4243 SMILES Strings for Integrase

Compound Name
SMILES String
Cc1ccc(cc1)-c1c(C)c2CN(Cc3ccc(F)cc3)Cc2c(C)c1C(OC(C)(C)C)C(O)=O |w:26.30|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3ccc(F)cc3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3cccc(F)c3F)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)NC1CCCCC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1C(OC(C)(C)C)C(O)=O)S(=O)(=O)c1cccc2ccccc12 |w:18.21|
Cc1ccc(cc1)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c(C(OC(C)(C)C)C(O)=O)c2C |w:23.26|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCCC1 |r|
Cc1c2CN(Cc3cccc(F)c3)Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O |r,wD:31.36,(-3.32,-1.52,;-1.99,-.75,;-1.99,.79,;-3.13,1.82,;-2.51,3.23,;-3.28,4.56,;-2.51,5.9,;-.97,5.9,;-.2,7.23,;-.97,8.56,;-2.51,8.56,;-3.28,9.9,;-3.28,7.23,;-.98,3.07,;-.66,1.56,;.68,.79,;2.01,1.56,;.68,-.75,;2.01,-1.52,;2.01,-3.06,;3.35,-3.83,;3.35,-5.37,;4.68,-3.06,;6.01,-3.83,;7.35,-3.06,;7.35,-1.52,;6.01,-.75,;4.68,-1.52,;3.35,-.75,;3.35,.79,;-.66,-1.52,;-.66,-3.06,;.68,-3.83,;.68,-5.37,;2.22,-5.37,;-.86,-5.37,;.68,-6.91,;-1.99,-3.83,;-3.32,-3.06,;-1.99,-5.37,)|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3ccccc3)Cc2c(C)c1C(OC(C)(C)C)C(O)=O |w:25.29|
Cc1ccc(cc1)-c1c(C)c2CN(CC3CCCCC3)Cc2c(C)c1C(OC(C)(C)C)C(O)=O |w:25.29|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3ccncc3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(CC3CCOCC3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3cccc4ccccc34)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C1CCC(C)(C)CC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1C(OC(C)(C)C)C(O)=O)S(C)(=O)=O |w:18.21|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1C(OC(C)(C)C)C(O)=O)C(=O)OCc1ccccc1 |w:18.21|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3ccc(Cl)cc3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
COc1ccc(CN2Cc3c(C2)c(C)c(-c2ccc(C)cc2)c([C@H](OC(C)(C)C)C(O)=O)c3C)cc1 |r|
Cc1ccc(CN2Cc3c(C2)c(C)c(-c2ccc(C)cc2)c([C@H](OC(C)(C)C)C(O)=O)c3C)cc1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3ccccc3F)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3cccc(F)c3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1c[nH]c(CN2Cc3c(C2)c(C)c(-c2ccc(C)cc2)c([C@H](OC(C)(C)C)C(O)=O)c3C)n1 |r|
COc1cccc(CN2Cc3c(C2)c(C)c(-c2ccc(C)cc2)c([C@H](OC(C)(C)C)C(O)=O)c3C)c1 |r|
CC(C)CN1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3ccc(Cl)c(Cl)c3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3ccc(cc3)C(F)(F)F)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3cccc(c3)C(F)(F)F)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3cccc(c3)-c3ccccc3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(CC3CCCCC3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C1CCCC(C1)c1ccccc1 |r|
C[C@@H]1CCCC(C1)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
C[C@H]1CC[C@@H](CC1)NC(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wU:4.7,wD:26.29,1.0,(-6.29,-8.79,;-5.52,-7.45,;-3.98,-7.45,;-3.21,-6.12,;-3.98,-4.79,;-5.52,-4.79,;-6.29,-6.12,;-3.21,-3.45,;-1.67,-3.45,;-.9,-4.79,;-.9,-2.12,;.63,-1.96,;.95,-.45,;-.38,.32,;-1.52,-.71,;-.38,1.86,;-1.71,2.63,;.95,2.63,;.95,4.17,;2.29,4.94,;2.29,6.48,;.95,7.25,;.95,8.79,;-.38,6.48,;-.38,4.94,;2.29,1.86,;3.62,2.63,;3.62,4.17,;4.95,4.94,;6.29,4.17,;4.95,6.48,;6.29,5.71,;4.95,1.86,;6.29,2.63,;4.95,.32,;2.29,.32,;3.62,-.45,)|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)NCc1ccccc1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)S(=O)(=O)C1CCCCC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(CCCc3cccc(F)c3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(CCc3ccccc3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(CC3CCCN3C(=O)OC(C)(C)C)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3cccnc3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3ccc(F)cc3F)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
CNC(=O)c1cccc(CN2Cc3c(C2)c(C)c(-c2ccc(C)cc2)c([C@H](OC(C)(C)C)C(O)=O)c3C)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3cccc(c3)C(=O)N3CCCCC3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3cccc(Cl)c3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3cccc(c3)N3CCOCC3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3cccc(F)c3C)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
COC(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)S(=O)(=O)c1ccc(F)cc1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)S(=O)(=O)N1CCCCC1 |r|
CC(C)NS(=O)(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)S(=O)(=O)N1CCOCC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3ccc(F)c(F)c3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
C[C@H]1CCC(CC1)NC(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:26.29,1.0,(-5.13,-9.45,;-4.36,-8.12,;-2.82,-8.12,;-2.05,-6.79,;-2.82,-5.45,;-4.36,-5.45,;-5.13,-6.79,;-2.05,-4.12,;-2.82,-2.79,;-4.36,-2.79,;-2.05,-1.45,;-.52,-1.29,;-.2,.21,;-1.54,.98,;-2.68,-.05,;-1.54,2.52,;-2.87,3.29,;-.2,3.29,;-.2,4.83,;1.13,5.6,;1.13,7.14,;-.2,7.91,;-.2,9.45,;-1.54,7.14,;-1.54,5.6,;1.13,2.52,;2.47,3.29,;2.47,4.83,;3.55,5.92,;5.04,5.53,;3.16,7.41,;4.64,7.01,;3.8,2.52,;5.13,3.29,;3.8,.98,;1.13,.98,;2.47,.21,)|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCOCC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)NCC1CCCCC1 |r|
CN(C)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCCCCC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC1 |r|
COCCN(C)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)NC(C)(C)C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCS(=O)(=O)CC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCC(F)(F)C1 |r|
CN(C1CCCCC1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(F)(F)C1 |r|
C[C@@H]1CCCCN1C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)NC1CCC1 |r|
CN1CCN(CC1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
C[C@@H]1COCCN1C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
C[C@H]1CN(C[C@H](C)O1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)NCC(C)(C)C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CC2CCC(C1)O2 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCOCC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CC[C@H](O)C1 |r|
CN(CC1CCCCC1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)NCCOCc1ccccc1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCN2CCC[C@@H]2C1 |r|
CC1CCN(CC1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CC2CCCC2C1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1[C@H]2CC[C@@H]1CC2 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(C)(C)CC1 |r|
CC(=O)N1CCN(CC1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCNCC1 |r|
C[C@H]1CCCN1C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
C[C@H]1CN([C@H](C)CO1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(F)CC1 |r|
CN1CCN(CC1=O)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
C[C@H]1COCCN1C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(F)(F)CC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCC(C)(C)C1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)NCC(F)(F)F |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(Cc2ccccc2)CC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CC[C@@H](F)C1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)NC(C)(C)c1ccccc1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(CC1)N1CCOCC1 |r|
C[C@H](NC(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C)C1CCCCC1 |r|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(F)(F)C1 |r,wD:23.27,(2.08,-1.44,;.75,-.67,;-.59,-1.44,;-.91,-2.94,;-2.44,-3.11,;-3.06,-1.7,;-1.92,-.67,;-1.92,.87,;-3.25,1.64,;-.59,1.64,;-.59,3.18,;.75,3.95,;.75,5.49,;2.08,6.26,;-.59,6.26,;-.59,7.8,;-1.92,8.57,;-3.25,7.8,;-3.25,6.26,;-1.92,5.49,;-1.92,3.95,;-3.25,3.18,;.75,.87,;2.08,1.64,;2.08,3.18,;3.41,3.95,;4.75,3.18,;3.41,5.49,;4.75,4.72,;3.41,.87,;4.75,1.64,;3.41,-.67,;-3.21,-4.44,;-4.75,-4.44,;-2.44,-5.77,;-2.91,-7.24,;-1.67,-8.14,;-.42,-7.24,;1.12,-7.24,;.35,-8.57,;-.9,-5.77,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCCC1 |r,wD:23.27,(2.08,-1.5,;.75,-.73,;-.59,-1.5,;-.91,-3.01,;-2.44,-3.17,;-3.06,-1.76,;-1.92,-.73,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;2.08,6.2,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;4.75,3.12,;3.41,5.43,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-5.84,;-3.21,-7.17,;-2.44,-8.51,;-.9,-8.51,;-.13,-7.17,;-.9,-5.84,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCC(F)(F)C1 |r,wD:23.27,(3.9,-2.84,;2.57,-2.07,;1.24,-2.84,;.92,-4.34,;-.62,-4.51,;-1.24,-3.1,;-.1,-2.07,;-.1,-.53,;-1.43,.24,;1.24,.24,;1.24,1.78,;2.57,2.55,;2.57,4.09,;3.9,4.86,;1.24,4.86,;1.24,6.4,;-.1,7.17,;-1.43,6.4,;-1.43,4.86,;-.1,4.09,;-.1,2.55,;-1.43,1.78,;2.57,-.53,;3.9,.24,;3.9,1.78,;5.24,2.55,;6.57,1.78,;5.24,4.09,;6.57,3.32,;5.24,-.53,;6.57,.24,;5.24,-2.07,;-1.39,-5.84,;-.62,-7.17,;-2.93,-5.84,;-3.7,-7.17,;-5.24,-7.17,;-6.01,-5.84,;-5.24,-4.51,;-5.24,-2.97,;-6.57,-3.74,;-3.7,-4.51,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r,wD:23.27,(3.62,-2.17,;2.29,-1.4,;.95,-2.17,;.63,-3.68,;-.9,-3.84,;-1.52,-2.43,;-.38,-1.4,;-.38,.14,;-1.71,.91,;.95,.91,;.95,2.45,;2.29,3.22,;2.29,4.76,;3.62,5.53,;.95,5.53,;.95,7.07,;-.38,7.84,;-1.71,7.07,;-1.71,5.53,;-.38,4.76,;-.38,3.22,;-1.71,2.45,;2.29,.14,;3.62,.91,;3.62,2.45,;4.95,3.22,;6.29,2.45,;4.95,4.76,;6.29,3.99,;4.95,.14,;6.29,.91,;4.95,-1.4,;-1.67,-5.17,;-.9,-6.51,;-3.21,-5.17,;-3.98,-3.84,;-5.52,-3.84,;-6.29,-5.17,;-5.52,-6.51,;-6.29,-7.84,;-3.98,-6.51,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)CC(C)(C)C |r,wD:23.27,(3.24,-2.17,;1.9,-1.4,;.57,-2.17,;.25,-3.68,;-1.28,-3.84,;-1.91,-2.43,;-.77,-1.4,;-.77,.14,;-2.1,.91,;.57,.91,;.57,2.45,;1.9,3.22,;1.9,4.76,;3.24,5.53,;.57,5.53,;.57,7.07,;-.77,7.84,;-2.1,7.07,;-2.1,5.53,;-.77,4.76,;-.77,3.22,;-2.1,2.45,;1.9,.14,;3.24,.91,;3.24,2.45,;4.57,3.22,;5.9,2.45,;4.57,4.76,;5.9,3.99,;4.57,.14,;5.9,.91,;4.57,-1.4,;-2.05,-5.17,;-1.28,-6.51,;-3.59,-5.17,;-4.36,-6.51,;-5.9,-6.51,;-3.59,-7.84,;-5.13,-7.84,)|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2OCCOc12 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)CN1CCCCC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)C1CCCCC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)C(C)(C)C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)CC(C)(C)C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)C1CCC(F)(F)CC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)C1CCCC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)C1CCC(F)(F)C1 |r|
COc1cccc(c1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(C)c(F)c1 |r|
COC1CCC(CC1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:26.29,(-.9,-9.45,;-.13,-8.12,;-.9,-6.79,;-2.44,-6.79,;-3.21,-5.45,;-2.44,-4.12,;-.9,-4.12,;-.13,-5.45,;-3.21,-2.79,;-4.75,-2.79,;-2.44,-1.45,;-.91,-1.29,;-.59,.21,;-1.92,.98,;-3.06,-.05,;-1.92,2.52,;-3.25,3.29,;-.59,3.29,;-.59,4.83,;-1.92,5.6,;-1.92,7.14,;-.59,7.91,;-.59,9.45,;.75,7.14,;.75,5.6,;.75,2.52,;2.08,3.29,;2.08,4.83,;3.17,5.92,;4.66,5.53,;2.77,7.41,;4.26,7.01,;3.41,2.52,;4.75,3.29,;3.41,.98,;.75,.98,;2.08,.21,)|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)CC1CCCCC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)C1CC2(CCC2)C1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(F)cc(F)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1F |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(F)ccc1C |r|
COc1cc(F)cc(c1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(C)cc(F)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CNCc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc3cccc4OCCOc34)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)OC(C)(C)C |r|
Cc1ccc(cc1)-c1c(C)c2CN(CC(=O)N3CCCCC3)Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=N)N1CCCCC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)C(=O)N1CCCCC1 |r|
C[C@@H]1COCCN1C(=O)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=S)N1CCCCC1 |r|
Cc1c2CN(Cc2c(C)c(-c2ccc(Cl)cc2)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCCC1 |r|
Cc1c2CN(Cc2c(C)c(-c2ccc(Cl)cc2)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r|
Cc1c2CN(Cc2c(C)c(-c2ccc(Cl)cc2)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)C1CCCCC1 |r|
Cc1c2CN(Cc2c(C)c(-c2ccc(Cl)cc2)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)CC(C)(C)C |r|
Cc1ccc(F)cc1C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:31.35,(-3.21,-7.84,;-3.98,-6.51,;-5.52,-6.51,;-6.29,-5.17,;-5.52,-3.84,;-6.29,-2.5,;-3.98,-3.84,;-3.21,-5.17,;-1.67,-5.17,;-.9,-6.51,;-.9,-3.84,;.63,-3.68,;.95,-2.17,;-.38,-1.4,;-1.52,-2.43,;-.38,.14,;-1.71,.91,;.95,.91,;.95,2.45,;2.29,3.22,;2.29,4.76,;3.62,5.53,;.95,5.53,;.95,7.07,;-.38,7.84,;-1.71,7.07,;-1.71,5.53,;-.38,4.76,;-.38,3.22,;-1.71,2.45,;2.29,.14,;3.62,.91,;3.62,2.45,;4.95,3.22,;4.95,4.76,;6.29,2.45,;6.29,3.99,;4.95,.14,;6.29,.91,;4.95,-1.4,;2.29,-1.4,;3.62,-2.17,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)C1CCCCC1 |r,wD:23.27,(3.62,-2.84,;2.29,-2.07,;.95,-2.84,;.63,-4.34,;-.9,-4.51,;-1.52,-3.1,;-.38,-2.07,;-.38,-.53,;-1.71,.24,;.95,.24,;.95,1.78,;2.29,2.55,;2.29,4.09,;3.62,4.86,;.95,4.86,;.95,6.4,;-.38,7.17,;-1.71,6.4,;-1.71,4.86,;-.38,4.09,;-.38,2.55,;-1.71,1.78,;2.29,-.53,;3.62,.24,;3.62,1.78,;4.95,2.55,;4.95,4.09,;6.29,1.78,;6.29,3.32,;4.95,-.53,;6.29,.24,;4.95,-2.07,;-1.67,-5.84,;-.9,-7.17,;-3.21,-5.84,;-3.98,-4.51,;-5.52,-4.51,;-6.29,-5.84,;-5.52,-7.17,;-3.98,-7.17,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2OCOc12 |r,wD:23.27,(3.62,-1.65,;2.29,-.88,;.95,-1.65,;.63,-3.16,;-.9,-3.32,;-1.52,-1.91,;-.38,-.88,;-.38,.66,;-1.71,1.43,;.95,1.43,;.95,2.97,;2.29,3.74,;2.29,5.28,;3.62,6.05,;.95,6.05,;.95,7.59,;-.38,8.36,;-1.71,7.59,;-1.71,6.05,;-.38,5.28,;-.38,3.74,;-1.71,2.97,;2.29,.66,;3.62,1.43,;3.62,2.97,;4.95,3.74,;4.95,5.28,;6.29,2.97,;6.29,4.51,;4.95,.66,;6.29,1.43,;4.95,-.88,;-1.67,-4.65,;-.9,-5.99,;-3.21,-4.65,;-3.98,-3.32,;-5.52,-3.32,;-6.29,-4.65,;-5.52,-5.99,;-5.99,-7.45,;-4.75,-8.36,;-3.5,-7.45,;-3.98,-5.99,)|
COc1cccc(C(=O)N2Cc3c(C2)c(C)c(-c2cc(F)c4OCCCc4c2C)c([C@H](OC(C)(C)C)C(O)=O)c3C)c1C |r,wD:30.33,(-4.75,-9.17,;-3.21,-9.17,;-2.44,-7.84,;-.9,-7.84,;-.13,-6.51,;-.9,-5.17,;-2.44,-5.17,;-3.21,-3.84,;-4.75,-3.84,;-2.44,-2.5,;-.91,-2.34,;-.59,-.84,;-1.92,-.07,;-3.06,-1.1,;-1.92,1.47,;-3.25,2.24,;-.59,2.24,;-.59,3.78,;.75,4.55,;.75,6.09,;2.08,6.86,;-.59,6.86,;-.59,8.4,;-1.92,9.17,;-3.25,8.4,;-3.25,6.86,;-1.92,6.09,;-1.92,4.55,;-3.25,3.78,;.75,1.47,;2.08,2.24,;2.08,3.78,;3.41,4.55,;3.41,6.09,;4.75,3.78,;4.75,5.32,;3.41,1.47,;4.75,2.24,;3.41,-.07,;.75,-.07,;2.08,-.84,;-3.21,-6.51,;-4.75,-6.51,)|
COc1cc(F)cc(c1)C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:32.36,(2.24,-5.17,;1.47,-6.51,;-.07,-6.51,;-.9,-7.84,;-2.44,-7.84,;-3.21,-9.17,;-3.21,-6.51,;-2.44,-5.17,;-.9,-5.17,;-3.21,-3.84,;-4.75,-3.84,;-2.44,-2.5,;-.91,-2.34,;-.59,-.84,;-1.92,-.07,;-3.06,-1.1,;-1.92,1.47,;-3.25,2.24,;-.59,2.24,;-.59,3.78,;.75,4.55,;.75,6.09,;2.08,6.86,;-.59,6.86,;-.59,8.4,;-1.92,9.17,;-3.25,8.4,;-3.25,6.86,;-1.92,6.09,;-1.92,4.55,;-3.25,3.78,;.75,1.47,;2.08,2.24,;2.08,3.78,;3.41,4.55,;3.41,6.09,;4.75,3.78,;4.75,5.32,;3.41,1.47,;4.75,2.24,;3.41,-.07,;.75,-.07,;2.08,-.84,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1C |r,wD:23.27,(2.08,-.84,;.75,-.07,;-.59,-.84,;-.91,-2.34,;-2.44,-2.5,;-3.06,-1.1,;-1.92,-.07,;-1.92,1.47,;-3.25,2.24,;-.59,2.24,;-.59,3.78,;.75,4.55,;.75,6.09,;2.08,6.86,;-.59,6.86,;-.59,8.4,;-1.92,9.17,;-3.25,8.4,;-3.25,6.86,;-1.92,6.09,;-1.92,4.55,;-3.25,3.78,;.75,1.47,;2.08,2.24,;2.08,3.78,;3.41,4.55,;3.41,6.09,;4.75,3.78,;4.75,5.32,;3.41,1.47,;4.75,2.24,;3.41,-.07,;-3.21,-3.84,;-4.75,-3.84,;-2.44,-5.17,;-.9,-5.17,;-.13,-6.51,;-.9,-7.84,;-2.44,-7.84,;-3.21,-9.17,;-3.21,-6.51,;-4.75,-6.51,)|
Cc1ncccc1C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:30.34,(-4.75,-7.17,;-3.21,-7.17,;-2.44,-8.51,;-.9,-8.51,;-.13,-7.17,;-.9,-5.84,;-2.44,-5.84,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-3.17,;-.91,-3.01,;-.59,-1.5,;-1.92,-.73,;-3.06,-1.76,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;2.08,6.2,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;3.41,5.43,;4.75,3.12,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;.75,-.73,;2.08,-1.5,)|
COc1cncc(c1)C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:31.35,(2.24,-5.84,;1.47,-7.17,;-.07,-7.17,;-.9,-8.51,;-2.44,-8.51,;-3.21,-7.17,;-2.44,-5.84,;-.9,-5.84,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-3.17,;-.91,-3.01,;-.59,-1.5,;-1.92,-.73,;-3.06,-1.76,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;2.08,6.2,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;3.41,5.43,;4.75,3.12,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;.75,-.73,;2.08,-1.5,)|
Cc1ccc(cc1F)C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:31.35,(-.13,-9.17,;-.9,-7.84,;-.13,-6.51,;-.9,-5.17,;-2.44,-5.17,;-3.21,-6.51,;-2.44,-7.84,;-3.21,-9.17,;-3.21,-3.84,;-4.75,-3.84,;-2.44,-2.5,;-.91,-2.34,;-.59,-.84,;-1.92,-.07,;-3.06,-1.1,;-1.92,1.47,;-3.25,2.24,;-.59,2.24,;-.59,3.78,;.75,4.55,;.75,6.09,;2.08,6.86,;-.59,6.86,;-.59,8.4,;-1.92,9.17,;-3.25,8.4,;-3.25,6.86,;-1.92,6.09,;-1.92,4.55,;-3.25,3.78,;.75,1.47,;2.08,2.24,;2.08,3.78,;3.41,4.55,;3.41,6.09,;4.75,3.78,;4.75,5.32,;3.41,1.47,;4.75,2.24,;3.41,-.07,;.75,-.07,;2.08,-.84,)|
Cc1cc(ccc1F)C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:31.35,(-3.21,-9.17,;-2.44,-7.84,;-3.21,-6.51,;-2.44,-5.17,;-.9,-5.17,;-.13,-6.51,;-.9,-7.84,;-.13,-9.17,;-3.21,-3.84,;-4.75,-3.84,;-2.44,-2.5,;-.91,-2.34,;-.59,-.84,;-1.92,-.07,;-3.06,-1.1,;-1.92,1.47,;-3.25,2.24,;-.59,2.24,;-.59,3.78,;.75,4.55,;.75,6.09,;2.08,6.86,;-.59,6.86,;-.59,8.4,;-1.92,9.17,;-3.25,8.4,;-3.25,6.86,;-1.92,6.09,;-1.92,4.55,;-3.25,3.78,;.75,1.47,;2.08,2.24,;2.08,3.78,;3.41,4.55,;3.41,6.09,;4.75,3.78,;4.75,5.32,;3.41,1.47,;4.75,2.24,;3.41,-.07,;.75,-.07,;2.08,-.84,)|
Cc1ccccc1C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:30.34,(-4.75,-7.17,;-3.21,-7.17,;-2.44,-8.51,;-.9,-8.51,;-.13,-7.17,;-.9,-5.84,;-2.44,-5.84,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-3.17,;-.91,-3.01,;-.59,-1.5,;-1.92,-.73,;-3.06,-1.76,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;2.08,6.2,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;3.41,5.43,;4.75,3.12,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;.75,-.73,;2.08,-1.5,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(Cl)c1 |r,wD:23.27,(2.08,-.84,;.75,-.07,;-.59,-.84,;-.91,-2.34,;-2.44,-2.5,;-3.06,-1.1,;-1.92,-.07,;-1.92,1.47,;-3.25,2.24,;-.59,2.24,;-.59,3.78,;.75,4.55,;.75,6.09,;2.08,6.86,;-.59,6.86,;-.59,8.4,;-1.92,9.17,;-3.25,8.4,;-3.25,6.86,;-1.92,6.09,;-1.92,4.55,;-3.25,3.78,;.75,1.47,;2.08,2.24,;2.08,3.78,;3.41,4.55,;3.41,6.09,;4.75,3.78,;4.75,5.32,;3.41,1.47,;4.75,2.24,;3.41,-.07,;-3.21,-3.84,;-4.75,-3.84,;-2.44,-5.17,;-.9,-5.17,;-.13,-6.51,;-.9,-7.84,;-2.44,-7.84,;-3.21,-9.17,;-3.21,-6.51,)|
COc1cccc(C(=O)N2Cc3c(C2)c(C)c(-c2cc(F)c4OCCCc4c2C)c([C@H](OC(C)(C)C)C(O)=O)c3C)c1F |r,wD:30.33,(-4.75,-9.17,;-3.21,-9.17,;-2.44,-7.84,;-.9,-7.84,;-.13,-6.51,;-.9,-5.17,;-2.44,-5.17,;-3.21,-3.84,;-4.75,-3.84,;-2.44,-2.5,;-.91,-2.34,;-.59,-.84,;-1.92,-.07,;-3.06,-1.1,;-1.92,1.47,;-3.25,2.24,;-.59,2.24,;-.59,3.78,;.75,4.55,;.75,6.09,;2.08,6.86,;-.59,6.86,;-.59,8.4,;-1.92,9.17,;-3.25,8.4,;-3.25,6.86,;-1.92,6.09,;-1.92,4.55,;-3.25,3.78,;.75,1.47,;2.08,2.24,;2.08,3.78,;3.41,4.55,;3.41,6.09,;4.75,3.78,;4.75,5.32,;3.41,1.47,;4.75,2.24,;3.41,-.07,;.75,-.07,;2.08,-.84,;-3.21,-6.51,;-4.75,-6.51,)|
Cc1cccc(c1)C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:30.34,(-3.21,-9.17,;-2.44,-7.84,;-.9,-7.84,;-.13,-6.51,;-.9,-5.17,;-2.44,-5.17,;-3.21,-6.51,;-3.21,-3.84,;-4.75,-3.84,;-2.44,-2.5,;-.91,-2.34,;-.59,-.84,;-1.92,-.07,;-3.06,-1.1,;-1.92,1.47,;-3.25,2.24,;-.59,2.24,;-.59,3.78,;.75,4.55,;.75,6.09,;2.08,6.86,;-.59,6.86,;-.59,8.4,;-1.92,9.17,;-3.25,8.4,;-3.25,6.86,;-1.92,6.09,;-1.92,4.55,;-3.25,3.78,;.75,1.47,;2.08,2.24,;2.08,3.78,;3.41,4.55,;3.41,6.09,;4.75,3.78,;4.75,5.32,;3.41,1.47,;4.75,2.24,;3.41,-.07,;.75,-.07,;2.08,-.84,)|
COc1ccc(F)cc1C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:32.36,(-5.52,-5.84,;-4.75,-7.17,;-3.21,-7.17,;-2.44,-8.51,;-.9,-8.51,;-.13,-7.17,;1.41,-7.17,;-.9,-5.84,;-2.44,-5.84,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-3.17,;-.91,-3.01,;-.59,-1.5,;-1.92,-.73,;-3.06,-1.76,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;2.08,6.2,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;3.41,5.43,;4.75,3.12,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;.75,-.73,;2.08,-1.5,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2sccc12 |r,wD:23.27,(2.08,-1.5,;.75,-.73,;-.59,-1.5,;-.91,-3.01,;-2.44,-3.17,;-3.06,-1.76,;-1.92,-.73,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;2.08,6.2,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;3.41,5.43,;4.75,3.12,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-5.84,;-3.21,-7.17,;-2.44,-8.51,;-.9,-8.51,;-.13,-7.17,;1.38,-6.85,;1.54,-5.32,;.13,-4.69,;-.9,-5.84,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2CCOc12 |r,wD:23.27,(2.08,-1.5,;.75,-.73,;-.59,-1.5,;-.91,-3.01,;-2.44,-3.17,;-3.06,-1.76,;-1.92,-.73,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;2.08,6.2,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;3.41,5.43,;4.75,3.12,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-5.84,;-3.21,-7.17,;-2.44,-8.51,;-.9,-8.51,;-.13,-7.17,;1.38,-6.85,;1.54,-5.32,;.13,-4.69,;-.9,-5.84,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2OCCOc12 |r,wD:23.27,(2.08,-1.5,;.75,-.73,;-.59,-1.5,;-.91,-3.01,;-2.44,-3.17,;-3.06,-1.76,;-1.92,-.73,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;2.08,6.2,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;3.41,5.43,;4.75,3.12,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-5.84,;-3.21,-7.17,;-2.44,-8.51,;-.9,-8.51,;-.13,-7.17,;1.41,-7.17,;2.18,-5.84,;1.41,-4.51,;-.13,-4.51,;-.9,-5.84,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc2n(C)ncc2c1 |r,wD:23.27,(2.08,-.19,;.75,.58,;-.59,-.19,;-.91,-1.69,;-2.44,-1.86,;-3.06,-.45,;-1.92,.58,;-1.92,2.12,;-3.25,2.89,;-.59,2.89,;-.59,4.43,;.75,5.2,;.75,6.74,;2.08,7.51,;-.59,7.51,;-.59,9.05,;-1.92,9.82,;-3.25,9.05,;-3.25,7.51,;-1.92,6.74,;-1.92,5.2,;-3.25,4.43,;.75,2.12,;2.08,2.89,;2.08,4.43,;3.41,5.2,;3.41,6.74,;4.75,4.43,;4.75,5.97,;3.41,2.12,;4.75,2.89,;3.41,.58,;-3.21,-3.19,;-4.75,-3.19,;-2.44,-4.52,;-3.21,-5.86,;-2.44,-7.19,;-.9,-7.19,;.13,-8.33,;-.27,-9.82,;1.54,-7.71,;1.38,-6.18,;-.13,-5.86,;-.9,-4.52,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccccc1C(C)(C)C |r,wD:23.27,(3.62,-1.5,;2.29,-.73,;.95,-1.5,;.63,-3.01,;-.9,-3.17,;-1.52,-1.76,;-.38,-.73,;-.38,.81,;-1.71,1.58,;.95,1.58,;.95,3.12,;2.29,3.89,;2.29,5.43,;3.62,6.2,;.95,6.2,;.95,7.74,;-.38,8.51,;-1.71,7.74,;-1.71,6.2,;-.38,5.43,;-.38,3.89,;-1.71,3.12,;2.29,.81,;3.62,1.58,;3.62,3.12,;4.95,3.89,;4.95,5.43,;6.29,3.12,;6.29,4.66,;4.95,.81,;6.29,1.58,;4.95,-.73,;-1.67,-4.51,;-.9,-5.84,;-3.21,-4.51,;-3.98,-3.17,;-5.52,-3.17,;-6.29,-4.51,;-5.52,-5.84,;-3.98,-5.84,;-3.21,-7.17,;-3.98,-8.51,;-1.67,-7.17,;-2.44,-8.51,)|
COc1cc(ccc1C)C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:32.36,(-7.06,-3.17,;-5.52,-3.17,;-4.75,-4.51,;-3.21,-4.51,;-2.44,-5.84,;-3.21,-7.17,;-4.75,-7.17,;-5.52,-5.84,;-7.06,-5.84,;-.9,-5.84,;-.13,-7.17,;-.13,-4.51,;1.4,-4.34,;1.72,-2.84,;.39,-2.07,;-.75,-3.1,;.39,-.53,;-.94,.24,;1.72,.24,;1.72,1.78,;3.06,2.55,;3.06,4.09,;4.39,4.86,;1.72,4.86,;1.72,6.4,;.39,7.17,;-.94,6.4,;-.94,4.86,;.39,4.09,;.39,2.55,;-.94,1.78,;3.06,-.53,;4.39,.24,;4.39,1.78,;5.72,2.55,;5.72,4.09,;7.06,1.78,;7.06,3.32,;5.72,-.53,;7.06,.24,;5.72,-2.07,;3.06,-2.07,;4.39,-2.84,)|
Cc1ccc(C)c(c1)C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:31.35,(-6.29,-2.5,;-5.52,-3.84,;-6.29,-5.17,;-5.52,-6.51,;-3.98,-6.51,;-3.21,-7.84,;-3.21,-5.17,;-3.98,-3.84,;-1.67,-5.17,;-.9,-6.51,;-.9,-3.84,;.63,-3.68,;.95,-2.17,;-.38,-1.4,;-1.52,-2.43,;-.38,.14,;-1.71,.91,;.95,.91,;.95,2.45,;2.29,3.22,;2.29,4.76,;3.62,5.53,;.95,5.53,;.95,7.07,;-.38,7.84,;-1.71,7.07,;-1.71,5.53,;-.38,4.76,;-.38,3.22,;-1.71,2.45,;2.29,.14,;3.62,.91,;3.62,2.45,;4.95,3.22,;4.95,4.76,;6.29,2.45,;6.29,3.99,;4.95,.14,;6.29,.91,;4.95,-1.4,;2.29,-1.4,;3.62,-2.17,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccccc1 |r,wD:23.27,(3.62,-2.84,;2.29,-2.07,;.95,-2.84,;.63,-4.34,;-.9,-4.51,;-1.52,-3.1,;-.38,-2.07,;-.38,-.53,;-1.71,.24,;.95,.24,;.95,1.78,;2.29,2.55,;2.29,4.09,;3.62,4.86,;.95,4.86,;.95,6.4,;-.38,7.17,;-1.71,6.4,;-1.71,4.86,;-.38,4.09,;-.38,2.55,;-1.71,1.78,;2.29,-.53,;3.62,.24,;3.62,1.78,;4.95,2.55,;4.95,4.09,;6.29,1.78,;6.29,3.32,;4.95,-.53,;6.29,.24,;4.95,-2.07,;-1.67,-5.84,;-.9,-7.17,;-3.21,-5.84,;-3.98,-4.51,;-5.52,-4.51,;-6.29,-5.84,;-5.52,-7.17,;-3.98,-7.17,)|
COc1cccc(c1)C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:31.35,(-7.06,-3.17,;-5.52,-3.17,;-4.75,-4.51,;-5.52,-5.84,;-4.75,-7.17,;-3.21,-7.17,;-2.44,-5.84,;-3.21,-4.51,;-.9,-5.84,;-.13,-7.17,;-.13,-4.51,;1.4,-4.34,;1.72,-2.84,;.39,-2.07,;-.75,-3.1,;.39,-.53,;-.94,.24,;1.72,.24,;1.72,1.78,;3.06,2.55,;3.06,4.09,;4.39,4.86,;1.72,4.86,;1.72,6.4,;.39,7.17,;-.94,6.4,;-.94,4.86,;.39,4.09,;.39,2.55,;-.94,1.78,;3.06,-.53,;4.39,.24,;4.39,1.78,;5.72,2.55,;5.72,4.09,;7.06,1.78,;7.06,3.32,;5.72,-.53,;7.06,.24,;5.72,-2.07,;3.06,-2.07,;4.39,-2.84,)|
COc1ccc(C)c(c1)C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:32.36,(-5.52,-1.17,;-6.29,-2.5,;-5.52,-3.84,;-6.29,-5.17,;-5.52,-6.51,;-3.98,-6.51,;-3.21,-7.84,;-3.21,-5.17,;-3.98,-3.84,;-1.67,-5.17,;-.9,-6.51,;-.9,-3.84,;.63,-3.68,;.95,-2.17,;-.38,-1.4,;-1.52,-2.43,;-.38,.14,;-1.71,.91,;.95,.91,;.95,2.45,;2.29,3.22,;2.29,4.76,;3.62,5.53,;.95,5.53,;.95,7.07,;-.38,7.84,;-1.71,7.07,;-1.71,5.53,;-.38,4.76,;-.38,3.22,;-1.71,2.45,;2.29,.14,;3.62,.91,;3.62,2.45,;4.95,3.22,;4.95,4.76,;6.29,2.45,;6.29,3.99,;4.95,.14,;6.29,.91,;4.95,-1.4,;2.29,-1.4,;3.62,-2.17,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2CCCc12 |r,wD:23.27,(3.62,-2.84,;2.29,-2.07,;.95,-2.84,;.63,-4.34,;-.9,-4.51,;-1.52,-3.1,;-.38,-2.07,;-.38,-.53,;-1.71,.24,;.95,.24,;.95,1.78,;2.29,2.55,;2.29,4.09,;3.62,4.86,;.95,4.86,;.95,6.4,;-.38,7.17,;-1.71,6.4,;-1.71,4.86,;-.38,4.09,;-.38,2.55,;-1.71,1.78,;2.29,-.53,;3.62,.24,;3.62,1.78,;4.95,2.55,;4.95,4.09,;6.29,1.78,;6.29,3.32,;4.95,-.53,;6.29,.24,;4.95,-2.07,;-1.67,-5.84,;-.9,-7.17,;-3.21,-5.84,;-3.98,-7.17,;-5.52,-7.17,;-6.29,-5.84,;-5.52,-4.51,;-5.99,-3.04,;-4.75,-2.14,;-3.5,-3.04,;-3.98,-4.51,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2OC(F)(F)Oc12 |r,wD:23.27,(2.08,-1.5,;.75,-.73,;-.59,-1.5,;-.91,-3.01,;-2.44,-3.17,;-3.06,-1.76,;-1.92,-.73,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;2.08,6.2,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;3.41,5.43,;4.75,3.12,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-5.84,;-3.21,-7.17,;-2.44,-8.51,;-.9,-8.51,;-.13,-7.17,;1.38,-6.85,;1.54,-5.32,;3.08,-5.32,;1.94,-3.83,;.13,-4.69,;-.9,-5.84,)|
COc1ccccc1C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2CCOc12 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2n(C)ccc12 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2sccc12 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2ccoc12 |r|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2ccccc12 |r,wD:23.27,(3.62,-2.84,;2.29,-2.07,;.95,-2.84,;.63,-4.34,;-.9,-4.51,;-1.52,-3.1,;-.38,-2.07,;-.38,-.53,;-1.71,.24,;.95,.24,;.95,1.78,;2.29,2.55,;2.29,4.09,;3.62,4.86,;.95,4.86,;.95,6.4,;-.38,7.17,;-1.71,6.4,;-1.71,4.86,;-.38,4.09,;-.38,2.55,;-1.71,1.78,;2.29,-.53,;3.62,.24,;3.62,1.78,;4.95,2.55,;4.95,4.09,;6.29,1.78,;6.29,3.32,;4.95,-.53,;6.29,.24,;4.95,-2.07,;-1.67,-5.84,;-.9,-7.17,;-3.21,-5.84,;-3.98,-7.17,;-5.52,-7.17,;-6.29,-5.84,;-5.52,-4.51,;-6.29,-3.17,;-5.52,-1.84,;-3.98,-1.84,;-3.21,-3.17,;-3.98,-4.51,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2ccoc12 |r,wD:23.27,(3.62,-2.84,;2.29,-2.07,;.95,-2.84,;.63,-4.34,;-.9,-4.51,;-1.52,-3.1,;-.38,-2.07,;-.38,-.53,;-1.71,.24,;.95,.24,;.95,1.78,;2.29,2.55,;2.29,4.09,;3.62,4.86,;.95,4.86,;.95,6.4,;-.38,7.17,;-1.71,6.4,;-1.71,4.86,;-.38,4.09,;-.38,2.55,;-1.71,1.78,;2.29,-.53,;3.62,.24,;3.62,1.78,;4.95,2.55,;4.95,4.09,;6.29,1.78,;6.29,3.32,;4.95,-.53,;6.29,.24,;4.95,-2.07,;-1.67,-5.84,;-.9,-7.17,;-3.21,-5.84,;-3.98,-7.17,;-5.52,-7.17,;-6.29,-5.84,;-5.52,-4.51,;-5.99,-3.04,;-4.75,-2.14,;-3.5,-3.04,;-3.98,-4.51,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(F)cc(F)c1 |r,wD:23.27,(3.62,-2.17,;2.29,-1.4,;.95,-2.17,;.63,-3.68,;-.9,-3.84,;-1.52,-2.43,;-.38,-1.4,;-.38,.14,;-1.71,.91,;.95,.91,;.95,2.45,;2.29,3.22,;2.29,4.76,;3.62,5.53,;.95,5.53,;.95,7.07,;-.38,7.84,;-1.71,7.07,;-1.71,5.53,;-.38,4.76,;-.38,3.22,;-1.71,2.45,;2.29,.14,;3.62,.91,;3.62,2.45,;4.95,3.22,;4.95,4.76,;6.29,2.45,;6.29,3.99,;4.95,.14,;6.29,.91,;4.95,-1.4,;-1.67,-5.17,;-.9,-6.51,;-3.21,-5.17,;-3.98,-3.84,;-5.52,-3.84,;-6.29,-2.5,;-6.29,-5.17,;-5.52,-6.51,;-6.29,-7.84,;-3.98,-6.51,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(F)c(Cl)c1 |r,wD:23.27,(4.39,-2.84,;3.06,-2.07,;1.72,-2.84,;1.4,-4.34,;-.13,-4.51,;-.75,-3.1,;.39,-2.07,;.39,-.53,;-.94,.24,;1.72,.24,;1.72,1.78,;3.06,2.55,;3.06,4.09,;4.39,4.86,;1.72,4.86,;1.72,6.4,;.39,7.17,;-.94,6.4,;-.94,4.86,;.39,4.09,;.39,2.55,;-.94,1.78,;3.06,-.53,;4.39,.24,;4.39,1.78,;5.72,2.55,;5.72,4.09,;7.06,1.78,;7.06,3.32,;5.72,-.53,;7.06,.24,;5.72,-2.07,;-.9,-5.84,;-.13,-7.17,;-2.44,-5.84,;-3.21,-7.17,;-4.75,-7.17,;-5.52,-5.84,;-7.06,-5.84,;-4.75,-4.51,;-5.52,-3.17,;-3.21,-4.51,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(Cl)c1C |r,wD:23.27,(3.62,-2.17,;2.29,-1.4,;.95,-2.17,;.63,-3.68,;-.9,-3.84,;-1.52,-2.43,;-.38,-1.4,;-.38,.14,;-1.71,.91,;.95,.91,;.95,2.45,;2.29,3.22,;2.29,4.76,;3.62,5.53,;.95,5.53,;.95,7.07,;-.38,7.84,;-1.71,7.07,;-1.71,5.53,;-.38,4.76,;-.38,3.22,;-1.71,2.45,;2.29,.14,;3.62,.91,;3.62,2.45,;4.95,3.22,;4.95,4.76,;6.29,2.45,;6.29,3.99,;4.95,.14,;6.29,.91,;4.95,-1.4,;-1.67,-5.17,;-.9,-6.51,;-3.21,-5.17,;-3.98,-3.84,;-5.52,-3.84,;-6.29,-5.17,;-5.52,-6.51,;-6.29,-7.84,;-3.98,-6.51,;-3.21,-7.84,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(F)c(F)c(F)c1 |r,wD:23.27,(4.39,-2.17,;3.06,-1.4,;1.72,-2.17,;1.4,-3.68,;-.13,-3.84,;-.75,-2.43,;.39,-1.4,;.39,.14,;-.94,.91,;1.72,.91,;1.72,2.45,;3.06,3.22,;3.06,4.76,;4.39,5.53,;1.72,5.53,;1.72,7.07,;.39,7.84,;-.94,7.07,;-.94,5.53,;.39,4.76,;.39,3.22,;-.94,2.45,;3.06,.14,;4.39,.91,;4.39,2.45,;5.72,3.22,;5.72,4.76,;7.06,2.45,;7.06,3.99,;5.72,.14,;7.06,.91,;5.72,-1.4,;-.9,-5.17,;-.13,-6.51,;-2.44,-5.17,;-3.21,-3.84,;-4.75,-3.84,;-5.52,-2.5,;-5.52,-5.17,;-7.06,-5.17,;-4.75,-6.51,;-5.52,-7.84,;-3.21,-6.51,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(F)cc1 |r,wD:23.27,(4.39,-2.84,;3.06,-2.07,;1.72,-2.84,;1.4,-4.34,;-.13,-4.51,;-.75,-3.1,;.39,-2.07,;.39,-.53,;-.94,.24,;1.72,.24,;1.72,1.78,;3.06,2.55,;3.06,4.09,;4.39,4.86,;1.72,4.86,;1.72,6.4,;.39,7.17,;-.94,6.4,;-.94,4.86,;.39,4.09,;.39,2.55,;-.94,1.78,;3.06,-.53,;4.39,.24,;4.39,1.78,;5.72,2.55,;5.72,4.09,;7.06,1.78,;7.06,3.32,;5.72,-.53,;7.06,.24,;5.72,-2.07,;-.9,-5.84,;-.13,-7.17,;-2.44,-5.84,;-3.21,-4.51,;-4.75,-4.51,;-5.52,-5.84,;-7.06,-5.84,;-4.75,-7.17,;-3.21,-7.17,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(F)c(Cl)c(F)c1 |r,wD:23.27,(4.39,-2.17,;3.06,-1.4,;1.72,-2.17,;1.4,-3.68,;-.13,-3.84,;-.75,-2.43,;.39,-1.4,;.39,.14,;-.94,.91,;1.72,.91,;1.72,2.45,;3.06,3.22,;3.06,4.76,;4.39,5.53,;1.72,5.53,;1.72,7.07,;.39,7.84,;-.94,7.07,;-.94,5.53,;.39,4.76,;.39,3.22,;-.94,2.45,;3.06,.14,;4.39,.91,;4.39,2.45,;5.72,3.22,;5.72,4.76,;7.06,2.45,;7.06,3.99,;5.72,.14,;7.06,.91,;5.72,-1.4,;-.9,-5.17,;-.13,-6.51,;-2.44,-5.17,;-3.21,-3.84,;-4.75,-3.84,;-5.52,-2.5,;-5.52,-5.17,;-7.06,-5.17,;-4.75,-6.51,;-5.52,-7.84,;-3.21,-6.51,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1F |r,wD:23.27,(3.62,-2.17,;2.29,-1.4,;.95,-2.17,;.63,-3.68,;-.9,-3.84,;-1.52,-2.43,;-.38,-1.4,;-.38,.14,;-1.71,.91,;.95,.91,;.95,2.45,;2.29,3.22,;2.29,4.76,;3.62,5.53,;.95,5.53,;.95,7.07,;-.38,7.84,;-1.71,7.07,;-1.71,5.53,;-.38,4.76,;-.38,3.22,;-1.71,2.45,;2.29,.14,;3.62,.91,;3.62,2.45,;4.95,3.22,;4.95,4.76,;6.29,2.45,;6.29,3.99,;4.95,.14,;6.29,.91,;4.95,-1.4,;-1.67,-5.17,;-.9,-6.51,;-3.21,-5.17,;-3.98,-3.84,;-5.52,-3.84,;-6.29,-5.17,;-5.52,-6.51,;-6.29,-7.84,;-3.98,-6.51,;-3.21,-7.84,)|
Cc1cc(F)cc(c1)C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:31.35,(-6.29,-7.84,;-5.52,-6.51,;-6.29,-5.17,;-5.52,-3.84,;-6.29,-2.5,;-3.98,-3.84,;-3.21,-5.17,;-3.98,-6.51,;-1.67,-5.17,;-.9,-6.51,;-.9,-3.84,;.63,-3.68,;.95,-2.17,;-.38,-1.4,;-1.52,-2.43,;-.38,.14,;-1.71,.91,;.95,.91,;.95,2.45,;2.29,3.22,;2.29,4.76,;3.62,5.53,;.95,5.53,;.95,7.07,;-.38,7.84,;-1.71,7.07,;-1.71,5.53,;-.38,4.76,;-.38,3.22,;-1.71,2.45,;2.29,.14,;3.62,.91,;3.62,2.45,;4.95,3.22,;4.95,4.76,;6.29,2.45,;6.29,3.99,;4.95,.14,;6.29,.91,;4.95,-1.4,;2.29,-1.4,;3.62,-2.17,)|
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Cc1cccc(F)c1C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:31.35,(-3.21,-7.84,;-3.98,-6.51,;-5.52,-6.51,;-6.29,-5.17,;-5.52,-3.84,;-3.98,-3.84,;-3.21,-2.5,;-3.21,-5.17,;-1.67,-5.17,;-.9,-6.51,;-.9,-3.84,;.63,-3.68,;.95,-2.17,;-.38,-1.4,;-1.52,-2.43,;-.38,.14,;-1.71,.91,;.95,.91,;.95,2.45,;2.29,3.22,;2.29,4.76,;3.62,5.53,;.95,5.53,;.95,7.07,;-.38,7.84,;-1.71,7.07,;-1.71,5.53,;-.38,4.76,;-.38,3.22,;-1.71,2.45,;2.29,.14,;3.62,.91,;3.62,2.45,;4.95,3.22,;4.95,4.76,;6.29,2.45,;6.29,3.99,;4.95,.14,;6.29,.91,;4.95,-1.4,;2.29,-1.4,;3.62,-2.17,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(Cl)cc1 |r,wD:23.27,(4.39,-2.84,;3.06,-2.07,;1.72,-2.84,;1.4,-4.34,;-.13,-4.51,;-.75,-3.1,;.39,-2.07,;.39,-.53,;-.94,.24,;1.72,.24,;1.72,1.78,;3.06,2.55,;3.06,4.09,;4.39,4.86,;1.72,4.86,;1.72,6.4,;.39,7.17,;-.94,6.4,;-.94,4.86,;.39,4.09,;.39,2.55,;-.94,1.78,;3.06,-.53,;4.39,.24,;4.39,1.78,;5.72,2.55,;5.72,4.09,;7.06,1.78,;7.06,3.32,;5.72,-.53,;7.06,.24,;5.72,-2.07,;-.9,-5.84,;-.13,-7.17,;-2.44,-5.84,;-3.21,-4.51,;-4.75,-4.51,;-5.52,-5.84,;-7.06,-5.84,;-4.75,-7.17,;-3.21,-7.17,)|
COc1ccccc1C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:31.35,(-3.98,-8.51,;-3.21,-7.17,;-3.98,-5.84,;-5.52,-5.84,;-6.29,-4.51,;-5.52,-3.17,;-3.98,-3.17,;-3.21,-4.51,;-1.67,-4.51,;-.9,-5.84,;-.9,-3.17,;.63,-3.01,;.95,-1.5,;-.38,-.73,;-1.52,-1.76,;-.38,.81,;-1.71,1.58,;.95,1.58,;.95,3.12,;2.29,3.89,;2.29,5.43,;3.62,6.2,;.95,6.2,;.95,7.74,;-.38,8.51,;-1.71,7.74,;-1.71,6.2,;-.38,5.43,;-.38,3.89,;-1.71,3.12,;2.29,.81,;3.62,1.58,;3.62,3.12,;4.95,3.89,;4.95,5.43,;6.29,3.12,;6.29,4.66,;4.95,.81,;6.29,1.58,;4.95,-.73,;2.29,-.73,;3.62,-1.5,)|
COc1cc(C)ccc1C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:32.36,(-.87,-7.89,;-2.41,-7.89,;-3.18,-6.55,;-4.75,-6.51,;-5.52,-5.17,;-7.06,-5.17,;-4.75,-3.84,;-3.21,-3.84,;-2.44,-5.17,;-.9,-5.17,;-.13,-6.51,;-.13,-3.84,;1.4,-3.68,;1.72,-2.17,;.39,-1.4,;-.75,-2.43,;.39,.14,;-.94,.91,;1.72,.91,;1.72,2.45,;3.06,3.22,;3.06,4.76,;4.39,5.53,;1.72,5.53,;1.72,7.07,;.39,7.84,;-.94,7.07,;-.94,5.53,;.39,4.76,;.39,3.22,;-.94,2.45,;3.06,.14,;4.39,.91,;4.39,2.45,;5.72,3.22,;5.72,4.76,;7.06,2.45,;7.06,3.99,;5.72,.14,;7.06,.91,;5.72,-1.4,;3.06,-1.4,;4.39,-2.17,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)c1nnc(o1)-c1cccc(F)c1 |r,wD:23.27,(4.71,-.96,;3.38,-.19,;2.04,-.96,;1.72,-2.46,;.19,-2.62,;-.43,-1.22,;.71,-.19,;.71,1.35,;-.62,2.12,;2.04,2.12,;2.04,3.66,;3.38,4.43,;3.38,5.97,;4.71,6.74,;2.04,6.74,;2.04,8.28,;.71,9.05,;-.62,8.28,;-.62,6.74,;.71,5.97,;.71,4.43,;-.62,3.66,;3.38,1.35,;4.71,2.12,;4.71,3.66,;6.04,4.43,;6.04,5.97,;7.38,3.66,;7.38,5.2,;6.04,1.35,;7.38,2.12,;6.04,-.19,;-.58,-3.96,;.33,-5.2,;-.58,-6.45,;-2.04,-5.97,;-2.04,-4.43,;-3.38,-6.74,;-3.38,-8.28,;-4.71,-9.05,;-6.04,-8.28,;-6.04,-6.74,;-7.38,-5.97,;-4.71,-5.97,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)c1nc2ccccc2o1 |r,wD:23.27,(2.9,-1.13,;1.57,-.36,;.24,-1.13,;-.08,-2.64,;-1.62,-2.8,;-2.24,-1.39,;-1.1,-.36,;-1.1,1.18,;-2.43,1.95,;.24,1.95,;.24,3.49,;1.57,4.26,;1.57,5.8,;2.9,6.57,;.24,6.57,;.24,8.11,;-1.1,8.88,;-2.43,8.11,;-2.43,6.57,;-1.1,5.8,;-1.1,4.26,;-2.43,3.49,;1.57,1.18,;2.9,1.95,;2.9,3.49,;4.24,4.26,;4.24,5.8,;5.57,3.49,;5.57,5.03,;4.24,1.18,;5.57,1.95,;4.24,-.36,;-2.39,-4.13,;-3.92,-4.29,;-4.24,-5.8,;-5.57,-6.57,;-5.57,-8.11,;-4.24,-8.88,;-2.9,-8.11,;-2.9,-6.57,;-1.76,-5.54,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)c1nnc(Cc2ccc(F)c(F)c2)o1 |r,wD:23.27,(5.38,-2.11,;4.04,-1.34,;2.71,-2.11,;2.39,-3.62,;.86,-3.78,;.23,-2.37,;1.38,-1.34,;1.38,.2,;.04,.97,;2.71,.97,;2.71,2.51,;4.04,3.28,;4.04,4.82,;5.38,5.59,;2.71,5.59,;2.71,7.13,;1.38,7.9,;.04,7.13,;.04,5.59,;1.38,4.82,;1.38,3.28,;.04,2.51,;4.04,.2,;5.38,.97,;5.38,2.51,;6.71,3.28,;6.71,4.82,;8.04,2.51,;8.04,4.05,;6.71,.2,;8.04,.97,;6.71,-1.34,;.09,-5.11,;.99,-6.36,;.09,-7.6,;-1.38,-7.13,;-2.71,-7.9,;-4.04,-7.13,;-5.38,-7.9,;-6.71,-7.13,;-6.71,-5.59,;-8.04,-4.82,;-5.38,-4.82,;-5.38,-3.28,;-4.04,-5.59,;-1.38,-5.59,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)c1nc2cc(F)ccc2o1 |r,wD:23.27,(3.57,-1.13,;2.24,-.36,;.9,-1.13,;.58,-2.64,;-.95,-2.8,;-1.58,-1.39,;-.43,-.36,;-.43,1.18,;-1.76,1.95,;.9,1.95,;.9,3.49,;2.24,4.26,;2.24,5.8,;3.57,6.57,;.9,6.57,;.9,8.11,;-.43,8.88,;-1.76,8.11,;-1.76,6.57,;-.43,5.8,;-.43,4.26,;-1.76,3.49,;2.24,1.18,;3.57,1.95,;3.57,3.49,;4.9,4.26,;4.9,5.8,;6.24,3.49,;6.24,5.03,;4.9,1.18,;6.24,1.95,;4.9,-.36,;-1.72,-4.13,;-3.25,-4.29,;-3.57,-5.8,;-4.9,-6.57,;-4.9,-8.11,;-6.24,-8.88,;-3.57,-8.88,;-2.24,-8.11,;-2.24,-6.57,;-1.09,-5.54,)|
C[C@@H]1CCCCN1C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wD:30.34,1.0,(-3.21,-7.84,;-3.98,-6.51,;-5.52,-6.51,;-6.29,-5.17,;-5.52,-3.84,;-3.98,-3.84,;-3.21,-5.17,;-1.67,-5.17,;-.9,-6.51,;-.9,-3.84,;.63,-3.68,;.95,-2.17,;-.38,-1.4,;-1.52,-2.43,;-.38,.14,;-1.71,.91,;.95,.91,;.95,2.45,;2.29,3.22,;2.29,4.76,;3.62,5.53,;.95,5.53,;.95,7.07,;-.38,7.84,;-1.71,7.07,;-1.71,5.53,;-.38,4.76,;-.38,3.22,;-1.71,2.45,;2.29,.14,;3.62,.91,;3.62,2.45,;4.95,3.22,;4.95,4.76,;6.29,2.45,;6.29,3.99,;4.95,.14,;6.29,.91,;4.95,-1.4,;2.29,-1.4,;3.62,-2.17,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCC(C)(C)CC1 |r,wD:23.27,(4.54,-2.64,;3.2,-1.87,;1.87,-2.64,;1.55,-4.15,;.02,-4.31,;-.61,-2.9,;.54,-1.87,;.54,-.33,;-.8,.44,;1.87,.44,;1.87,1.98,;3.2,2.75,;3.2,4.29,;4.54,5.06,;1.87,5.06,;1.87,6.6,;.54,7.37,;-.8,6.6,;-.8,5.06,;.54,4.29,;.54,2.75,;-.8,1.98,;3.2,-.33,;4.54,.44,;4.54,1.98,;5.87,2.75,;5.87,4.29,;7.2,1.98,;7.2,3.52,;5.87,-.33,;7.2,.44,;5.87,-1.87,;-.75,-5.64,;.02,-6.97,;-2.29,-5.64,;-2.96,-7.03,;-4.46,-7.37,;-5.66,-6.41,;-5.66,-4.87,;-7.2,-4.87,;-6.43,-3.54,;-4.46,-3.91,;-2.96,-4.25,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)NCC(C)(C)C |r,wD:23.27,(4.01,-2.17,;2.67,-1.4,;1.34,-2.17,;1.02,-3.68,;-.51,-3.84,;-1.14,-2.43,;0,-1.4,;0,.14,;-1.33,.91,;1.34,.91,;1.34,2.45,;2.67,3.22,;2.67,4.76,;4.01,5.53,;1.34,5.53,;1.34,7.07,;0,7.84,;-1.33,7.07,;-1.33,5.53,;0,4.76,;0,3.22,;-1.33,2.45,;2.67,.14,;4.01,.91,;4.01,2.45,;5.34,3.22,;5.34,4.76,;6.67,2.45,;6.67,3.99,;5.34,.14,;6.67,.91,;5.34,-1.4,;-1.28,-5.17,;-.51,-6.51,;-2.82,-5.17,;-3.59,-6.51,;-5.13,-6.51,;-5.9,-5.17,;-5.9,-7.84,;-6.67,-6.51,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCC1 |r,wD:23.27,(3.3,-2.84,;1.97,-2.07,;.63,-2.84,;.31,-4.34,;-1.22,-4.51,;-1.85,-3.1,;-.7,-2.07,;-.7,-.53,;-2.04,.24,;.63,.24,;.63,1.78,;1.97,2.55,;1.97,4.09,;3.3,4.86,;.63,4.86,;.63,6.4,;-.7,7.17,;-2.04,6.4,;-2.04,4.86,;-.7,4.09,;-.7,2.55,;-2.04,1.78,;1.97,-.53,;3.3,.24,;3.3,1.78,;4.63,2.55,;5.97,3.32,;4.63,4.09,;5.97,1.78,;4.63,-.53,;5.97,.24,;4.63,-2.07,;-1.99,-5.84,;-1.22,-7.17,;-3.53,-5.84,;-4.3,-4.51,;-5.81,-4.83,;-5.97,-6.36,;-4.56,-6.98,)|
C[C@H]1COCCN1C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wU:1.0,wD:30.34,(-3.21,-7.84,;-3.98,-6.51,;-5.52,-6.51,;-6.29,-5.17,;-5.52,-3.84,;-3.98,-3.84,;-3.21,-5.17,;-1.67,-5.17,;-.9,-6.51,;-.9,-3.84,;.63,-3.68,;.95,-2.17,;-.38,-1.4,;-1.52,-2.43,;-.38,.14,;-1.71,.91,;.95,.91,;.95,2.45,;2.29,3.22,;2.29,4.76,;3.62,5.53,;.95,5.53,;.95,7.07,;-.38,7.84,;-1.71,7.07,;-1.71,5.53,;-.38,4.76,;-.38,3.22,;-1.71,2.45,;2.29,.14,;3.62,.91,;3.62,2.45,;4.95,3.22,;6.29,3.99,;4.95,4.76,;6.29,2.45,;4.95,.14,;6.29,.91,;4.95,-1.4,;2.29,-1.4,;3.62,-2.17,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)Nc1cccc(F)c1 |r,wD:23.27,(4.39,-2.84,;3.06,-2.07,;1.72,-2.84,;1.4,-4.34,;-.13,-4.51,;-.75,-3.1,;.39,-2.07,;.39,-.53,;-.94,.24,;1.72,.24,;1.72,1.78,;3.06,2.55,;3.06,4.09,;4.39,4.86,;1.72,4.86,;1.72,6.4,;.39,7.17,;-.94,6.4,;-.94,4.86,;.39,4.09,;.39,2.55,;-.94,1.78,;3.06,-.53,;4.39,.24,;4.39,1.78,;5.72,2.55,;7.06,3.32,;5.72,4.09,;7.06,1.78,;5.72,-.53,;7.06,.24,;5.72,-2.07,;-.9,-5.84,;-.13,-7.17,;-2.44,-5.84,;-3.21,-4.51,;-2.44,-3.17,;-3.21,-1.84,;-4.75,-1.84,;-5.52,-3.17,;-7.06,-3.17,;-4.75,-4.51,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(C)(C)CC1 |r,wD:23.27,(4.29,-2.84,;2.95,-2.07,;1.62,-2.84,;1.3,-4.34,;-.23,-4.51,;-.86,-3.1,;.29,-2.07,;.29,-.53,;-1.05,.24,;1.62,.24,;1.62,1.78,;2.95,2.55,;2.95,4.09,;4.29,4.86,;1.62,4.86,;1.62,6.4,;.29,7.17,;-1.05,6.4,;-1.05,4.86,;.29,4.09,;.29,2.55,;-1.05,1.78,;2.95,-.53,;4.29,.24,;4.29,1.78,;5.62,2.55,;6.96,3.32,;5.62,4.09,;6.96,1.78,;5.62,-.53,;6.96,.24,;5.62,-2.07,;-1,-5.84,;-.23,-7.17,;-2.54,-5.84,;-3.31,-4.51,;-4.85,-4.51,;-5.62,-5.84,;-6.96,-6.61,;-6.96,-5.07,;-4.85,-7.17,;-3.31,-7.17,)|
C[C@H]1CCCN1C(=O)N1Cc2c(C1)c(C)c(-c1cc(F)c3OCCCc3c1C)c([C@H](OC(C)(C)C)C(O)=O)c2C |r,wU:1.0,wD:29.33,(-4.16,-7.82,;-4.56,-6.33,;-5.97,-5.71,;-5.81,-4.18,;-4.3,-3.86,;-3.53,-5.19,;-1.99,-5.19,;-1.22,-6.52,;-1.22,-3.86,;.31,-3.69,;.63,-2.19,;-.7,-1.42,;-1.85,-2.45,;-.7,.12,;-2.04,.89,;.63,.89,;.63,2.43,;1.97,3.2,;1.97,4.74,;3.3,5.51,;.63,5.51,;.63,7.05,;-.7,7.82,;-2.04,7.05,;-2.04,5.51,;-.7,4.74,;-.7,3.2,;-2.04,2.43,;1.97,.12,;3.3,.89,;3.3,2.43,;4.63,3.2,;5.97,3.97,;4.63,4.74,;5.97,2.43,;4.63,.12,;5.97,.89,;4.63,-1.42,;1.97,-1.42,;3.3,-2.19,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(F)(F)CC1 |r,wD:23.27,(4.29,-2.84,;2.95,-2.07,;1.62,-2.84,;1.3,-4.34,;-.23,-4.51,;-.86,-3.1,;.29,-2.07,;.29,-.53,;-1.05,.24,;1.62,.24,;1.62,1.78,;2.95,2.55,;2.95,4.09,;4.29,4.86,;1.62,4.86,;1.62,6.4,;.29,7.17,;-1.05,6.4,;-1.05,4.86,;.29,4.09,;.29,2.55,;-1.05,1.78,;2.95,-.53,;4.29,.24,;4.29,1.78,;5.62,2.55,;6.96,3.32,;5.62,4.09,;6.96,1.78,;5.62,-.53,;6.96,.24,;5.62,-2.07,;-1,-5.84,;-.23,-7.17,;-2.54,-5.84,;-3.31,-4.51,;-4.85,-4.51,;-5.62,-5.84,;-6.96,-6.61,;-6.96,-5.07,;-4.85,-7.17,;-3.31,-7.17,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(C)(C)C1 |r,wD:23.27,(4.07,-2.58,;2.74,-1.81,;1.4,-2.58,;1.08,-4.09,;-.45,-4.25,;-1.08,-2.84,;.07,-1.81,;.07,-.27,;-1.27,.5,;1.4,.5,;1.4,2.04,;2.74,2.81,;2.74,4.35,;4.07,5.12,;1.4,5.12,;1.4,6.66,;.07,7.43,;-1.27,6.66,;-1.27,5.12,;.07,4.35,;.07,2.81,;-1.27,2.04,;2.74,-.27,;4.07,.5,;4.07,2.04,;5.4,2.81,;6.74,3.58,;5.4,4.35,;6.74,2.04,;5.4,-.27,;6.74,.5,;5.4,-1.81,;-1.22,-5.58,;-.45,-6.91,;-2.76,-5.58,;-3.53,-4.25,;-5.04,-4.57,;-5.2,-6.1,;-6.74,-6.1,;-5.97,-7.43,;-3.79,-6.72,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)C(=O)N1CCCCC1 |r,wD:23.27,(3.62,-1.5,;2.29,-.73,;.95,-1.5,;.63,-3.01,;-.9,-3.17,;-1.52,-1.76,;-.38,-.73,;-.38,.81,;-1.71,1.58,;.95,1.58,;.95,3.12,;2.29,3.89,;2.29,5.43,;3.62,6.2,;.95,6.2,;.95,7.74,;-.38,8.51,;-1.71,7.74,;-1.71,6.2,;-.38,5.43,;-.38,3.89,;-1.71,3.12,;2.29,.81,;3.62,1.58,;3.62,3.12,;4.95,3.89,;6.29,4.66,;4.95,5.43,;6.29,3.12,;4.95,.81,;6.29,1.58,;4.95,-.73,;-1.67,-4.51,;-.9,-5.84,;-3.21,-4.51,;-3.98,-3.17,;-3.98,-5.84,;-5.52,-5.84,;-6.29,-7.17,;-5.52,-8.51,;-3.98,-8.51,;-3.21,-7.17,)|
Cc1c2CN(Cc3cccc4OCOc34)Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O |r,wD:33.39,(3.62,-1.65,;2.29,-.88,;.95,-1.65,;.63,-3.16,;-.9,-3.32,;-1.67,-4.65,;-3.21,-4.65,;-3.98,-3.32,;-5.52,-3.32,;-6.29,-4.65,;-5.52,-5.99,;-5.99,-7.45,;-4.75,-8.36,;-3.5,-7.45,;-3.98,-5.99,;-1.52,-1.91,;-.38,-.88,;-.38,.66,;-1.71,1.43,;.95,1.43,;.95,2.97,;2.29,3.74,;2.29,5.28,;3.62,6.05,;.95,6.05,;.95,7.59,;-.38,8.36,;-1.71,7.59,;-1.71,6.05,;-.38,5.28,;-.38,3.74,;-1.71,2.97,;2.29,.66,;3.62,1.43,;3.62,2.97,;4.95,3.74,;6.29,4.51,;4.95,5.28,;6.29,2.97,;4.95,.66,;6.29,1.43,;4.95,-.88,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)Oc1ccccc1 |r,wD:23.27,(3.62,-1.5,;2.29,-.73,;.95,-1.5,;.63,-3.01,;-.9,-3.17,;-1.52,-1.76,;-.38,-.73,;-.38,.81,;-1.71,1.58,;.95,1.58,;.95,3.12,;2.29,3.89,;2.29,5.43,;3.62,6.2,;.95,6.2,;.95,7.74,;-.38,8.51,;-1.71,7.74,;-1.71,6.2,;-.38,5.43,;-.38,3.89,;-1.71,3.12,;2.29,.81,;3.62,1.58,;3.62,3.12,;4.95,3.89,;6.29,4.66,;4.95,5.43,;6.29,3.12,;4.95,.81,;6.29,1.58,;4.95,-.73,;-1.67,-4.51,;-.9,-5.84,;-3.21,-4.51,;-3.98,-5.84,;-5.52,-5.84,;-6.29,-7.17,;-5.52,-8.51,;-3.98,-8.51,;-3.21,-7.17,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)S(=O)(=O)c1cccc(F)c1 |r,wD:23.27,(3.62,-1.5,;2.29,-.73,;.95,-1.5,;.63,-3.01,;-.9,-3.17,;-1.52,-1.76,;-.38,-.73,;-.38,.81,;-1.71,1.58,;.95,1.58,;.95,3.12,;2.29,3.89,;2.29,5.43,;3.62,6.2,;.95,6.2,;.95,7.74,;-.38,8.51,;-1.71,7.74,;-1.71,6.2,;-.38,5.43,;-.38,3.89,;-1.71,3.12,;2.29,.81,;3.62,1.58,;3.62,3.12,;4.95,3.89,;6.29,4.66,;4.95,5.43,;6.29,3.12,;4.95,.81,;6.29,1.58,;4.95,-.73,;-1.67,-4.51,;-3,-3.74,;-.33,-5.28,;-2.44,-5.84,;-1.67,-7.17,;-2.44,-8.51,;-3.98,-8.51,;-4.75,-7.17,;-6.29,-7.17,;-3.98,-5.84,)|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccccc1C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(Cl)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1C |r|
COc1cc(ccc1C)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccnn1C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(cc1)C(C)(C)C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(C)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(F)cc(Cl)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(cc1)C(F)(F)F |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)C1CCC1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccccc1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(c1)C(C)(C)C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)[C@H]1CCOC1 |r|
CCOCCC(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)Cc1cccc(F)c1 |r|
CC(C)Oc1cccc(c1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
COc1cncc(c1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cncc(C)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cn(C)cn1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1nccn1C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccn(C)n1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)C(C)(C)C(F)(F)F |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccccc1C(C)(C)C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)C1(C)CCCCC1 |r|
COC1CCCC(C1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(F)c(C)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(F)cc1F |r|
COc1ccc(F)c(c1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
COc1ccc(C)c(c1)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
COc1ccc(C)cc1C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
COc1cc(ccc1F)C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(F)c(Cl)c1 |r|
COc1cccc(C(=O)N2Cc3c(C2)c(C)c(-c2ccc(C)cc2)c([C@H](OC(C)(C)C)C(O)=O)c3C)c1F |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(F)cc1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc2OCCOc2c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc2COB(O)c2c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(c1)B(O)O |r|
COc1cccc(C(=O)N2Cc3c(C2)c(C)c(-c2ccc(C)cc2)c([C@H](OC(C)(C)C)C(O)=O)c3C)c1C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccnc1C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cnccc1C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(F)c(F)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(F)ccc1F |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(Cl)ccc1C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(Cl)c(F)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc2OCOc2c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(F)cc(c1)C(N)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(F)cc(c1)C(O)=O |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccnc1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cncs1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(Cl)cc1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(Cl)cc(Cl)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cocn1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccccn1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cnc(o1)-c1ccccc1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2OCOc12 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(Cl)c(Cl)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(F)c(Cl)c(Cl)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(C)c(F)c(F)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(F)c(F)c(F)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(F)c(F)c(Cl)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(Cl)c(F)c(Cl)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(F)c(Cl)c(F)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1ccc(C)nc1 |r|
COc1cccc(C(=O)N2Cc3c(C2)c(C)c(-c2ccc(C)cc2)c([C@H](OC(C)(C)C)C(O)=O)c3C)c1OC |r|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cc(F)ccc1F |r,wD:23.27,(3.62,-2.17,;2.29,-1.4,;.95,-2.17,;.63,-3.68,;-.9,-3.84,;-1.52,-2.43,;-.38,-1.4,;-.38,.14,;-1.71,.91,;.95,.91,;.95,2.45,;2.29,3.22,;2.29,4.76,;3.62,5.53,;.95,5.53,;.95,7.07,;-.38,7.84,;-1.71,7.07,;-1.71,5.53,;-.38,4.76,;-.38,3.22,;-1.71,2.45,;2.29,.14,;3.62,.91,;3.62,2.45,;4.95,3.22,;6.29,2.45,;4.95,4.76,;6.29,3.99,;4.95,.14,;6.29,.91,;4.95,-1.4,;-1.67,-5.17,;-.9,-6.51,;-3.21,-5.17,;-3.98,-3.84,;-5.52,-3.84,;-6.29,-2.5,;-6.29,-5.17,;-5.52,-6.51,;-3.98,-6.51,;-3.21,-7.84,)|
COc1ccc(C(=O)N2Cc3c(C2)c(C)c(-c2cc(F)c4OCCCc4c2C)c([C@H](OC(C)(C)C)C(O)=O)c3C)c(C)c1 |r,wD:29.32,(-7.44,-6.51,;-6.67,-5.17,;-5.13,-5.17,;-4.36,-3.84,;-2.82,-3.84,;-2.05,-5.17,;-.51,-5.17,;.26,-6.51,;.26,-3.84,;1.79,-3.68,;2.11,-2.17,;.77,-1.4,;-.37,-2.43,;.77,.14,;-.56,.91,;2.11,.91,;2.11,2.45,;3.44,3.22,;3.44,4.76,;4.78,5.53,;2.11,5.53,;2.11,7.07,;.77,7.84,;-.56,7.07,;-.56,5.53,;.77,4.76,;.77,3.22,;-.56,2.45,;3.44,.14,;4.78,.91,;4.78,2.45,;6.11,3.22,;7.44,2.45,;6.11,4.76,;7.44,3.99,;6.11,.14,;7.44,.91,;6.11,-1.4,;3.44,-1.4,;4.78,-2.17,;-2.82,-6.51,;-2.05,-7.84,;-4.36,-6.51,)|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)OCC(C)(C)C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=S)c1cccc(F)c1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)S(=O)(=O)N1CCC(F)(F)C1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)NCc1ncccn1 |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(C)(C)C1 |r|
C[C@@H]1CCCN1C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
C[C@H]1CCCCN1C(=O)N1Cc2c(C1)c(C)c(-c1ccc(C)cc1)c([C@H](OC(C)(C)C)C(O)=O)c2C |r|
Cc1ccc(cc1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CC[C@H](F)C1 |r|
Cc1c2CN(Cc2c(C)c(-c2cc(Cl)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r,wD:23.27,(3.62,-2.17,;2.29,-1.4,;.95,-2.17,;.63,-3.68,;-.9,-3.84,;-1.52,-2.43,;-.38,-1.4,;-.38,.14,;-1.71,.91,;.95,.91,;.95,2.45,;2.29,3.22,;2.29,4.76,;3.62,5.53,;.95,5.53,;.95,7.07,;-.38,7.84,;-1.71,7.07,;-1.71,5.53,;-.38,4.76,;-.38,3.22,;-1.71,2.45,;2.29,.14,;3.62,.91,;3.62,2.45,;4.95,3.22,;6.29,2.45,;4.95,4.76,;6.29,3.99,;4.95,.14,;6.29,.91,;4.95,-1.4,;-1.67,-5.17,;-.9,-6.51,;-3.21,-5.17,;-3.98,-3.84,;-5.52,-3.84,;-6.29,-5.17,;-5.52,-6.51,;-6.29,-7.84,;-3.98,-6.51,)|
Cc1cc(Cl)ccc1-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r,wD:19.22,(-3.33,3.5,;-2,4.27,;-2,5.81,;-.66,6.58,;-.66,8.12,;.67,5.81,;.67,4.27,;-.66,3.5,;-.66,1.96,;-2,1.19,;-3.33,1.96,;-2,-.35,;-3.14,-1.38,;-2.52,-2.79,;-.98,-2.63,;-.66,-1.12,;.67,-.35,;2,-1.12,;.67,1.19,;2,1.96,;2,3.5,;3.34,4.27,;3.34,5.81,;4.67,5.04,;4.83,3.87,;3.34,1.19,;4.67,1.96,;3.34,-.35,;-3.29,-4.12,;-4.83,-4.12,;-2.52,-5.45,;-3.29,-6.79,;-2.52,-8.12,;-.98,-8.12,;-.21,-6.79,;1.33,-6.79,;-.98,-5.45,)|
Cc1ccc(c(O)c1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r,wD:19.22,(-.66,8.12,;-.66,6.58,;.67,5.81,;.67,4.27,;-.66,3.5,;-2,4.27,;-3.33,3.5,;-2,5.81,;-.66,1.96,;-2,1.19,;-3.33,1.96,;-2,-.35,;-3.14,-1.38,;-2.52,-2.79,;-.98,-2.63,;-.66,-1.12,;.67,-.35,;2,-1.12,;.67,1.19,;2,1.96,;2,3.5,;3.34,4.27,;3.34,5.81,;4.67,5.04,;4.83,3.87,;3.34,1.19,;4.67,1.96,;3.34,-.35,;-3.29,-4.12,;-4.83,-4.12,;-2.52,-5.45,;-3.29,-6.79,;-2.52,-8.12,;-.98,-8.12,;-.21,-6.79,;1.33,-6.79,;-.98,-5.45,)|
COc1ccc(c(C)c1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r,wD:20.23,(.75,9.17,;-.59,8.4,;-.59,6.86,;.75,6.09,;.75,4.55,;-.59,3.78,;-1.92,4.55,;-3.25,3.78,;-1.92,6.09,;-.59,2.24,;-1.92,1.47,;-3.25,2.24,;-1.92,-.07,;-3.06,-1.1,;-2.44,-2.5,;-.91,-2.34,;-.59,-.84,;.75,-.07,;2.08,-.84,;.75,1.47,;2.08,2.24,;2.08,3.78,;3.41,4.55,;4.75,3.78,;3.41,6.09,;4.75,5.32,;3.41,1.47,;4.75,2.24,;3.41,-.07,;-3.21,-3.84,;-4.75,-3.84,;-2.44,-5.17,;-.9,-5.17,;-.13,-6.51,;-.9,-7.84,;-2.44,-7.84,;-3.21,-9.17,;-3.21,-6.51,)|
Cc1c2CN(Cc2c(C)c(-c2ccc3OCCc4ccnc2c34)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r,wD:24.29,(2,-.84,;.67,-.07,;-.66,-.84,;-.98,-2.34,;-2.52,-2.5,;-3.14,-1.1,;-2,-.07,;-2,1.47,;-3.33,2.24,;-.66,2.24,;-.66,3.78,;.67,4.55,;.67,6.09,;-.66,6.86,;-.66,8.4,;-2,9.17,;-3.33,8.4,;-3.33,6.86,;-4.66,6.09,;-4.66,4.55,;-3.33,3.78,;-2,4.55,;-2,6.09,;.67,1.47,;2,2.24,;2,3.78,;3.34,4.55,;3.34,6.09,;4.67,5.32,;4.83,4.15,;3.34,1.47,;4.67,2.24,;3.34,-.07,;-3.29,-3.84,;-4.83,-3.84,;-2.52,-5.17,;-.98,-5.17,;-.21,-6.51,;-.98,-7.84,;-2.52,-7.84,;-3.29,-9.17,;-3.29,-6.51,)|
Cc1c2CN(Cc2c(C)c(-c2ccc(Cl)c3cccnc23)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r,wD:22.26,(2,-.45,;.67,.32,;-.66,-.45,;-.98,-1.96,;-2.52,-2.12,;-3.14,-.71,;-2,.32,;-2,1.86,;-3.33,2.63,;-.66,2.63,;-.66,4.17,;.67,4.94,;.67,6.48,;-.66,7.25,;-.66,8.79,;-2,6.48,;-3.33,7.25,;-4.66,6.48,;-4.66,4.94,;-3.33,4.17,;-2,4.94,;.67,1.86,;2,2.63,;2,4.17,;3.34,4.94,;3.34,6.48,;4.67,5.71,;4.83,4.54,;3.34,1.86,;4.67,2.63,;3.34,.32,;-3.29,-3.45,;-4.83,-3.45,;-2.52,-4.79,;-.98,-4.79,;-.21,-6.12,;-.98,-7.45,;-2.52,-7.45,;-3.29,-8.79,;-3.29,-6.12,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCNc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r,wD:23.27,(-3.19,-.54,;-1.86,.23,;-1.86,1.77,;-3,2.8,;-2.37,4.21,;-.84,4.05,;-.52,2.54,;.81,1.77,;2.15,2.54,;.81,.23,;2.15,-.54,;2.15,-2.08,;3.48,-2.85,;3.48,-4.39,;4.81,-2.08,;6.15,-2.85,;7.48,-2.08,;7.48,-.54,;6.15,.23,;4.81,-.54,;3.48,.23,;3.48,1.77,;-.52,-.54,;-.52,-2.08,;.81,-2.85,;.81,-4.39,;-.73,-4.39,;2.35,-4.39,;.81,-5.93,;-1.86,-2.85,;-1.86,-4.39,;-3.19,-2.08,;-3.14,5.54,;-2.37,6.88,;-4.68,5.54,;-5.45,4.21,;-6.99,4.21,;-7.76,5.54,;-6.99,6.88,;-7.76,8.21,;-5.45,6.88,)|
Cc1c2CN(Cc2c(C)c(C2=CCC(C)(C)CC2)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r,t:11|
Cc1c2CN(Cc2c(C)c(-c2ccc3OCCNc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r,wD:22.26,(2.08,-1.5,;.75,-.73,;-.59,-1.5,;-.91,-3.01,;-2.44,-3.17,;-3.06,-1.76,;-1.92,-.73,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;3.41,5.43,;4.75,3.12,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-5.84,;-3.21,-7.17,;-2.44,-8.51,;-.9,-8.51,;-.13,-7.17,;1.41,-7.17,;-.9,-5.84,)|
Cc1c2CN(Cc2c(C)c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r|
Cc1c2CN(Cc2c(C)c(-c2ccc3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r,wD:22.26,(2.08,-1.5,;.75,-.73,;-.59,-1.5,;-.91,-3.01,;-2.44,-3.17,;-3.06,-1.76,;-1.92,-.73,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;3.41,5.43,;4.75,3.12,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-5.84,;-3.21,-7.17,;-2.44,-8.51,;-.9,-8.51,;-.13,-7.17,;1.41,-7.17,;-.9,-5.84,)|
Cc1ccc(c(Cl)c1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc(F)c1 |r,wD:19.22,(-.59,8.12,;-.59,6.58,;.75,5.81,;.75,4.27,;-.59,3.5,;-1.92,4.27,;-3.25,3.5,;-1.92,5.81,;-.59,1.96,;-1.92,1.19,;-3.25,1.96,;-1.92,-.35,;-3.06,-1.38,;-2.44,-2.79,;-.91,-2.63,;-.59,-1.12,;.75,-.35,;2.08,-1.12,;.75,1.19,;2.08,1.96,;2.08,3.5,;3.41,4.27,;3.41,5.81,;4.75,3.5,;4.75,5.04,;3.41,1.19,;4.75,1.96,;3.41,-.35,;-3.21,-4.12,;-4.75,-4.12,;-2.44,-5.45,;-3.21,-6.79,;-2.44,-8.12,;-.9,-8.12,;-.13,-6.79,;1.41,-6.79,;-.9,-5.45,)|
Cc1c2CN(Cc2c(C)c(C2=CCC(C)(C)CC2)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2OCOc12 |r,t:11|
Cc1c2CN(Cc2c(C)c(-c2ccc(Cl)cc2)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2OCOc12 |r|
Cc1ccc(c(Cl)c1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2OCOc12 |r,wU:19.22,(-3.65,7.31,;-2.88,5.98,;-3.65,4.64,;-2.88,3.31,;-1.34,3.31,;-.57,4.64,;.97,4.64,;-1.34,5.98,;-.57,1.98,;.97,1.98,;1.74,3.31,;1.74,.64,;3.25,.32,;3.41,-1.21,;2,-1.83,;.97,-.69,;-.57,-.69,;-1.34,-2.02,;-1.34,.64,;-2.88,.64,;-3.65,1.98,;-5.19,1.98,;-5.19,3.52,;-5.19,.44,;-6.73,1.98,;-3.65,-.69,;-2.88,-2.02,;-5.19,-.69,;4.74,-1.98,;6.08,-1.21,;4.74,-3.52,;6.08,-4.29,;6.08,-5.83,;4.74,-6.6,;3.41,-5.83,;1.95,-6.3,;1.04,-5.06,;1.95,-3.81,;3.41,-4.29,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCNc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)c1cccc2OCOc12 |r,wD:23.27,(2.08,-1.5,;.75,-.73,;-.59,-1.5,;-.91,-3.01,;-2.44,-3.17,;-3.06,-1.76,;-1.92,-.73,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;2.08,6.2,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;3.41,5.43,;4.75,3.12,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-5.84,;-3.21,-7.17,;-2.44,-8.51,;-.9,-8.51,;-.13,-7.17,;1.38,-6.85,;1.54,-5.32,;.13,-4.69,;-.9,-5.84,)|
Cc1c2CN(Cc2c(C)c(-c2ccc3OCCNc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(F)(F)C1 |r,wD:22.26,(-2.18,-1.65,;-.85,-.88,;-.85,.66,;-1.99,1.69,;-1.37,3.1,;.17,2.94,;.49,1.43,;1.82,.66,;3.15,1.43,;1.82,-.88,;3.15,-1.65,;3.15,-3.19,;4.49,-3.96,;5.82,-3.19,;7.15,-3.96,;8.49,-3.19,;8.49,-1.65,;7.15,-.88,;5.82,-1.65,;4.49,-.88,;4.49,.66,;.49,-1.65,;.49,-3.19,;1.82,-3.96,;1.82,-5.5,;3.36,-5.5,;.28,-5.5,;1.82,-7.04,;-.85,-3.96,;-2.18,-3.19,;-.85,-5.5,;-2.14,4.43,;-1.37,5.77,;-3.68,4.43,;-4.58,3.19,;-6.05,3.66,;-6.05,5.2,;-7.58,5.38,;-6.69,6.6,;-4.58,5.68,)|
Cc1c2CN(Cc2c(C)c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(F)(F)C1 |r|
Cc1ccc(c(Cl)c1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(F)(F)C1 |r,wD:19.22,(-.59,8.18,;-.59,6.64,;.75,5.87,;.75,4.33,;-.59,3.56,;-1.92,4.33,;-3.25,3.56,;-1.92,5.87,;-.59,2.02,;-1.92,1.25,;-3.25,2.02,;-1.92,-.29,;-3.06,-1.32,;-2.44,-2.73,;-.91,-2.57,;-.59,-1.06,;.75,-.29,;2.08,-1.06,;.75,1.25,;2.08,2.02,;2.08,3.56,;3.41,4.33,;3.41,5.87,;4.75,3.56,;4.75,5.1,;3.41,1.25,;4.75,2.02,;3.41,-.29,;-3.21,-4.06,;-4.75,-4.06,;-2.44,-5.39,;-3.34,-6.64,;-2.44,-7.89,;-.97,-7.41,;.36,-6.64,;.36,-8.18,;-.97,-5.87,)|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCNc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(F)(F)C1 |r,wD:23.27,(2.08,-1.44,;.75,-.67,;-.59,-1.44,;-.91,-2.95,;-2.44,-3.11,;-3.06,-1.71,;-1.92,-.67,;-1.92,.87,;-3.25,1.64,;-.59,1.64,;-.59,3.18,;.75,3.95,;.75,5.49,;2.08,6.26,;-.59,6.26,;-.59,7.8,;-1.92,8.57,;-3.25,7.8,;-3.25,6.26,;-1.92,5.49,;-1.92,3.95,;-3.25,3.18,;.75,.87,;2.08,1.64,;2.08,3.18,;3.41,3.95,;3.41,5.49,;4.75,3.18,;4.75,4.72,;3.41,.87,;4.75,1.64,;3.41,-.67,;-3.21,-4.45,;-4.75,-4.45,;-2.44,-5.78,;-3.34,-7.03,;-2.44,-8.27,;-.97,-7.8,;.36,-7.03,;.36,-8.57,;-.97,-6.26,)|
Cc1ccc(c(Cl)c1)-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCCC1 |r,wD:19.22,(-.59,8.12,;-.59,6.58,;.75,5.81,;.75,4.27,;-.59,3.5,;-1.92,4.27,;-3.25,3.5,;-1.92,5.81,;-.59,1.96,;-1.92,1.19,;-3.25,1.96,;-1.92,-.35,;-3.06,-1.38,;-2.44,-2.79,;-.91,-2.63,;-.59,-1.12,;.75,-.35,;2.08,-1.12,;.75,1.19,;2.08,1.96,;2.08,3.5,;3.41,4.27,;3.41,5.81,;4.75,3.5,;4.75,5.04,;3.41,1.19,;4.75,1.96,;3.41,-.35,;-3.21,-4.12,;-4.75,-4.12,;-2.44,-5.45,;-3.21,-6.79,;-2.44,-8.12,;-.9,-8.12,;-.13,-6.79,;-.9,-5.45,)|
Cc1c2CN(Cc2c(C)c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCCC1 |r|
Cc1c2CN(Cc2c(C)c(-c2cc(F)c3OCCNc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCCC1 |r,wD:23.27,(2.08,-1.5,;.75,-.73,;-.59,-1.5,;-.91,-3.01,;-2.44,-3.17,;-3.06,-1.76,;-1.92,-.73,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;2.08,6.2,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;3.41,5.43,;4.75,3.12,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-5.84,;-3.21,-7.17,;-2.44,-8.51,;-.9,-8.51,;-.13,-7.17,;-.9,-5.84,)|
Cc1c2CN(Cc2c(C)c(-c2ccc3OCCNc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCCC1 |r,wD:22.26,(2.08,-1.5,;.75,-.73,;-.59,-1.5,;-.91,-3.01,;-2.44,-3.17,;-3.06,-1.76,;-1.92,-.73,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;3.41,5.43,;4.75,3.12,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-5.84,;-3.21,-7.17,;-2.44,-8.51,;-.9,-8.51,;-.13,-7.17,;-.9,-5.84,)|
Cc1c2CN(Cc2c(C)c(-c2ccc3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCC(F)(F)C1 |r,wD:22.26,(2.08,-1.44,;.75,-.67,;-.59,-1.44,;-.91,-2.95,;-2.44,-3.11,;-3.06,-1.71,;-1.92,-.67,;-1.92,.87,;-3.25,1.64,;-.59,1.64,;-.59,3.18,;.75,3.95,;.75,5.49,;-.59,6.26,;-.59,7.8,;-1.92,8.57,;-3.25,7.8,;-3.25,6.26,;-1.92,5.49,;-1.92,3.95,;-3.25,3.18,;.75,.87,;2.08,1.64,;2.08,3.18,;3.41,3.95,;3.41,5.49,;4.75,3.18,;4.75,4.72,;3.41,.87,;4.75,1.64,;3.41,-.67,;-3.21,-4.45,;-4.75,-4.45,;-2.44,-5.78,;-3.34,-7.03,;-2.44,-8.27,;-.97,-7.8,;.36,-7.03,;.36,-8.57,;-.97,-6.26,)|
Cc1c2CN(Cc2c(C)c(-c2ccc3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)N1CCCCC1 |r,wD:22.26,(2.08,-1.5,;.75,-.73,;-.59,-1.5,;-.91,-3.01,;-2.44,-3.17,;-3.06,-1.76,;-1.92,-.73,;-1.92,.81,;-3.25,1.58,;-.59,1.58,;-.59,3.12,;.75,3.89,;.75,5.43,;-.59,6.2,;-.59,7.74,;-1.92,8.51,;-3.25,7.74,;-3.25,6.2,;-1.92,5.43,;-1.92,3.89,;-3.25,3.12,;.75,.81,;2.08,1.58,;2.08,3.12,;3.41,3.89,;3.41,5.43,;4.75,3.12,;4.75,4.66,;3.41,.81,;4.75,1.58,;3.41,-.73,;-3.21,-4.51,;-4.75,-4.51,;-2.44,-5.84,;-3.21,-7.17,;-2.44,-8.51,;-.9,-8.51,;-.13,-7.17,;-.9,-5.84,)|
Cc1cc(Cl)ccc1-c1c(C)c2CN(Cc2c(C)c1C(OC(C)(C)C)C(O)=O)C(=O)N1CCC(F)(F)C1 |(-3.25,3.84,;-1.92,4.61,;-1.92,6.15,;-.59,6.92,;-.59,8.46,;.75,6.15,;.75,4.61,;-.59,3.84,;-.59,2.3,;-1.92,1.53,;-3.25,2.3,;-1.92,-.01,;-3.06,-1.04,;-2.44,-2.45,;-.91,-2.28,;-.59,-.78,;.75,-.01,;2.08,-.78,;.75,1.53,;2.08,2.3,;2.08,3.84,;3.41,4.61,;3.41,6.15,;4.75,3.84,;4.75,5.38,;3.41,1.53,;4.75,2.3,;3.41,-.01,;-3.21,-3.78,;-4.75,-3.78,;-2.44,-5.11,;-3.34,-6.36,;-2.44,-7.6,;-.97,-7.13,;.57,-7.13,;-.2,-8.46,;-.97,-5.59,)|
Cc1cc(Cl)ccc1-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)C1CCCCC1 |r,wD:19.22,(-3.25,3.5,;-1.92,4.27,;-1.92,5.81,;-.59,6.58,;-.59,8.12,;.75,5.81,;.75,4.27,;-.59,3.5,;-.59,1.96,;-1.92,1.19,;-3.25,1.96,;-1.92,-.35,;-3.06,-1.38,;-2.44,-2.79,;-.91,-2.63,;-.59,-1.12,;.75,-.35,;2.08,-1.12,;.75,1.19,;2.08,1.96,;2.08,3.5,;3.41,4.27,;3.41,5.81,;4.75,3.5,;4.75,5.04,;3.41,1.19,;4.75,1.96,;3.41,-.35,;-3.21,-4.12,;-4.75,-4.12,;-2.44,-5.45,;-3.21,-6.79,;-2.44,-8.12,;-.9,-8.12,;-.13,-6.79,;-.9,-5.45,)|
Cc1cc(Cl)ccc1-c1c(C)c2CN(Cc2c(C)c1[C@H](OC(C)(C)C)C(O)=O)C(=O)CC(C)(C)C |r,wD:19.22,(-3.25,3.5,;-1.92,4.27,;-1.92,5.81,;-.59,6.58,;-.59,8.12,;.75,5.81,;.75,4.27,;-.59,3.5,;-.59,1.96,;-1.92,1.19,;-3.25,1.96,;-1.92,-.35,;-3.06,-1.38,;-2.44,-2.79,;-.91,-2.63,;-.59,-1.12,;.75,-.35,;2.08,-1.12,;.75,1.19,;2.08,1.96,;2.08,3.5,;3.41,4.27,;3.41,5.81,;4.75,3.5,;4.75,5.04,;3.41,1.19,;4.75,1.96,;3.41,-.35,;-3.21,-4.12,;-4.75,-4.12,;-2.44,-5.45,;-3.21,-6.79,;-2.44,-8.12,;-4.75,-6.79,;-3.98,-8.12,)|
CN(C)S(=O)(=O)c1cc(F)ccc1CNC(=O)c1nc2n(CCCC22CCCC2)c(=O)c1O
Oc1c(nc2n(CCCC22CCCC2)c1=O)C(=O)NCc1ccc(F)cc1
CC1(C)OCCn2c1nc(C(=O)NCc1ccc(F)cc1Cl)c(O)c2=O
Cc1cc(CNC(=O)c2nc3n(CCOC3(C)C)c(=O)c2O)ccc1F
Cc1cc(F)ccc1CNC(=O)c1nc2n(CCOC2(C)C)c(=O)c1O
CC1(C)OCCn2c1nc(C(=O)NCc1ccc(F)c(Cl)c1)c(O)c2=O
CC1(C)OCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Oc1c(nc2n(CCCC22CCCC2)c1=O)C(=O)NCc1ccc(F)cc1N1CCCCS1(=O)=O
Oc1c(nc2n(CCCC22CCCC2)c1=O)C(=O)NCc1ccc(F)cc1S(=O)(=O)N1CCOCC1
CS(=O)(=O)c1cc(F)ccc1CNC(=O)c1nc2n(CCCC22CCCC2)c(=O)c1O
Cc1cc(CNC(=O)c2nc3n(CCCC33CCCC3)c(=O)c2O)ccc1F
CC1(C)OCCn2c1nc(C(=O)NCc1ccc(F)cc1N1CCCCS1(=O)=O)c(O)c2=O
CN(C)S(=O)(=O)c1c(CNC(=O)c2nc3n(CCOC3(C)C)c(=O)c2O)ccc(F)c1F
CC1(C)OCCn2c1nc(C(=O)NCc1ccc(F)cc1S(C)(=O)=O)c(O)c2=O
CNC(=O)c1cc(F)ccc1CNC(=O)c1nc2n(CCOC2(C)C)c(=O)c1O
CC1(C)OCCn2c1nc(C(=O)NCc1ccc(F)cc1N1CCOCC1)c(O)c2=O
c1ccc(cc1)Cc2cc3c(s2)NC(=O)N(C3=O)O
On1c(=O)[nH]c2SC3CCCCC3c2c1=O
On1c(=O)[nH]c2cc(ccc2c1=O)-c1ccccc1
On1c(=O)[nH]c2sc(cc2c1=O)-c1ccccc1
Cc1csc2[nH]c(=O)n(O)c(=O)c12
On1c(=O)[nH]c2SC3CCCC3c2c1=O
On1c(=O)[nH]c2SC3CNCCC3c2c1=O
ON1C(=O)NC2CN(Cc3ccccc3)CCC2C1=O
On1c(=O)[nH]c2cc(sc2c1=O)-c1ccccc1
On1c(=O)[nH]c2cc(sc2c1=O)-c1ccc(F)cc1
On1c(=O)[nH]c2scc(-c3ccccc3)c2c1=O
On1c(=O)[nH]c2scc(-c3ccc(Cl)cc3)c2c1=O
On1c(=O)[nH]c2sccc2c1=O
Cc1sc2[nH]c(=O)n(O)c(=O)c2c1C
Cc1c(sc2[nH]c(=O)n(O)c(=O)c12)C(O)=O
CCN1CCC2C(C1)Sc1[nH]c(=O)n(O)c(=O)c21
On1c(=O)[nH]c2SC3CN(Cc4ccccc4)CCC3c2c1=O
ON1C(=O)Cc2cc(ccc2C1=O)-c1ccccc1
Cc1nnc(o1)C(=O)NC(C)(C)C2=NC(=C(C(=O)N2C)O)C(=O)NCc3ccc(cc3)F
On1c(=O)[nH]c2cc(sc2c1=O)-c1ccc(Cl)cc1
COC(=O)c1c(Nc2ccc(cc2)-c2cncnc2)c2nccnc2n(O)c1=O
COC(=O)c1c(Nc2cccc(c2)-c2ccc(OC)c(OC)c2)c2nccnc2n(O)c1=O
COC(=O)c1c(Nc2ccc(cc2)-c2ccccc2)c2nccnc2n(O)c1=O
COC(=O)c1c(Nc2ccc(cc2)-c2cccc(c2)C#N)c2nccnc2n(O)c1=O
COC(=O)c1c(Nc2cccc(c2)-c2ccc(cc2)C#N)c2nccnc2n(O)c1=O
COC(=O)c1c(Nc2ccc(cc2)-c2ccc(cc2)C#N)c2nccnc2n(O)c1=O
COC(=O)c1c(Nc2cccc(c2)-c2cncnc2)c2nccnc2n(O)c1=O
COC(=O)c1c(Nc2ccc(cc2)-c2ccc(OC)c(OC)c2)c2nccnc2n(O)c1=O
COC(=O)c1c(Nc2cccc3ccccc23)c2nccnc2n(O)c1=O
COC(=O)c1c(Nc2ccc3ccccc3c2)c2nccnc2n(O)c1=O
COC(=O)c1c(Nc2cccc(c2)-c2cccc(c2)C#N)c2nccnc2n(O)c1=O
CC(=O)Oc1ccc(\C=C\S(=O)(=O)CCc2ccc(NC(=O)c3ccccc3)cc2)cc1OC(C)=O
Oc1ccc(\C=C\S(=O)(=O)CCc2ccc(NC(=O)c3ccccc3)cc2)cc1O
Oc1ccc(\C=C\S(=O)(=O)CCc2ccc(NC(=O)C3CCCCC3)cc2)cc1O
Oc1ccc(\C=C\[S+]([O-])CCc2ccc(NC(=O)c3ccccc3)cc2)cc1O
OC(CC(O)=O)\C=N\c1ccc(O)c(O)c1O
c1c(cc(c(c1)O)O)/C=C/C(=O)O[C@@H](C(=O)O)[C@@H](OC(=O)/C=C/c2cc(c(cc2)O)O)C(=O)O
OC(CC(O)=O)\C=N\c1ccc(O)c(O)c1
OC(CC(O)=O)\C=N\c1cc(ccc1O)[N+]([O-])=O
OC(CC(O)=O)\C=N\c1cc(Br)cc(Br)c1O
OC(CC(O)=O)\C=N\c1cccc(O)c1O
OC(CC(O)=O)\C=N\c1cc(Cl)cc(Br)c1O
OC(CC(O)=O)\C=N\c1cc(Cl)cc(Cl)c1O
OC(CC(O)=O)\C=N\c1ccccc1O
CN(C)CCCNC(=O)c1ccc2nc([nH]c2c1)-c1ccc2nc(CNC(=O)CCCCCCCCCCCC(=O)NCc3nc4ccc(cc4[nH]3)-c3nc4ccc(cc4[nH]3)C(=O)NCCCN(C)C)[nH]c2c1
Cc1nc2ccccc2c(-c2cccc(F)c2)c1C(OC(C)(C)C)C(O)=O
Cc1nc2ccccc2c(-c2ccccc2)c1C(OC(C)(C)C)C(O)=O
Cc1nc2ccccc2c(-c2ccccc2C#N)c1C(OC(C)(C)C)C(O)=O |(13.77,-11.51,;12.43,-10.75,;11.1,-11.52,;9.76,-10.75,;8.43,-11.53,;7.1,-10.76,;7.1,-9.22,;8.43,-8.45,;9.76,-9.21,;11.09,-8.44,;11.08,-6.91,;12.41,-6.13,;12.4,-4.59,;11.07,-3.83,;9.73,-4.61,;9.75,-6.15,;8.41,-6.93,;7.09,-7.71,;12.43,-9.2,;13.75,-8.42,;13.74,-6.88,;15.07,-6.1,;15.06,-4.56,;16.41,-6.86,;16.4,-5.32,;15.09,-9.18,;16.42,-8.4,;15.1,-10.72,)|
CSc1ccccc1-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2ccccc12 |(61.62,-34.48,;62.96,-35.24,;64.28,-34.46,;64.27,-32.92,;65.61,-32.15,;66.94,-32.9,;66.95,-34.44,;65.62,-35.22,;65.63,-36.75,;66.96,-37.51,;68.29,-36.73,;68.28,-35.19,;69.61,-34.41,;69.6,-32.87,;70.95,-35.17,;70.94,-33.63,;69.63,-37.49,;70.96,-36.71,;69.64,-39.03,;66.97,-39.06,;68.31,-39.82,;65.64,-39.83,;64.3,-39.07,;62.97,-39.84,;61.63,-39.07,;61.64,-37.53,;62.97,-36.76,;64.3,-37.52,)|
Cc1nc2ccccc2c(-c2ccc(OC(F)(F)F)cc2)c1C(OC(C)(C)C)C(O)=O
COc1ccccc1-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2ccccc12 |(61.68,-17.76,;63.02,-18.52,;64.35,-17.74,;64.33,-16.2,;65.67,-15.42,;67.01,-16.18,;67.01,-17.72,;65.68,-18.5,;65.69,-20.03,;67.03,-20.79,;68.35,-20.01,;68.35,-18.47,;69.67,-17.69,;69.66,-16.15,;71.01,-18.45,;71,-16.91,;69.69,-20.77,;71.02,-19.99,;69.7,-22.31,;67.03,-22.34,;68.37,-23.1,;65.7,-23.11,;64.36,-22.34,;63.03,-23.12,;61.7,-22.35,;61.7,-20.81,;63.03,-20.04,;64.36,-20.8,)|
Cc1nc2ccccc2c(-c2ccccc2Cl)c1C(OC(C)(C)C)C(O)=O |(48.8,-25.08,;47.47,-24.32,;46.13,-25.09,;44.8,-24.33,;43.46,-25.1,;42.13,-24.33,;42.13,-22.79,;43.46,-22.02,;44.79,-22.78,;46.12,-22.01,;46.11,-20.48,;47.44,-19.7,;47.44,-18.16,;46.1,-17.41,;44.76,-18.19,;44.78,-19.72,;43.45,-20.5,;47.46,-22.77,;48.79,-21.99,;48.78,-20.45,;50.11,-19.67,;50.1,-18.13,;51.44,-20.43,;51.43,-18.89,;50.12,-22.75,;51.45,-21.97,;50.13,-24.29,)|
CC(=O)c1ccc(cc1)-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2ccccc12
Cc1nc2ccccc2c(-c2ccc(cc2)C(F)(F)F)c1C(OC(C)(C)C)C(O)=O
Cc1nc2ccccc2c(-c2ccc3OCCCc3c2)c1C(OC(C)(C)C)C(O)=O
CC(=O)Nc1ccc(cc1)-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2ccccc12
Cc1ccc(cc1)-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2ccccc12
Cc1nc2ccccc2c(-c2cccc(Cl)c2)c1C(OC(C)(C)C)C(O)=O
Cc1nc2ccccc2c(-c2ccc3OCCOc3c2)c1C(OC(C)(C)C)C(O)=O
Cc1nc2ccccc2c(-c2ccoc2)c1C(OC(C)(C)C)C(O)=O
Cc1ccccc1-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2ccccc12 |(61.21,-5,;62.53,-4.22,;62.52,-2.68,;63.86,-1.9,;65.19,-2.66,;65.2,-4.2,;63.87,-4.98,;63.88,-6.51,;65.21,-7.27,;66.54,-6.49,;66.53,-4.95,;67.86,-4.17,;67.85,-2.63,;69.2,-4.93,;69.19,-3.39,;67.88,-7.25,;69.21,-6.47,;67.89,-8.79,;65.22,-8.82,;66.56,-9.58,;63.89,-9.59,;62.55,-8.82,;61.22,-9.6,;59.88,-8.83,;59.89,-7.29,;61.21,-6.52,;62.55,-7.28,)|
Cc1nc2ccccc2c(-c2ccccc2F)c1C(OC(C)(C)C)C(O)=O |(48.86,-39.18,;47.52,-38.42,;46.19,-39.19,;44.85,-38.43,;43.52,-39.21,;42.18,-38.43,;42.18,-36.89,;43.51,-36.12,;44.85,-36.88,;46.17,-36.11,;46.17,-34.58,;47.5,-33.8,;47.49,-32.27,;46.15,-31.51,;44.82,-32.29,;44.83,-33.82,;43.5,-34.6,;47.51,-36.87,;48.84,-36.09,;48.83,-34.55,;50.16,-33.77,;50.15,-32.23,;51.5,-34.54,;51.49,-32.99,;50.18,-36.85,;51.51,-36.08,;50.19,-38.39,)|
CSc1cccc(c1)-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2ccccc12
COc1cccc(c1)-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2ccccc12
Cc1cccc(c1)-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2ccccc12
Cc1nc2ccccc2c(-c2ccc(cc2)C#N)c1C(OC(C)(C)C)C(O)=O
CSc1ccc(cc1)-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2ccccc12
COc1ccc(cc1)-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2ccccc12
Cc1nc2ccccc2c(-c2ccc(F)cc2)c1C(OC(C)(C)C)C(O)=O
Cc1nc2ccccc2c(-c2ccc(Cl)cc2)c1C(OC(C)(C)C)C(O)=O
Cc1nc2ccc(Br)cc2c(-c2ccc(Cl)cc2)c1C(OC(C)(C)C)C(O)=O
COc1ccc(cc1OC)-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2ccccc12
CCc1ccccc1Sc1cc(=O)n(O)c(=O)[nH]1
On1c(=O)cc(Sc2ccc(F)cc2)[nH]c1=O
Oc1ccc(Sc2cc(=O)n(O)c(=O)[nH]2)cc1
On1c(=O)cc(Sc2ccc(cc2)-c2ccc(F)cc2)[nH]c1=O
COc1cccc(c1)-c1ccc(Nc2cc(=O)n(O)c(=O)[nH]2)cc1
On1c(=O)cc(Sc2ccc(cc2)C(F)(F)F)[nH]c1=O
COc1ccc(Sc2cc(=O)n(O)c(=O)[nH]2)cc1
COc1cccc(c1)-c1ccc(Sc2cc(=O)n(O)c(=O)[nH]2)cc1
Cc1ccc(Sc2cc(=O)n(O)c(=O)[nH]2)cc1
CCc1ccc(Sc2cc(=O)n(O)c(=O)[nH]2)cc1
On1c(=O)cc(Sc2ccccc2C(F)(F)F)[nH]c1=O
On1c(=O)cc(Sc2cccc(F)c2)[nH]c1=O
On1c(=O)cc(Sc2ccccc2F)[nH]c1=O
On1c(=O)cc(Sc2cccc(Cl)c2)[nH]c1=O
On1c(=O)cc(Sc2cccc(Br)c2)[nH]c1=O
On1c(=O)cc(Sc2ccccc2Br)[nH]c1=O
COc1cccc(Sc2cc(=O)n(O)c(=O)[nH]2)c1
COc1ccccc1Sc1cc(=O)n(O)c(=O)[nH]1
Cc1ccc(cc1)-c1ccc(Sc2cc(=O)n(O)c(=O)[nH]2)cc1
On1c(=O)cc(Sc2ccc(cc2)-c2ccc(cc2)C(F)(F)F)[nH]c1=O
On1c(=O)cc(Sc2ccc(cc2)-c2cccc(c2)C(F)(F)F)[nH]c1=O
On1c(=O)cc(Sc2ccc(cc2)-c2ccc(Cl)cc2)[nH]c1=O
Oc1ccc(cc1)-c1ccc(Sc2cc(=O)n(O)c(=O)[nH]2)cc1
COc1ccc(cc1OC)-c1ccc(Sc2cc(=O)n(O)c(=O)[nH]2)cc1
COc1cc(OC)cc(c1)-c1ccc(Sc2cc(=O)n(O)c(=O)[nH]2)cc1
Cc1cc(ccc1F)-c1ccc(Sc2cc(=O)n(O)c(=O)[nH]2)cc1
On1c(=O)cc(Sc2cccc(c2)-c2cccc(c2)C(F)(F)F)[nH]c1=O
On1c(=O)cc(Sc2cccc(c2)-c2cccc(F)c2)[nH]c1=O
On1c(=O)cc(Sc2cccc(c2)-c2ccc(Cl)cc2)[nH]c1=O
On1c(=O)cc(Sc2ccccc2-c2ccc(cc2)C(F)(F)F)[nH]c1=O
On1c(=O)cc(Sc2ccccc2-c2ccc(F)cc2)[nH]c1=O
On1c(=O)cc(Sc2cccc(c2)-c2ccc(F)cc2)[nH]c1=O
COc1ccc(cc1F)-c1ccc(Sc2cc(=O)n(O)c(=O)[nH]2)cc1
On1c(=O)cc(Sc2ccccc2)[nH]c1=O
On1c(=O)cc(Sc2cccc(c2)C(F)(F)F)[nH]c1=O
On1c(=O)cc(Sc2ccc(Cl)cc2)[nH]c1=O
On1c(=O)cc(Sc2ccc(cc2)[N+]([O-])=O)[nH]c1=O
On1c(=O)cc(Sc2cccc3ccccc23)[nH]c1=O
On1c(=O)cc(Sc2ccc(cc2)-c2cccc(F)c2)[nH]c1=O
COc1ccc(cc1)-c1ccc(Sc2cc(=O)n(O)c(=O)[nH]2)cc1
On1c(=O)cc(Sc2cccc(c2)-c2ccc(cc2)C(F)(F)F)[nH]c1=O
On1c(=O)cc(Sc2cccc(c2)-c2ccc(F)c(Cl)c2)[nH]c1=O
[H][C@]12Cn3cc(C(=O)NCc4ccc(F)cc4F)c(=O)c(O)c3C(=O)N1[C@H](C)CCO2 |r|
COc1ccc(cc1F)-c1cccc(Cc2cc(=O)n(O)c(=O)[nH]2)c1
On1c(=O)cc(Cc2cccc(c2)-c2cccc(c2)C(F)(F)F)[nH]c1=O
On1c(=O)cc(Cc2ccc(cc2)-c2ccc(Cl)cc2Cl)[nH]c1=O
On1c(=O)cc(Cc2ccc(cc2)-c2cccc(F)c2)[nH]c1=O
On1c(=O)cc(Cc2cccc(c2)-c2cc(Cl)cc(c2)C(F)(F)F)[nH]c1=O
COc1ccc(cc1F)-c1ccc(Cc2cc(=O)n(O)c(=O)[nH]2)cc1
On1c(=O)cc(Cc2ccc(cc2)-c2cccc(c2)C(F)(F)F)[nH]c1=O
On1c(=O)cc(Cc2ccc(Br)cc2)[nH]c1=O
On1c(=O)cc(Cc2ccc(cc2)-c2cc(Cl)cc(c2)C(F)(F)F)[nH]c1=O
On1c(=O)cc(Cc2cccc(Br)c2)[nH]c1=O
Cc1cc(ccc1F)-c1cccc(Cc2cc(=O)n(O)c(=O)[nH]2)c1
On1c(=O)cc(Cc2cccc(c2)-c2cccc(Cl)c2)[nH]c1=O
On1c(=O)cc(Cc2cccc(c2)-c2ccc(Cl)cc2)[nH]c1=O
On1c(=O)cc(Cc2cccc(c2)-c2cccc(F)c2)[nH]c1=O
On1c(=O)cc(Cc2cccc(c2)-c2ccccc2)[nH]c1=O
On1c(=O)cc(Cc2ccc(cc2)-c2ccc(Cl)c(F)c2)[nH]c1=O
On1c(=O)cc(Cc2ccc(cc2)-c2ccc(F)cc2F)[nH]c1=O
On1c(=O)cc(Cc2ccc(cc2)-c2ccc(cc2C(F)(F)F)C(F)(F)F)[nH]c1=O
On1c(=O)cc(Cc2ccc(cc2)-c2cccc(Cl)c2)[nH]c1=O
On1c(=O)cc(Cc2ccc(cc2)-c2ccc(cc2)C(F)(F)F)[nH]c1=O
On1c(=O)cc(Cc2ccc(cc2)-c2ccccc2)[nH]c1=O
Cc1cc(ccc1F)-c1ccc(Cc2cc(=O)n(O)c(=O)[nH]2)cc1
O=c1[nH]c2ccc(cc2c2ccccc12)N(Cc1cccc(c1)C#N)Cc1cccc(c1)C#N
OC(=O)C(=O)CC(=O)c1c2ccccc2cc2ccccc12
OC(=O)C(=O)CC(=O)c1ccc2c(ccc3ccccc23)c1
COC(=O)C(=O)CC(=O)c1ccc(-c2ccccc2C(=O)OC)c(c1)[N+]([O-])=O
Cc1cc(C)c2[nH]c(=O)c3ccc(cc3c2c1)C#N
Cc1ccc2oc3nc(C)c(cc3c(=O)c2c1)C(=O)CC(=O)C(O)=O
Cc1cccc2c3ccc(cc3c(=O)[nH]c12)C#N
OC(=O)C(=O)CC(=O)c1ccc2ccc3cccc4ccc1c2c34
O=c1[nH]c2ccc(cc2c2ccccc12)N(Cc1ccc(cc1)C#N)Cc1ccc(cc1)C#N
OC(=O)C(=O)CC(=O)c1ccc2cc3ccccc3cc2c1
CC(=O)Nc1ccc2[nH]c(=O)c3ccccc3c2c1
FC(F)(F)c1ccc2[nH]c(=O)c3ccccc3c2c1
OC(=O)C(=O)CC(=O)c1ccc(Br)c(CC(=O)c2ccccc2)c1
O=C(Nc1ccc2[nH]c(=O)c3ccccc3c2c1)c1ccccc1
O\C(=C/C(=O)c1ccc(Cc2ccc(F)cc2)o1)c1nc[nH]n1
OC(=O)C(=O)CC(=O)c1ccc2ccccc2c1
O=c1[nH]c2ccc(NCc3cccc(c3)C#N)cc2c2ccccc12
OC(=O)C(=O)CC(=O)c1ccc2ccc3ccccc3c2c1
O=c1[nH]c2ccc(cc2c2ccccc12)C#N
Cc1cc(C)c2[nH]c(=O)c3ccc(cc3c2c1)C(F)(F)F
COc1ccc2[nH]c(=O)c3ccccc3c2c1
Cc1cc(C)c2[nH]c(=O)c3ccccc3c2c1
COC(=O)c1ccccc1-c1ccc(cc1[N+]([O-])=O)C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1cc2ccccc2c2ccccc12
Nc1ccc2[nH]c(=O)c3ccccc3c2c1
Cc1cccc2c1[nH]c(=O)c1ccc(cc21)C(F)(F)F
Cc1cccc2c3cc(ccc3c(=O)[nH]c12)C#N
Cc1cccc2c3ccccc3c(=O)[nH]c12
Cc1nc2oc3ccccc3c(=O)c2cc1C(=O)CC(=O)C(O)=O
CCNc1ccc2[nH]c(=O)c3ccccc3c2c1
Cc1ccc2cc(ccc2c1)C(=O)CC(=O)C(O)=O
OC(=O)c1ccc2[nH]c(=O)c3ccccc3c2c1
O=c1[nH]c2ccc(cc2c2ccccc12)S(=O)(=O)c1ccccc1
Cc1cc(C)c2[nH]c(=O)c3cc(ccc3c2c1)C#N
Brc1ccc2[nH]c(=O)c3ccccc3c2c1
O=c1[nH]c2ccc(NCc3ccc(cc3)C#N)cc2c2ccccc12
OC(=O)C(=O)CC(=O)c1ccc2c(c1)[nH]c(=O)c1ccccc21
COC(=O)C(=O)CC(=O)c1ccc(Br)c(CC(=O)c2ccccc2)c1
Clc1ccc2[nH]c(=O)c3ccccc3c2c1
OC(=O)C(=O)CC(=O)c1ccc(cc1)N1CCOCC1
CC(C)c1c(Cc2cc(C)cc(C)c2)n(COCc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c(=O)[nH]c1=O
CCc1c(Cc2ccccc2)n(COCc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c(=O)[nH]c1=O
OC(=O)c1ccc(cc1)\N=N\c1c(O)c2ccc(NC(=O)Nc3ccc4c(O)c(\N=N\c5ccc(cc5)C(O)=O)c(cc4c3)S(O)(=O)=O)cc2cc1S(O)(=O)=O
CC(C)c1c(Cc2ccccc2)n(COCc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c(=O)[nH]c1=O
OC(=O)C(\O)=C\C(=O)c1cccc(Cc2ccccc2)c1
Oc1nc(S)nc2Oc3nc(S)nc(O)c3C(c3ccc(cc3)[N+]([O-])=O)c12
Oc1c(O)c(=O)c(O)c(cc1-c1cccc(C=O)c1)-c1ccc(C=O)cc1
CC(C)C1=C(N(C(=O)NC1=O)COCc2ccccc2)Cc3ccccc3
CCc1c(Cc2cc(C)cc(C)c2)n(COCc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c(=O)[nH]c1=O
Oc1nc(nc(C(=O)NCc2ccccc2F)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCc2ccc(Cl)cc2)c1O)-c1cccs1
COc1cccc(CNC(=O)c2nc(nc(O)c2O)-c2cccs2)c1
Oc1nc(nc(C(=O)Nc2cccc3ccccc23)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCc2ccc(Cl)c(Cl)c2)c1O)-c1cccs1
Oc1nc(nc(C(=O)Nc2cc3ccccc3s2)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCc2cccc(c2)-c2ccccc2)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCCc2ccccc2)c1O)-c1cccs1
Cc1ccc(CNC(=O)c2nc(nc(O)c2O)-c2cccs2)cc1
Cc1ccccc1CNC(=O)c1nc(nc(O)c1O)-c1cccs1
Oc1nc(nc(C(=O)Nc2nccs2)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCc2ccc(cc2)-c2ccccc2)c1O)-c1cccs1
Oc1nc(nc(C(=O)N[C@H]2CCc3ccccc23)c1O)-c1cccs1 |r|
Oc1nc(nc(C(=O)NCC2CCCCC2)c1O)-c1cccs1
Oc1nc(nc(C(=O)Nc2cncs2)c1O)-c1cccs1
Cc1cccc(CNC(=O)c2nc(nc(O)c2O)-c2cccs2)c1
C[C@H](NC(=O)c1nc(nc(O)c1O)-c1cccs1)c1ccc2ccccc2c1 |r|
Oc1nc(nc(C(=O)Nc2ccccc2)c1O)-c1cccs1
Oc1nc(nc(C(=O)Nc2cccs2)c1O)-c1cccs1
CN(C(=O)c1nc(nc(O)c1O)-c1cccs1)c1cccc2ccccc12
COc1ccccc1CNC(=O)c1nc(nc(O)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCc2ccc(F)cc2)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCc2ccncc2)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCc2ccccc2-c2ccccc2)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCc2cccc(F)c2)c1O)-c1cccs1
Oc1nc(nc(C(=O)Nc2csc3ccccc23)c1O)-c1cccs1
Oc1nc(nc(C(=O)N[C@@H]2CCc3ccccc23)c1O)-c1cccs1 |r|
Oc1nc(nc(C(=O)NCc2c[nH]c3ccccc23)c1O)-c1cccs1
C[C@@H](NC(=O)c1nc(nc(O)c1O)-c1cccs1)c1ccc2ccccc2c1 |r|
COc1ccc(CNC(=O)c2nc(nc(O)c2O)-c2cccs2)cc1
Oc1nc(nc(C(=O)NCc2ccccc2)c1O)-c1cccs1
CC(C)CC(NC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
OC(=O)C(Cc1ccccc1)NC(=O)\C=C\c1ccc(O)c(O)c1
OC(=O)[C@@H](OC(=O)\C=C\c1ccc(O)c(O)c1)[C@@H](OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
COc1ccc(\C=C\C(=O)OCC(O)=O)cc1OC
CC(NC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
OC(=O)C(Cc1ccc(O)cc1)NC(=O)\C=C\c1ccc(O)c(O)c1
OC(=O)CNC(=O)\C=C\c1ccc(O)c(O)c1
COc1cc(\C=C\C(=O)OCC(O)=O)ccc1O
OC(=O)COC(=O)\C=C\c1ccc(O)c(O)c1
CC(OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
OC(=O)C(Cc1ccc(O)c(O)c1)NC(=O)\C=C\c1ccc(O)c(O)c1
COc1c(C)cc(cc1C)-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
[O-][N+](=O)c1cc(Cl)ccc1-c1ccc(\C=C(/C#N)c2nc3ccccc3s2)o1
Cc1ccc2[nH]c(nc2c1)C(=C\c1ccc(o1)-c1ccc(Cl)cc1C(O)=O)\C#N
COc1ccc(cn1)-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
[O-][N+](=O)c1cccc(c1)-c1ccc(\C=C(/C#N)c2nc3ccccc3s2)o1
OC(=O)c1ccc(cc1O)-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
OC(=O)c1cc(ccc1Cl)-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
Clc1ccc(cc1)-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
[O-][N+](=O)c1ccccc1-c1ccc(\C=C\c2nc3ccccc3[nH]2)o1
[O-][N+](=O)c1ccc(Cl)c(c1)-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
[O-][N+](=O)c1ccccc1-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
C\C(=C/c1ccc(o1)-c1ccc(Cl)cc1[N+]([O-])=O)c1nc2ccccc2[nH]1
[O-][N+](=O)c1cc(Cl)ccc1-c1ccc(\C=C\c2nc3ccccc3[nH]2)o1
FC(F)(F)c1cccc(Cl)c1-c1ccc(\C=C(/C#N)c2nc3ccccc3o2)o1
[O-][N+](=O)c1cccc(c1)-c1ccc(\C=C(/C#N)c2nc3ccccc3o2)o1
[O-][N+](=O)c1cccc(c1)-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
FC(F)(F)c1ccc(Cl)c(c1)-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
Cc1c(cccc1[N+]([O-])=O)-c1ccc(\C=C\c2nc3ccccc3[nH]2)o1
[O-][N+](=O)c1cccc(c1)-c1ccc(\C=C\c2nc3ccccc3[nH]2)o1
OC(=O)c1cc(F)ccc1-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
FC(F)(F)c1cccc(Cl)c1-c1ccc(\C=C(/C#N)c2nc3ccccc3s2)o1
COc1c(C)cc(cc1C)-c1ccc(\C=C\c2nc3ccccc3[nH]2)o1
NC(=O)C(=C/c1ccc(o1)-c1ccc(Cl)cc1[N+]([O-])=O)\c1nc2ccccc2[nH]1
FC(F)(F)c1cccc(Cl)c1-c1ccc(\C=C\c2nc3ccccc3[nH]2)o1
CC(C)(C)OC(=O)Nc1ccc(cc1)-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
Cc1ccc(cc1-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1)C(O)=O
Cc1c(cccc1[N+]([O-])=O)-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
OC(=O)c1ccc(cc1)-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
OC(=O)c1cc(ccc1O)-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
OC(=O)c1cccc(c1)-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1
OC(=O)CCCC(=O)Nc1cccc(c1)C(=C)NNC(=O)c1c[nH]c2ccccc12
Cc1n[nH]c(O)c1C(c1ccc(o1)-c1ccc(Cl)c(c1)C(O)=O)c1c(C)n[nH]c1O
CC(C)n1nc(C(=O)NN\C(=C\CC(O)=O)c2ccc(Br)cc2)c2ccccc2c1=O
OC(=O)COc1ccccc1\C=N\NC(=O)CSc1nc2ccccc2[nH]1
OC(=O)C1CCCCC1C(=O)Nc1cccc(c1)C(=C)NNC(=O)C1CC1c1ccccc1
OC(=O)CCC(=O)Nc1ccc(cc1)C(=C)NNC(=O)Cc1ccc(O)cc1
Cc1[nH]nc(O)c1CC(=O)N\N=C\c1ccccc1OCC(O)=O
OC(=O)CCC(=O)Nc1ccccc1-c1ccccc1NC(=O)CCC(O)=O
CC(Oc1ccccc1Cl)C(=O)NNC(=C)c1cccc(NC(=O)C2CCCCC2C(O)=O)c1
Oc1cc(=O)n2ccn(Cc3ccc(F)cc3)c(=O)c2c1O
Oc1cc(=O)n2CCN(Cc3ccc(F)c(Cl)c3)C(=O)c2c1O
Oc1c(O)c2C(=O)N(Cc3ccc(F)cc3)CCn2c(=O)c1C#N
Oc1c(O)c2C(=O)N(Cc3ccc(F)cc3)CCn2c(=O)c1I
Oc1cc(=O)n2CCN(Cc3cccc(Cl)c3)C(=O)c2c1O
Oc1cc(=O)n2CCN(Cc3ccccc3)C(=O)c2c1O
Oc1cc(=O)n2CCCN(Cc3ccc(F)cc3)C(=O)c2c1O
Oc1cc(=O)n2CCN(Cc3ccc(F)cc3)C(=O)c2c1O
Oc1cc(=O)n2CCN(Cc3ccccc3Cl)C(=O)c2c1O
Oc1c(O)c2C(=O)N(Cc3ccc(F)cc3)CCn2c(=O)c1Br
Oc1cc(=O)n2CCN(Cc3ccc(Cl)cc3)C(=O)c2c1O
CCOC(=O)c1sc(nc1C)N1C(C(C(=O)c2ccccc2)=C(O)C1=O)c1ccc(F)cc1 |t:23|
CCOc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(OC)cc1)c1nccs1 |c:12|
CCOc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(O)c(OC)c1)c1nccs1 |c:12|
COc1ccc(OC)c(c1)C(=O)C1=C(O)C(=O)N(CCCCCC(O)=O)C1c1ccc(Cl)cc1 |c:13|
COc1ccc(cc1OC)C1N(C(=O)C(O)=C1C(=O)c1ccc(Br)cc1)c1cccc(c1)C(F)(F)F |c:16|
Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(Cl)cc1)c1nccs1 |c:10|
Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cccc(Cl)c1)c1ncc(s1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O |c:10|
Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(CCCn2ccnc2)C1c1ccc(Cl)cc1 |c:10|
OC1=C(C(N(C1=O)c1nc2ccccc2s1)c1ccc2OCOc2c1)C(=O)c1ccccc1 |t:1|
OC1=C(C(N(C1=O)c1nc2ccccc2s1)c1cccnc1)C(=O)c1ccc(Cl)cc1 |t:1|
OC1=C(C(N(C1=O)c1nc2ccccc2s1)c1ccccn1)C(=O)c1ccc(Cl)cc1 |t:1|
CC(C)(C)c1ccc(cc1)C1N(C(=O)C(O)=C1C(=O)c1ccc(F)cc1)c1nncs1 |c:16|
CCOC(=O)c1sc(nc1C)N1C(C(C(=O)c2ccc(C)cc2)=C(O)C1=O)c1ccc(F)cc1 |t:24|
COc1ccc(cc1OC)C(=O)C1=C(O)C(=O)N(CCc2ccccc2)C1c1ccc(Br)cc1 |c:13|
Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(F)cc1)c1nccs1 |c:10|
COc1ccc(cc1OC)C1N(C(=O)C(O)=C1C(=O)c1ccc(Br)cc1)c1cc(on1)C(C)(C)C |c:16|
CCOc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(F)cc1)c1nnc(C)s1 |c:12|
Cc1ccc(cc1)C1N(CC(O)=O)C(=O)C(O)=C1C(=O)c1ccc(Cl)cc1 |c:17|
CNC(=O)c1cn2CCN(Cc3ccc(F)cc3)C(=O)c2c1O
CN1CCc2c(c(O)c3C(=O)N(Cc4ccc(F)cc4)CCn23)C1=O
CCOC(=O)c1cn2CCN(Cc3ccccc3)C(=O)c2c1O
OC(=O)c1cn2CCN(Cc3cccc(Cl)c3)C(=O)c2c1O
CCOC(=O)c1cn2CCN(Cc3ccc(Cl)cc3)C(=O)c2c1O
CCOC(=O)c1cn2CCN(Cc3ccc(F)cc3)C(=O)c2c1O
CNC(=O)c1cn2CCN(Cc3ccc(Cl)c(Cl)c3)C(=O)c2c1O
CCOC(=O)c1cn2CCN(Cc3cccc(Cl)c3)C(=O)c2c1O
CN1CCn2c3CCN(Cc4ccc(F)cc4)C(=O)c3c(O)c2C1=O
CNC(=O)c1cn2CCN(Cc3ccc(Cl)cc3)C(=O)c2c1O
CCOC(=O)c1cn2CCCN(Cc3ccc(F)cc3)C(=O)c2c1O
CCOC(=O)c1cn2CCN(Cc3cccc(F)c3)C(=O)c2c1O
CCOC(=O)c1cn2CCN(Cc3ccc(Cl)c(Cl)c3)C(=O)c2c1O
Oc1c2c(CCN(Cc3ccc(F)cc3)C2=O)n2CCN(Cc3ccc(F)cc3)C(=O)c12
OC(=O)c1cn2CCN(Cc3ccccc3)C(=O)c2c1O
CCOC(=O)c1cn2CCN(Cc3ccc(F)c(Cl)c3)C(=O)c2c1O
[H][C@@]1(CC(=O)C[C@@H](c2cccc(OC)c2OC)C11C(=O)OC(C)(C)OC1=O)c1ccco1
[H][C@@]1(CC(=O)C[C@@H](c2ccco2)C11C(=O)OC(C)(C)OC1=O)c1ccco1
[H][C@]1(c2ccco2)C(C(=O)OCC)=C(O)CCC11C(=O)OC(C)(C)OC1=O |t:13|
[H][C@@]1(CC(=O)C[C@@H](c2ccccc2)C11C(=O)OC(C)(C)OC1=O)c1ccco1
[H][C@@]1(CC(=O)C[C@@H](c2ccc(OC)cc2)C11C(=O)OC(C)(C)OC1=O)c1ccco1
[H][C@@]1(CC(=O)C[C@@H](c2ccc(OC)c(OC)c2)C11C(=O)OC(C)(C)OC1=O)c1ccco1
[H][C@@]1(CC(=O)CCC11C(=O)OC(C)(C)OC1=O)c1ccc(OC)cc1
[H][C@@]1(CC(=O)C[C@@H](c2c[nH]c3ccccc23)C11C(=O)OC(C)(C)OC1=O)c1ccco1
[H][C@@]1(C(C(=O)OCC)=C(O)CCC11C(=O)OC(C)(C)OC1=O)c1ccccc1OC |t:7|
CNC(=O)c1cc(F)ccc1CNC(=O)c1ncc2cccnc2c1O
Oc1c(nc(N2CCCCS2(=O)=O)c2cccnc12)C(=O)NCc1ccccc1
CNC(=O)Cc1ccccc1CNC(=O)c1nc(N2CCCCS2(=O)=O)c2cccnc2c1O
CN(C)S(=O)(=O)c1cc(F)ccc1CNC(=O)c1nc(N2CCCCS2(=O)=O)c2cccnc2c1O
CN(C)C(=O)c1cc(F)ccc1CNC(=O)c1nc(N2CCCCS2(=O)=O)c2cccnc2c1O
O\C(=N/Cc1ccc(F)cc1)c1nc(N2CCCCS2(=O)=O)c2cccnc2c1O
Oc1c(ncc2cccnc12)C(=O)NCc1ccc(F)cc1
CN(C)C(=O)Cc1ccccc1CNC(=O)c1nc(N2CCCCS2(=O)=O)c2cccnc2c1O
CNC(=O)c1cc(F)ccc1CNC(=O)c1nc(N2CCCCS2(=O)=O)c2cccnc2c1O
NS(=O)(=O)c1cc(F)ccc1CNC(=O)c1nc(N2CCCCS2(=O)=O)c2cccnc2c1O
CNS(=O)(=O)c1cc(F)ccc1CNC(=O)c1nc(N2CCCCS2(=O)=O)c2cccnc2c1O
[H][C@@]12[C@@H](O)[C@@]3([H])C(C(=O)c4c(O)cccc4[C@@]3(C)O)=C(O)[C@]1(O)C(=O)C(C(=O)NCN1CCN(CC1)c1cc3n(cc(C(O)=O)c(=O)c3cc1F)C1CC1)=C(O)[C@H]2N(C)C |t:20,60|
[H][C@@]12C[C@@]3([H])C(C(=O)c4c(O)cccc4[C@@]3(C)O)=C(O)[C@]1(O)C(=O)C(C(=O)NCN1CCCC1)=C(O)[C@H]2N(C)C |t:19,37|
[H][C@@]12C[C@@]3([H])C(=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@H]2N(C)C)C(=O)c1c(O)cccc1[C@@]3(C)O |r,t:5,16|
[H][C@@]12[C@@H](O)[C@@]3([H])C(C(=O)c4c(O)cccc4[C@@]3(C)O)=C(O)[C@]1(O)C(=O)C(C(=O)NCN1CCN(CC1)c1cc3n(CC)cc(C(O)=O)c(=O)c3cc1F)=C(O)[C@H]2N(C)C |t:20,58|
[H][C@@]12Cc3c(ccc(O)c3C(=O)C1=C(O)[C@]1(O)C(=O)C(C(=O)NCN3CCN(CC3C)c3c(F)cc4c(c3F)n(CC)cc(C(O)=O)c4=O)=C(O)[C@@H](N(C)C)[C@]1([H])C2)N(C)C |t:14,53|
[H][C@@]12[C@@H](O)[C@@]3([H])C(C(=O)c4c(O)cccc4[C@@]3(C)O)=C(O)[C@]1(O)C(=O)C(C(=O)NCN1CCN(CC1C)c1c(F)cc3c(c1OC)n(cc(C(O)=O)c3=O)C1CC1)=C(O)[C@H]2N(C)C |t:20,63|
[H][C@@]12C[C@@]3([H])C(C(=O)c4c(O)cccc4[C@@]3(C)O)=C(O)[C@]1(O)C(=O)C(C(=O)NCN1CCN(CC1C)c1c(F)cc3c(c1F)n(CC)cc(C(O)=O)c3=O)=C(O)[C@H]2N(C)C |t:19,59|
[H][C@@]12C[C@@]3([H])C(C(=O)c4c(O)cccc4[C@@]3(C)O)=C(O)[C@]1(O)C(=O)C(C(=O)NCN1CCN(CC1)c1cc3n(cc(C(O)=O)c(=O)c3cc1F)C1CC1)=C(O)[C@H]2N(C)C |t:19,59|
[H][C@@]12C[C@@]3([H])C(C(=O)c4c(O)cccc4[C@@]3(C)O)=C(O)[C@]1(O)C(=O)C(C(=O)NCN1CCN(CC1)c1cc3n(CC)cc(C(O)=O)c(=O)c3cc1F)=C(O)[C@H]2N(C)C |t:19,57|
Oc1ccc(C(=O)\C=C\c2ccccc2O)c(O)c1
Oc1cccc(NC(=O)c2cc(cc(c2)C(=O)Nc2cccc(O)c2)N2C(=O)c3ccccc3C2=O)c1
COc1cc(cc(\C=N\Nc2nc(Nc3ccccc3)nc(Nc3ccccc3)n2)c1O)[N+]([O-])=O
Oc1c(C(=O)NNC(=O)c2cccc(c2)[N+]([O-])=O)c(=O)[nH]c2ccccc12
CCCc1nc2ccccc2c(=O)n1NC(=O)c1c(O)c2cccc3CCCn(c23)c1=O
CCOc1ccc(cc1)-c1c(C#N)c(N)nc(SCC(=O)c2cc3cc(Br)cc(Br)c3oc2=O)c1C#N
Oc1ccc(C(=O)CSc2nnc([nH]2)-c2ccncc2)c(O)c1
O=C(Oc1ccccc1\C=C\C(=O)c1ccccc1)c1cc2ccccc2oc1=O
OC(=O)c1ccc(NCN2C(=O)c3ccc(cc3C2=O)[N+]([O-])=O)cc1
CCCOc1ccc(\C=N\NC2=NC(CC(=N2)c2ccccc2)c2ccccc2O)c(O)c1 |c:15,t:11|
Oc1c(C(=O)NNC(=O)c2ccccc2[N+]([O-])=O)c(=O)[nH]c2ccccc12
COc1ccc(OC)c(c1)C(=O)\C=C\c1ccc2OCOc2c1
COc1cccc(\C=C\C(=O)c2ccccc2)c1O
CCn1c2ccccc2c(O)c(C(=O)NNC(=O)c2cccc(c2)[N+]([O-])=O)c1=O
CNc1nc(N\N=C\c2ccc(o2)-c2ccc(cc2OC)[N+]([O-])=O)nc(Nc2ccccc2)n1
O=C(CSc1nc(SCC(=O)NCc2ccco2)nc(SCC(=O)NCc2ccco2)n1)NCc1ccco1
CC(C)CN1C2C(N=C1N\N=C\c1cc(Br)ccc1O)N(C)C(=O)NC2=O |c:7|
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cc3ccccc3oc2=O)c1
CCCn1c2ccccc2c(O)c(C(=O)NNC(=O)CC(=O)OCC)c1=O
Oc1ccc(cc1O)C(=O)N\N=C\c1c[nH]c2ccccc12
CCCn1c2ccccc2c(O)c(C(=O)NNC(=O)COc2ccccc2)c1=O
COc1ccc(cc1)C(=O)NNC(=O)c1cc2ccccc2cc1O
O\C(=C/C(=O)c1ccc(Cl)cc1)C(=O)Nc1nccs1
Brc1ccc(NS(=O)(=O)c2ccc(Sc3ccc(cc3)S(=O)(=O)Nc3ccc(Br)cc3)cc2)cc1
O=C(Nc1cccc(\C=C\C(=O)c2ccccc2)c1)c1cccs1
CC(=O)Nc1ccc2OCCOCCOc3ccc(NC(C)=O)cc3OCCOCCOc2c1
[O-][N+](=O)c1ccc2n(-c3ccc(Cl)cc3)c3nc(=O)[nH]c(=O)c3cc2c1
CCCCCCc1nc2ccccc2c(=O)n1NC(=O)c1c(O)c2ccccc2n(CC)c1=O
O=C(\C=C\c1ccc2OCOc2c1)c1ccccc1
COc1cccc(c1)C(=O)NNC(=O)c1ccc2ccccc2c1O
Nc1cc(O)nc(SCC(=O)c2ccc(O)c(O)c2)n1
[#7]-[#6](=O)-[#7]\[#7]=[#6]-1/c2cc(ccc2-c2ccc(cc-12)S(=O)(=O)[#7]-[#6]-c1ccco1)S(=O)(=O)[#7]-[#6]-c1ccco1
Cc1cc(O)nc(SCC(=O)c2ccc(O)c(O)c2)n1
[O-][N+](=O)c1ccc(NC(=O)CCC(=O)Nc2ccc(c(c2)C(F)(F)F)[N+]([O-])=O)cc1C(F)(F)F
Oc1ccc(Br)cc1\C=N\Nc1nc2nonc2nc1Nc1ccc(F)cc1
Oc1ccc(cc1O)-c1csc(Nc2ncccn2)n1
CCc1cccc2c(SCC(=O)NNC(=O)c3ccccc3[N+]([O-])=O)nc(nc12)-c1ccc(F)cc1
Oc1ccccc1C(=O)\C=C\c1ccc2OCOc2c1
CC(C)Cc1c(C#N)c(SCC(=O)c2ccc(O)c(O)c2)nc(C)c1C(N)=O
Cc1ccc(O)c(\C=N\Nc2nc3n(C)c(=O)[nH]c(=O)c3n2Cc2ccccc2)c1
Oc1ccc(Cl)cc1\C=C\c1ccc2cccc(O)c2n1
COc1cc(OC)c(cc1OC)C(=O)\C=C\c1cccc(c1)[N+]([O-])=O
OC(=O)COc1ccccc1\C=N\Nc1nncc(n1)-c1ccccc1
Cc1ccc(NCC(=O)N\N=C\c2cccc(OC(=O)c3ccc4OCOc4c3)c2)cc1
O=C(Cn1nnc2ccccc12)N(C(C(=O)NC1CCCCC1)c1ccco1)c1ccc(cc1)S(=O)(=O)NCC1CCCO1
Oc1c(C(=O)NNC(=O)c2ccccc2)c(=O)[nH]c2ccccc12
Cc1ccc(NP(=O)(Oc2ccccc2)Oc2ccccc2)cc1
CCCC(=O)NC(c1ccc(OC)c(OC)c1)c1cc(Cl)c2cccnc2c1O
Oc1ccccc1C(=O)NNC(=O)CSc1nc2ccccc2c(=O)n1CC1CCCO1
CCCn1c(N\N=C\c2cc(Br)ccc2O)nc2n(C)c(=O)[nH]c(=O)c12
COc1ccc(\C=C\C(=O)c2ccc(O)cc2O)cc1
CCCn1c2ccccc2c(O)c(C(=O)NNC(=O)c2ccccc2)c1=O
Nc1ccc(cc1)C(=O)CC(=O)Nc1cc(cc(c1)C(O)=O)C(O)=O
CCn1c2ccccc2c(O)c(C(=O)NNC(=O)c2ccc(cc2)[N+]([O-])=O)c1=O
Oc1c(C(=O)NNC(=O)c2ccccc2F)c(=O)[nH]c2ccccc12
COc1ccc(NC(=O)CSc2nc(nn2CC(=O)NCc2ccco2)-c2ccncc2)cc1
Oc1cc2ccccc2cc1C(=O)NNC(=O)COc1ccc2ccccc2c1
COc1ccc(Nc2nc(NCc3ccco3)nc(N\N=C\c3ccc(Br)cc3)n2)cc1
COc1cc(cc(OC)c1OC)C(=O)\C=C\c1ccc2OCOc2c1
Brc1ccc(cc1)C(=O)Oc1ccc(\C=N\Nc2nnc3c(n2)[nH]c2ccccc32)cc1
Cc1ccc(NC(=O)CN2C(=O)\C(=N/NC(=O)c3ccc4ccccc4n3)c3ccccc23)cc1
CCN(CC)c1nc(N\N=C\c2ccc(cc2)[N+]([O-])=O)nc(Nc2ccc(C)c(Cl)c2)n1
CCn1c2ccccc2c(O)c(C(=O)NNC(=O)c2ccccc2[N+]([O-])=O)c1=O
Cn1c2nc(SCC(O)CCl)n(CC(O)COc3ccc(Cl)cc3)c2c(=O)[nH]c1=O
COc1cc(ccc1O)C(=O)\C=C\c1ccc2OCOc2c1
OC(=O)c1ccccc1NC(=O)c1ccc(cc1)C(=O)Nc1ccccc1C(O)=O
CCOc1cc(Br)cc(\C=N\c2ncccc2O)c1O
COc1ccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc2ccc(cc2)C(O)=O)cc1
[O-][N+](=O)c1cccc(\C=N\NC(=O)c2cccc(n2)C(=O)N\N=C\c2cccc(c2)[N+]([O-])=O)c1
[O-][N+](=O)c1ccc(cc1)C(=O)COC(=O)CNC(=O)c1ccc(Cl)cc1
Cn1c(SCC(=O)NNC(=O)c2cccc(O)c2)nc2sc3CCCc3c2c1=O
OC(=O)c1cc(ccc1Cl)-c1ccc(\C=N\Nc2nc3nonc3nc2Nc2ccccc2F)o1
COc1ccc(cc1)C(=O)Nc1ccccc1C(=O)NC(C(C)C)C(=O)NNC(=O)c1ccccc1O
Oc1ccc(\C=N\NC(=O)c2ccccc2O)cc1O
Oc1c(\C=N\Nc2nc(Nc3ccccc3)nc(Nc3ccccc3)n2)cc(Br)cc1[N+]([O-])=O
Oc1ccccc1C(=O)N\N=C1/C(=O)Nc2ccccc12
Oc1ccccc1C(=O)NNC(=O)COc1ccc2ccccc2c1
Oc1ccc(cc1O)C(=O)CSc1nc(O)c2ccccc2n1
Oc1ccc(C(=O)N\N=C2\C(=O)Nc3ccccc23)c(O)c1
CCc1nc2sc3CCCCc3c2c2nnc(SCC(=O)NNC(=O)c3ccc(OC)cc3)n12
COc1cc(ccc1OCc1ccccc1)C(NC(=O)c1ccco1)NC(=O)c1ccco1
Oc1ccccc1C(=O)NNC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1-c1ccccc1
COc1ccc(cc1)-n1c(Cc2ccccc2)nnc1SCC(=O)NNC(=O)c1ccccc1O
Oc1ccccc1\C=N\NC(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1
Oc1ccccc1C(=O)NNC(=O)CSc1nnc(-c2ccccc2)n1Cc1ccccc1
Cn1c(SCC(=O)NNC(=O)c2ccccc2O)nnc1-c1ccccc1
Oc1ccccc1C(=O)NNC(=O)CSc1nnc(-c2ccccc2O)n1Cc1ccccc1
COc1ccccc1-n1c(SCC(=O)NNC(=O)c2ccccc2O)nnc1-c1ccccc1O |(18.04,.11,;16.9,1.14,;15.43,.66,;15.12,-.85,;13.65,-1.33,;12.5,-.29,;12.83,1.21,;14.29,1.68,;14.62,3.18,;16.02,3.8,;17.35,3.03,;18.68,3.8,;20.02,3.03,;20.02,1.49,;21.35,3.8,;22.69,3.03,;24.02,3.8,;24.02,5.34,;25.35,3.03,;25.35,1.49,;26.69,.72,;28.02,1.49,;28.02,3.04,;26.68,3.8,;26.68,5.34,;15.86,5.34,;14.35,5.66,;13.59,4.32,;12.07,4.16,;11.16,5.41,;9.63,5.25,;9.01,3.84,;9.92,2.59,;11.45,2.76,;12.36,1.52,)|
Oc1ccccc1C(=O)NNC(=O)CSc1nnc(Cc2ccccc2)n1C1CCCCC1
OC(=O)c1ccccc1\C=N\NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1-c1ccccc1
Oc1ccccc1C(=O)NNC(=O)CSc1nnc(-c2ccncc2)n1-c1ccc(F)cc1
Oc1ccccc1C(=O)NNC(=O)CSc1nnc(Cc2ccccc2)n1-c1cccc(Cl)c1
Cc1cc(C)nc(SCc2nnc(SCC(=O)NNC(=O)c3ccccc3O)n2-c2ccccc2)n1
Oc1ccc(C(=O)NNC(=O)CSc2nnnn2-c2ccccc2)c(O)c1
COc1ccc(cc1OC)-c1nnc(SCC(=O)NNC(=O)c2ccccc2O)n1-c1ccccc1
Cc1cc(C)nc(SCc2nnc(SCC(=O)NNC(=O)c3ccccc3O)n2C)n1
Cc1ccc(cc1)-n1c(SCC(=O)NNC(=O)c2ccccc2O)nnc1-c1ccccc1
Cc1ccc(cc1)-n1c(SCC(=O)NNC(=O)c2ccccc2O)nnc1-c1ccccc1O
OC(=O)C(=O)CC(=O)C=Cc1cccn1Cc1ccccc1 |w:8.7|
NC(=N)c1ccc2cc(ccc2c1)C#Cc1cccc(OCc2ccccc2)c1
OC(=O)C(=O)CC(=O)c1cc(OCc2ccccc2)cc(OCc2ccccc2)c1
OC1=C(O)C(=O)C2C=CC=C(O)CC2=C1O |c:1,7,14,t:9|
OC(=O)c1cc2cc(O)c(O)cc2[nH]1
CC(C)S(=O)(=O)Nc1ccc2nc(N)[nH]c2c1
c1c2c-3c(c(c1O)O)OC(=O)c4c3c(c(c(c4)O)O)OC2=O
OC(=O)C(\O)=C(/C#N)c1cn(-c2ccc(F)cc2)c2ccccc12
COc1cccc(CN(Cc2cccc(OC)c2)c2ccc3nc(N)[nH]c3c2)c1
Oc1c(ncc2cccnc12)C(=O)c1cc(CN2CCCS2(=O)=O)cc(Cc2ccccc2)c1
CC(C)[C@@H](CO)N1C=C(C(=O)c2c1cc(c(c2)Cc3cccc(c3F)Cl)OC)C(=O)O
CC(C)(C)C1CCC(CC1)C1=NCCc2ccc(cc12)[C@H]1CC1c1ccc2cc(ccc2c1)C(N)=N |wD:20.22,t:11,(.6,-33.86,;-.73,-34.65,;.05,-35.98,;-1.5,-33.32,;-2.06,-35.41,;-2.07,-36.95,;-3.4,-37.72,;-4.73,-36.95,;-4.74,-35.41,;-3.4,-34.64,;-6.07,-37.73,;-7.4,-36.96,;-8.72,-37.73,;-8.72,-39.27,;-7.39,-40.02,;-7.39,-41.57,;-6.06,-42.33,;-4.73,-41.56,;-4.72,-40.02,;-6.07,-39.25,;-3.4,-42.33,;-2.63,-43.67,;-1.86,-42.33,;-.53,-41.56,;-.53,-40.02,;.8,-39.25,;2.13,-40.01,;3.46,-39.24,;4.8,-40,;4.8,-41.55,;3.47,-42.32,;2.13,-41.55,;.8,-42.33,;6.12,-39.22,;7.46,-39.98,;6.11,-37.68,)|
O\C(=C/C(=O)c1ccc(Cc2ccc(F)cc2)[nH]1)c1nc[nH]n1
O\C(=C/C(=O)c1ccc(Cc2ccc(F)cc2)o1)c1cc[nH]c1
Oc1ccc2CN(NC(=O)c3ccccc3O)C(=O)c2c1O
Oc1cccc(C(=O)NNC(=O)c2cccc(O)c2O)c1O
Oc1ccc2CN(N3C(=O)c4ccc(O)c(O)c4C3=O)C(=O)c2c1O
Oc1ccc(cc1O)S(=O)(=O)N(N1Cc2ccc(O)c(O)c2C1=O)S(=O)(=O)c1ccc(O)c(O)c1
Oc1cccc(C(=O)NNC(=O)c2ccccc2O)c1O
COc1cccc(C(=O)NNC(=O)c2cccc(OC)c2O)c1O
COc1cccc(C(=O)NNC(=O)c2cccnc2)c1O
Oc1ccc2CN(Cc3cccc(CBr)c3)C(=O)c2c1O
COc1cccc(\C=N\NC(=O)c2cccc(O)c2O)c1OC
Oc1ccc2CN(N3C(=O)c4ccc(F)cc4C3=O)C(=O)c2c1O
Oc1ccc2CN(N(S(=O)(=O)c3ccc(F)cc3)S(=O)(=O)c3ccc(F)cc3)C(=O)c2c1O
Oc1cccc(\C=N\NC(=O)c2cccc(O)c2O)c1O
COc1cccc(C(=O)NN)c1O
Oc1ccc2CN(N3Cc4ccc(O)c(O)c4S3(=O)=O)C(=O)c2c1O
Oc1cccc(C(=O)NNC(=O)c2cccnc2)c1O
Oc1ccc2CN(Cc3ccccc3)C(=O)c2c1O
c1cc(c(cc1CN2Cc3ccc(c(c3C2=O)O)O)Cl)F
Oc1ccc2C(=O)N(Cc3ccc(F)cc3)Cc2c1O
COc1cccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)c1O
NNC(=O)c1cccc(O)c1O
Oc1ccc2CN(CCc3ccccc3)C(=O)c2c1O
Oc1ccc2CN(NC(=O)c3cccc(O)c3O)C(=O)c2c1O
Oc1ccc2CN(NS(=O)(=O)c3ccc(F)cc3)C(=O)c2c1O
COc1cccc(C(=O)NCc2ccc(F)cc2)c1O
COc1cccc(C(=O)N\N=C\c2ccc(F)cc2)c1O
Oc1ccc2CN(N3Cc4ccc(O)c(O)c4C3=O)C(=O)c2c1O
Oc1cccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)c1O
Oc1cccc2C(=O)N(Cc3ccc(F)cc3)C(=O)c12
Oc1cccc(C(=O)NCCNC(=O)c2cccc(O)c2O)c1O
Oc1ccc2CN(N3C(=O)c4cc(O)c(O)cc4C3=O)C(=O)c2c1O
Oc1ccc2CN(\N=C\c3ccc(F)cc3)C(=O)c2c1O
COc1cccc(C(=O)NNC(=O)c2cccc(O)c2O)c1O
Oc1cccc(C(=O)NCc2ccc(F)cc2)c1O
Oc1ccc2CN(Cc3cccc4ccccc34)C(=O)c2c1O
Oc1ccc2CN(Cc3ccc(F)cc3)C(=O)c2c1O
Oc1cccc(C(=O)NCCCNC(=O)c2cccc(O)c2O)c1O
Oc1ccc2CN(NC(=O)c3ccccc3)C(=O)c2c1O
Oc1ccc2CN(\N=C\c3cccc(O)c3O)C(=O)c2c1O
Oc1ccc2CN(Cc3cccc(Cc4ccccc4)c3)C(=O)c2c1O
Oc1ccccc1C(=O)NNC(=O)c1ccccc1O
Oc1ccc2CN(NC(=O)c3ccc(F)cc3)C(=O)c2c1O
Oc1cccc2C(=O)N(N3Cc4ccc(O)c(O)c4C3=O)C(=O)c12
Oc1ccc2CN(N3C(=O)c4ccccc4C3=O)C(=O)c2c1O
CC1=NN(C(=O)\C1=C/c1cc(Cl)c(O)c(Cl)c1)c1nnn[nH]1 |t:1|
CCOc1cc(\C=C2\C(C)=NN(C2=O)c2nnn[nH]2)ccc1OC |c:9|
COc1cc(\C=C2\C(C)=NN(C2=O)c2nnn[nH]2)cc(Cl)c1OC |c:8|
Cc1ccc(cc1NC(=O)CSc1nc2ccccc2s1)C(O)=O
OC(=O)CN1C(=O)\C(=C2/SC(=S)N(C(Cc3ccccc3)C(O)=O)C2=O)c2ccccc12
Cc1ccc2nc(sc2c1)-c1ccc(NC(=O)\C=C\C(O)=O)cc1
OC(=O)CSc1nc(Nc2ccccc2)nc(n1)N1CCOCC1
OC(=O)CSc1nc(cc(n1)C(F)(F)F)-c1ccccc1
OC(=O)C1CCCCC1C(=O)Nc1ccc(Oc2cccc3ccccc23)cc1
OC(=O)CSc1nc(cc(n1)C(F)(F)F)-c1cccs1
OC(=O)CSc1nc(cc(-c2ccc(Cl)cc2)c1C#N)-c1ccccc1
CCOc1cc(\C=C2\C(C)=NN(C2=O)c2nnn[nH]2)cc(Cl)c1OCC |c:9|
Nc1c(sc2[nH]c(=O)c(cc12)C(O)=O)C(=O)Nc1ccc(Cl)c(Cl)c1
OC(C(O)c1nc2cc3ccccc3cc2[nH]1)C(O)=O
OC(=O)CSc1nnc(-c2ccco2)c(n1)-c1ccco1
CCOc1cc(ccc1\C=C1\C(C)=NN(C1=O)c1nnn[nH]1)N(CC)CC |c:13|
CC(C)[C@H](CO)n1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3F)ccc12
COc1ccc(\C=C2\C(C)=NN(C2=O)c2nnn[nH]2)cc1OCc1ccccc1Cl |c:9|
COc1cccc(NC(=O)c2sc3[nH]c(=O)c(cc3c2N)C(O)=O)c1
OC(=O)c1ccccc1NC(=O)c1ccccc1S(=O)(=O)Nc1ccc(Oc2ccccc2)cc1
OCCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3F)ccc12
CCOc1cc(CNc2nn[nH]n2)cc(Cl)c1OCc1ccc(Cl)cc1
OC(=O)c1cnc2ccc(Cc3cccc(Cl)c3F)cc2c1O
COc1cc2n(CCO)cc(C(O)=O)c(=O)c2cc1Cc1cccc(Cl)c1F
COc1cc2n(cc(C(O)=O)c(=O)c2cc1Cc1cccc(Cl)c1F)[C@@H](CO)C(C)C
CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CS)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCSC)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C(C)C)C(O)=O
OC(=O)[C@@H](Cc1cc(O)c(O)cc1[N+]([O-])=O)OC(=O)\C=C\c1ccc(O)c(O)c1
OC(=O)[C@@H](Cc1cc(O)c(O)cc1[N+]([O-])=O)OC(=O)\C=C\c1cc(O)c(O)cc1[N+]([O-])=O
c1cc(c(cc1C[C@H](C(=O)O)OC(=O)/C=C/c2ccc(c(c2)O)O)O)O
CC(C)(C)c1nc(O)c(O)c(n1)C(=O)NCc1ccc(F)cc1
CN1CCN(CC1)C(=O)c1cc(F)ccc1CNC(=O)c1nc(n(C)c(=O)c1O)C(C)(C)C
Cn1c(nc(C(=O)NCc2ccc(F)cc2C(=O)NCC(F)(F)F)c(O)c1=O)C(C)(C)C
CC(C)NC(=O)c1cc(F)ccc1CNC(=O)c1nc(n(C)c(=O)c1O)C(C)(C)C
CCNC(=O)c1cc(F)ccc1CNC(=O)c1nc(n(C)c(=O)c1O)C(C)(C)C
Cc1noc(n1)-c1cc(F)ccc1CNC(=O)c1nc(n(C)c(=O)c1O)C(C)(C)C
Cn1c(nc(C(=O)NCc2cccc3cc[nH]c23)c(O)c1=O)C(C)(C)C
CC(C)(C)c1nc(O)c(O)c(n1)C(=O)NCc1ccc(F)cc1S(C)(=O)=O
CNC(=O)c1cc(F)ccc1CNC(=O)c1nc(nc(O)c1O)C(C)(C)C
CCCNC(=O)c1cc(F)ccc1CNC(=O)c1nc(n(C)c(=O)c1O)C(C)(C)C
Cc1noc(n1)-c1cc(F)ccc1CNC(=O)c1nc(nc(O)c1O)C(C)(C)C
CNC(=O)c1cc(F)ccc1CNC(=O)c1nc(n(C)c(=O)c1O)C(C)(C)C
CCOc1ccccc1CNC(=O)c1nc(n(C)c(=O)c1O)C(C)(C)C
Cn1c(nc(C(=O)NCc2ccc(F)cc2C(=O)N2CCCC2)c(O)c1=O)C(C)(C)C
CN(C)C(=O)c1cc(F)ccc1CNC(=O)c1nc(n(C)c(=O)c1O)C(C)(C)C
Cn1c(nc(C(=O)NCc2ccc(F)cc2C(N)=O)c(O)c1=O)C(C)(C)C
Cn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C(C)(C)C
CCOc1ccccc1CNC(=O)c1nc(nc(O)c1O)C(C)(C)C
Cn1c(nc(C(=O)NCc2ccc(F)cc2S(C)(=O)=O)c(O)c1=O)C(C)(C)C
CC(C)(C)c1nc(O)c(O)c(n1)C(=O)NCc1cccc2cc[nH]c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cccc(OC)c12
COc1cccc2c(cn(Cc3ccc(F)cc3)c12)C(=O)\C=C(/O)C(O)=O
COc1ccc2c(cn(Cc3ccc(F)cc3)c2c1)C(=O)\C=C(/O)C(O)=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2ccccc12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2c(OC)cccc12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OC)cc12
COc1cccc2n(Cc3ccc(F)cc3)cc(C(=O)\C=C(/O)C(O)=O)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2c(OC)ccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(OC)ccc12
COc1ccc2n(Cc3ccc(F)cc3)cc(C(=O)\C=C(/O)C(O)=O)c2c1
COc1ccc(OC)c2n(Cc3ccc(F)cc3)cc(C(=O)\C=C(/O)C(O)=O)c12
[H][C@@]12O[C@]1([H])[C@H](O)C1=C([C@@H](CCCCCC)OC1=O)[C@H]2O |r,t:8|
[H][C@@]12NC(=O)[C@H](NC(=O)[C@@H](Cc3c[nH]c4cc(ccc34)-c3cc1cc(Oc1ccc(C[C@H](N(C)C(=O)[C@H](NC2=O)c2cc(Cl)c(O)c(Cl)c2)C(=O)N[C@@H](C(O)=O)c2ccc(O)cc2)cc1)c3O)NC(=O)C(=O)c1cc(Cl)c(O)c(Cl)c1)c1cc(Cl)c(O)c(Cl)c1 |r|
CN1[C@@H](Cc2ccc(Oc3cc4cc(c3O)-c3cccc5c(C[C@@H](NC(=O)C(=O)c6cc(Cl)c(O)c(Cl)c6)C(=O)N[C@H](c6cc(Cl)c(O)c(Cl)c6)C(=O)N[C@H]4C(=O)N[C@H](c4cc(Cl)c(O)c(Cl)c4)C1=O)c[nH]c35)cc2)C(=O)N[C@@H](C(O)=O)c1ccc(O)cc1 |r|
[H][C@@]12NC(=O)[C@H](NC(=O)[C@H](N)Cc3c[nH]c4c(cccc34)-c3cc1cc(Oc1ccc(C[C@H](N(C)C(=O)[C@H](NC2=O)c2cc(Cl)c(O)c(Cl)c2)C(O)=O)cc1)c3O)c1cc(Cl)c(O)c(Cl)c1 |r|
[H][C@@]12NC(=O)[C@H](NC(=O)[C@@H](CC3C(=O)Nc4cc(ccc34)-c3cc1cc(Oc1ccc(C[C@H](N(C)C(=O)[C@H](NC2=O)c2cc(Cl)c(O)c(Cl)c2)C(=O)N[C@@H](C(O)=O)c2ccc(O)cc2)cc1)c3O)NC(=O)C(=O)c1cc(Cl)c(O)c(Cl)c1)c1cc(Cl)c(O)c(Cl)c1 |r|
CN[C@@H](Cc1ccc(Oc2cc3cc(c2O)-c2cccc4c(C[C@@H](N)C(=O)N[C@H](c5cc(Cl)c(O)c(Cl)c5)C(=O)N[C@H]3C(=O)N[C@@H](C(O)=O)c3cc(Cl)c(O)c(Cl)c3)c[nH]c24)cc1)C(O)=O |r|
CN[C@@H](Cc1ccc(Oc2cc3cc(c2O)-c2cccc4c(C[C@@H](N)C(=O)N[C@H](c5cc(Cl)c(O)c(Cl)c5)C(=O)N[C@H]3C(O)=O)c[nH]c24)cc1)C(O)=O |r|
[H][C@@]12NC(=O)[C@H](NC(=O)[C@@H](Cc3c[nH]c4c(cccc34)-c3cc1cc(Oc1ccc(C[C@H](N(C)C(=O)[C@H](NC2=O)c2cc(Cl)c(O)c(Cl)c2)C(O)=O)cc1)c3O)NC(=O)C(=O)c1cc(Cl)c(O)c(Cl)c1)c1cc(Cl)c(O)c(Cl)c1 |r|
CN([C@@H](Cc1ccc(Oc2cc3cc(c2O)-c2cccc4c(C[C@@H](N)C(=O)N[C@H](c5cc(Cl)c(O)c(Cl)c5)C(=O)N[C@H]3C(O)=O)c[nH]c24)cc1)C(O)=O)C(=O)[C@H](N)c1cc(Cl)c(O)c(Cl)c1 |r|
[H][C@@]12NC(=O)[C@H](NC(=O)[C@@H](CC3(O)C(=O)Nc4cc(ccc34)-c3cc1cc(Oc1ccc(C[C@H](N(C)C(=O)[C@H](NC2=O)c2cc(Cl)c(O)c(Cl)c2)C(=O)N[C@@H](C(O)=O)c2ccc(O)cc2)cc1)c3O)NC(=O)C(=O)c1cc(Cl)c(O)c(Cl)c1)c1cc(Cl)c(O)c(Cl)c1 |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)CCSC)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C(C)C)C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(O)=O |r|
COc1cc(ccc1O[C@@H]1O[C@H](COC(=O)\C=C\c2cc(OC)c(O)c(OC)c2)[C@@H](O)[C@H](O)[C@H]1O)C(O)=O |r|
C1C=C([C@@H]2[C@H]1C(=CO[C@H]2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)O)CO
COC(=O)[C@]1(O)C[C@@H](O)[C@@H](OC(=O)\C=C\c2cc(OC)c(O)c(OC)c2)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1 |r|
COC(=O)[C@@]1(O)C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H](OC(=O)C(C)(O)CC(O)=O)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1 |r,wU:7.7,wD:32.35,21.22,4.4,(26.06,-20.05,;27.39,-20.82,;28.72,-20.05,;28.72,-18.51,;30.06,-20.82,;29.28,-22.15,;30.05,-19.28,;31.37,-18.5,;31.35,-16.95,;32.68,-16.2,;34.01,-16.98,;32.69,-14.66,;34.03,-13.9,;34.04,-12.36,;35.38,-11.61,;35.39,-10.07,;34.06,-9.29,;34.07,-7.75,;32.72,-10.06,;31.39,-9.28,;32.71,-11.59,;32.71,-19.25,;34.04,-18.47,;35.38,-19.23,;35.39,-20.77,;36.7,-18.45,;35.92,-17.12,;37.49,-19.77,;38.03,-17.66,;39.37,-18.42,;40.69,-17.63,;39.38,-19.96,;32.72,-20.8,;31.41,-21.59,;34.06,-21.55,;34.09,-23.09,;32.77,-23.9,;35.44,-23.83,;35.47,-25.37,;36.82,-26.11,;36.85,-27.65,;38.2,-28.39,;39.51,-27.59,;40.87,-28.33,;39.47,-26.04,;40.79,-25.24,;38.12,-25.31,)|
CCOC(=O)[C@@]1(O)C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H](O)[C@@H](C1)OC(=O)\C=C\c1cc(OC)c(O)c(OC)c1 |r|
COC(=O)[C@@]1(O)C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H](O)[C@@H](C1)OC(=O)\C=C\c1cc(OC)c(O)c(OC)c1 |r|
CCOC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1 |r|
[H][C@]12CC=C(CO)[C@@]1([H])[C@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C(=O)OC |r,c:26,t:3|
O[C@H]1[C@@H](C[C@@](O)(C[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O)OC(=O)\C=C\c1ccc(O)c(O)c1 |r,wU:2.25,4.22,wD:1.0,7.8,4.4,(-1.06,-23.53,;-1.06,-21.99,;.29,-21.22,;.29,-19.66,;-1.06,-18.89,;.22,-18.03,;-2.39,-19.66,;-2.39,-21.22,;-3.73,-21.99,;-3.73,-23.53,;-2.39,-24.3,;-5.06,-24.3,;-5.06,-25.84,;-6.39,-26.61,;-7.73,-25.84,;-9.06,-26.61,;-9.06,-28.15,;-10.39,-28.92,;-7.72,-28.92,;-7.71,-30.46,;-6.39,-28.15,;-1.91,-17.6,;-.95,-16.4,;-3.45,-17.53,;1.62,-21.99,;1.61,-23.53,;.28,-24.3,;2.95,-24.3,;2.94,-25.84,;4.27,-26.62,;4.26,-28.16,;5.59,-28.93,;6.93,-28.16,;8.26,-28.93,;6.93,-26.61,;8.26,-25.84,;5.6,-25.85,)|
CCOC(=O)[C@]1(O)C[C@@H](O)[C@@H](OC(=O)\C=C\c2cc(OC)c(O)c(OC)c2)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1 |r|
O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O |r|
COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O |w:12.11,5.4|
O[C@H]1[C@H](O)[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)O[C@@H]1COC(=O)c1cc(O)c(O)c(O)c1 |r|
COC(=O)c1cc(O)c(O)c(O)c1
OC[C@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)c(O)c2)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](O)[C@H]1O |r|
O[C@H]1CO[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)cc2)[C@H](O)[C@H]1O |r|
C[C@@H]1O[C@@H](Oc2c(O)c3c(cc(O)cc3=O)oc2-c2ccc(O)cc2)[C@H](O)[C@H](O)[C@H]1O |r|
O[C@H]1[C@@H](COC(=O)c2cc(O)c(O)c(O)c2)O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)c(O)c2)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H]1O |r|
Oc1cc(cc(O)c1O)C(=O)OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H]1OC(=O)c1cc(O)c(O)c(O)c1 |r|
O[C@H]1CO[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)c(O)c2)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H]1O |r|
OC[C@H]1O[C@@H](Oc2c(O)c3c(cc(O)cc3=O)oc2-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@H]1O |r|
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(Oc3cc(cc(c3C2=O)O)O)c4ccc(c(c4)O)O)O)O)O
[H][C@@]12CCCN1C(=O)[C@@H](NC(=O)c1csc(CNC(=O)c3csc(n3)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC2=O)n1)C(C)C |r|
OC1=C(C2CCCCN2C1=O)C(=O)NCc1ccc(F)cc1 |t:1|
OC1=C(C(N(CCN2CCOCC2)C1=O)C(=O)NCc1ccc(F)cc1)C(=O)NCc1ccc(F)cc1 |t:1|
OC1=C(CN(CCN2CCCCC2)C1=O)C(=O)NCc1ccc(F)cc1 |t:1|
OC1=C(CN(CCCc2ccccc2)C1=O)C(=O)NCc1ccc(F)cc1 |t:1|
OC1=C(CN(Cc2ccccc2)C1=O)C(=O)NCc1ccc(F)cc1 |t:1|
CN1C(C(C(=O)NCc2ccc(F)cc2)=C(O)C1=O)c1ccccc1 |t:15|
COc1ccccc1CCN1CC(C(=O)NCc2ccc(F)cc2)=C(O)C1=O |t:25|
OC1=C(CN(Cc2ccccn2)C1=O)C(=O)NCc1ccc(F)cc1 |t:1|
Cc1cccc(CN2CC(C(=O)NCc3ccc(F)cc3)=C(O)C2=O)c1 |t:21|
COC(=O)C(\O)=C\C(=O)c1cccc(OCc2ccccc2)c1
OC(=O)C(\O)=C\C(=O)c1ccccc1
OC(=O)C(\O)=C\C(=O)c1ccc(cc1)[N+]([O-])=O
COc1cccc(c1)C(=O)CC(=O)C(=O)N1CCN(CC1)C(=O)C(=O)CC(=O)c1cccc(OC)c1
COc1cccc(c1)C(=O)CC(=O)C(=O)NC1CCC(CC1)NC(=O)C(=O)CC(=O)c1cccc(OC)c1 |(21.13,-17.07,;19.8,-17.83,;19.8,-19.37,;18.46,-20.14,;18.47,-21.69,;19.8,-22.45,;21.12,-21.68,;21.13,-20.14,;22.45,-22.45,;22.45,-23.99,;23.79,-21.68,;25.12,-22.45,;25.13,-24,;26.46,-21.68,;26.46,-20.14,;27.8,-22.44,;29.11,-21.64,;30.46,-22.37,;31.77,-21.57,;31.73,-20.04,;30.38,-19.3,;29.06,-20.09,;33.05,-19.23,;33,-17.69,;31.65,-16.95,;34.32,-16.89,;35.67,-17.62,;34.28,-15.34,;35.59,-14.54,;36.95,-15.28,;35.55,-13,;36.87,-12.2,;36.84,-10.68,;35.48,-9.94,;34.16,-10.74,;32.81,-10.01,;32.77,-8.48,;34.21,-12.28,)|
FC(F)(F)c1ccc(cc1)C(=O)CC(=O)C(=O)N1CCN(CC1)C(=O)C(=O)CC(=O)c1ccc(cc1)C(F)(F)F
Clc1ccccc1C(=O)CC(=O)C(=O)N1CCN(CC1)C(=O)C(=O)CC(=O)c1ccccc1Cl
Clc1ccccc1C(=O)CC(=O)C(=O)NC1CCN(CC1)C(=O)C(=O)CC(=O)c1ccccc1Cl
OC(=O)C(\O)=C\C(=O)c1ccccc1Cl
Cc1cc(ccc1Cl)C(=O)\C=C(/O)C(O)=O
COC(=O)C(\O)=C\C(=O)c1cccc(Cc2ccccc2F)c1
CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)C(\O)=C\C(=O)c1ccc(F)cc1
Fc1ccc(cc1)C(=O)CC(=O)C(=O)NC1CCC(CC1)NC(=O)C(=O)CC(=O)c1ccc(F)cc1 |(8.82,-41.88,;10.15,-42.65,;11.48,-41.88,;12.81,-42.65,;12.81,-44.19,;11.49,-44.96,;10.16,-44.2,;14.14,-44.96,;14.14,-46.5,;15.47,-44.19,;16.81,-44.96,;16.82,-46.51,;18.15,-44.19,;18.15,-42.65,;19.48,-44.96,;20.8,-44.15,;22.14,-44.88,;23.46,-44.08,;23.42,-42.55,;22.07,-41.81,;20.74,-42.61,;24.73,-41.75,;24.69,-40.21,;23.34,-39.46,;26.01,-39.4,;27.36,-40.13,;25.96,-37.86,;27.28,-37.05,;28.63,-37.79,;27.24,-35.51,;28.55,-34.72,;28.52,-33.19,;27.16,-32.46,;27.13,-30.92,;25.85,-33.26,;25.89,-34.8,)|
COC(=O)C(\O)=C\C(=O)c1ccc(F)cc1
c1ccc(c(c1)C(=O)C=C(C(=O)O)O)F
COC(=O)C(\O)=C\C(=O)c1ccccc1F
O=C(CC(=O)c1cccc(OCc2ccccc2)c1)C(=O)OC1CCN(CC1)C(=O)C(=O)CC(=O)c1cccc(OCc2ccccc2)c1
c1ccc(cc1)COc2cccc(c2)C(=O)CC(=O)C(=O)N3CCN(CC3)C(=O)C(=O)CC(=O)c4cccc(c4)OCc5ccccc5
O=C(CC(=O)c1cccc(OCc2ccccc2)c1)C(=O)NC1CCN(CC1)C(=O)C(=O)CC(=O)c1cccc(OCc2ccccc2)c1
O=C(CC(=O)c1cccc(OCc2ccccc2)c1)C(=O)NC1CCC(CC1)NC(=O)C(=O)CC(=O)c1cccc(OCc2ccccc2)c1 |(-2.39,-9.08,;-2.4,-7.52,;-3.73,-6.76,;-5.07,-7.52,;-5.07,-9.07,;-6.4,-6.76,;-7.73,-7.53,;-9.06,-6.76,;-9.07,-5.21,;-7.73,-4.44,;-7.73,-2.91,;-6.39,-2.14,;-6.39,-.6,;-5.07,.17,;-5.06,1.7,;-6.39,2.47,;-7.73,1.7,;-7.73,.17,;-6.4,-5.21,;-1.06,-6.76,;-1.06,-5.21,;.28,-7.52,;1.59,-6.72,;2.94,-7.45,;4.26,-6.64,;4.22,-5.11,;2.87,-4.37,;1.54,-5.17,;5.53,-4.31,;5.49,-2.77,;4.13,-2.02,;6.81,-1.96,;8.17,-2.7,;6.76,-.41,;8.08,.39,;9.44,-.35,;8.04,1.93,;9.36,2.73,;9.33,4.26,;7.97,4.99,;6.65,4.19,;5.3,4.92,;3.99,4.12,;2.63,4.85,;2.6,6.39,;1.25,7.12,;-.07,6.32,;-.02,4.78,;1.33,4.05,;6.69,2.65,)|
CCCCCC12CCC(CC1)(CC2)C(=O)Nc1cccc(c1)C(=O)CC(=O)C(O)=O
COc1cccc(c1)C(=O)CC(=O)C(=O)NC1CCN(CC1)C(=O)C(=O)CC(=O)c1cccc(OC)c1
OC(=O)C(\O)=C\C(=O)c1ccc(cc1)C(F)(F)F
Clc1ccccc1C(=O)CC(=O)C(=O)NC1CCC(CC1)NC(=O)C(=O)CC(=O)c1ccccc1Cl |(20.05,-16.63,;18.72,-17.4,;17.39,-16.63,;16.06,-17.4,;16.06,-18.94,;17.4,-19.71,;18.72,-18.94,;20.05,-19.7,;20.05,-21.25,;21.38,-18.94,;22.71,-19.7,;22.73,-21.25,;24.05,-18.94,;24.05,-17.39,;25.39,-19.7,;26.7,-18.9,;28.05,-19.63,;29.36,-18.82,;29.33,-17.29,;27.98,-16.56,;26.65,-17.35,;30.64,-16.49,;30.6,-14.95,;29.24,-14.2,;31.91,-14.14,;33.27,-14.88,;31.87,-12.6,;33.19,-11.79,;34.54,-12.54,;33.15,-10.26,;31.8,-9.54,;31.75,-8,;33.07,-7.2,;34.43,-7.94,;34.46,-9.46,;35.81,-10.2,)|
COC(=O)C(\O)=C\C(=O)c1cccc(NC(=O)OCc2ccccc2)c1
Fc1ccc(cc1)C(=O)CC(=O)C(=O)NC1CCN(CC1)C(=O)C(=O)CC(=O)c1ccc(F)cc1
Fc1ccccc1C(=O)CC(=O)C(=O)NC1CCC(CC1)NC(=O)C(=O)CC(=O)c1ccccc1F |(4.24,-28.05,;5.54,-27.24,;5.5,-25.7,;6.82,-24.9,;8.17,-25.64,;8.21,-27.16,;6.89,-27.96,;6.93,-29.49,;8.28,-30.24,;5.61,-30.3,;5.66,-31.84,;7.01,-32.58,;4.34,-32.65,;2.99,-31.9,;4.39,-34.19,;3.07,-34.99,;3.11,-36.52,;1.8,-37.33,;.45,-36.6,;.4,-35.05,;1.72,-34.26,;-.86,-37.4,;-2.2,-36.63,;-2.2,-35.09,;-3.54,-37.4,;-3.53,-38.95,;-4.87,-36.63,;-6.2,-37.4,;-6.2,-38.95,;-7.54,-36.63,;-8.86,-37.41,;-10.19,-36.64,;-10.2,-35.09,;-8.86,-34.33,;-7.53,-35.09,;-6.2,-34.33,)|
OC(=O)C(\O)=C\C(=O)c1cccc(OCc2ccccc2)c1
COC(=O)C(\O)=C\C(=O)c1ccc(OC)c(OCc2ccccc2)c1
FC(F)(F)c1ccc(cc1)C(=O)CC(=O)C(=O)NC1CCC(CC1)NC(=O)C(=O)CC(=O)c1ccc(cc1)C(F)(F)F |(13,-21.73,;14.33,-22.5,;13.57,-23.83,;15.11,-21.18,;15.67,-23.27,;17,-22.5,;18.33,-23.27,;18.33,-24.81,;17,-25.58,;15.67,-24.82,;19.66,-25.58,;19.66,-27.12,;20.99,-24.81,;22.33,-25.58,;22.34,-27.13,;23.67,-24.81,;23.67,-23.27,;25,-25.58,;26.32,-24.77,;27.66,-25.5,;28.98,-24.7,;28.94,-23.17,;27.59,-22.43,;26.27,-23.23,;30.26,-22.37,;30.21,-20.83,;28.86,-20.08,;31.53,-20.02,;32.88,-20.75,;31.48,-18.47,;32.8,-17.67,;34.16,-18.41,;32.76,-16.13,;34.08,-15.33,;34.05,-13.81,;32.69,-13.07,;31.37,-13.87,;31.42,-15.41,;32.65,-11.54,;32.64,-9.99,;31.11,-11.56,;34.19,-11.52,)|
COC(=O)C(\O)=C\C(=O)c1cccc(c1)N(Cc1ccccc1)Cc1ccccc1
COc1cccc(c1)C(=O)\C=C(/O)C(O)=O
Fc1ccc(cc1)C(=O)CC(=O)C(=O)N1CCN(CC1)C(=O)C(=O)CC(=O)c1ccc(F)cc1
COc1ccc(cc1OCc1ccccc1)C(=O)\C=C(/O)C(O)=O
OC(=O)C(\O)=C\C(=O)c1ccc2n(Cc3ccc(F)cc3)cc(C(=O)\C=C(/O)C(O)=O)c(=O)c2c1
CCOC(=O)C(\O)=C\C(=O)c1c[nH]c2ccc(Cl)cc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(ccc2c1=O)N1CCCC1
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2c(Cl)cccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(Cl)ccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(F)ccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2ccc(F)cc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(Cl)c(Cl)cc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(Cl)ccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2ccc(F)cc2c1=O
O\C(=C/C(=O)c1c[nH]c2ccc(Cl)cc12)c1nnn[nH]1
OC(=O)C(\O)=C\C(=O)c1c[nH]c2ccc(Cl)cc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1c[nH]c2cc(Cl)ccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(Cl)c(Cl)cc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2ccc(Cl)cc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2c(F)cccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(ccc2c1=O)N1CCCC1
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2ccc(Cl)cc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2c(F)cccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2c(Cl)cccc2c1=O
OC(=O)C(\O)=C\C(=O)c1c[nH]c2cc(Cl)ccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(F)ccc2c1=O
OC(=O)C(=O)CC(=O)c1cccn1Cc1ccc(F)cc1
OC(=O)c1cc([nH]n1)-c1cccc(OCc2ccccc2)c1
OC(=O)c1cc(no1)-c1cccc(OCc2ccccc2)c1
ONC(=O)c1cc(on1)-c1cccc(OCc2ccccc2)c1
OC(=O)c1cc(ns1)-c1cccc(OCc2ccccc2)c1
COC(=O)c1cc([nH]n1)-c1ccc(cc1)[N+]([O-])=O
OC(=O)c1csnc1-c1cccc(OCc2ccccc2)c1
OC(=O)c1cc(on1)-c1cccc(OCc2ccccc2)c1
OC(=O)c1cc([nH]n1)-c1ccc(cc1)[N+]([O-])=O
OC(=O)c1cc(on1)-c1ccc(cc1)[N+]([O-])=O
OCCn1cc(C(O)=O)c(=O)c2cc(Oc3ccc(F)c(Cl)c3)ccc12
CCn1cc(C(O)=O)c(=O)c2C(=O)C(Sc3ccccc3)=CC(=O)c12 |c:21|
CCn1cc(C(O)=O)c(=O)c2C(=O)C(Nc3ccc(F)c(Cl)c3)=CC(=O)c12 |c:23|
OCCn1cc(C(O)=O)c(=O)c2cc(ccc12)-c1ccncc1
CCn1cc(C(O)=O)c(=O)c2cc(Nc3cccc(Cl)c3F)ccc12
OCCn1cc(C(O)=O)c(=O)c2cc(ccc12)C(=O)Nc1ccccc1
OCCn1cc(C(O)=O)c(=O)c2cc(\C=C\c3ccccc3)ccc12
OCCCn1cc(C(O)=O)c(=O)c2cc(ccc12)C(=O)c1ccc(Cl)cc1Cl
OCCn1cc(C(O)=O)c(=O)c2cc(ccc12)C(=O)c1ccc(Cl)cc1Cl
OCCCn1cc(C(O)=O)c(=O)c2cc(Cc3ccc(Cl)cc3Cl)ccc12
OCCn1cc(C(O)=O)c(=O)c2cc(Cc3ccc(Cl)cc3Cl)ccc12
OCCn1cc(C(O)=O)c(=O)c2cc(Sc3ccccc3)ccc12
OCCCCn1cc(C(O)=O)c(=O)c2cc(Cc3ccc(Cl)cc3Cl)ccc12
CCn1cc(C(O)=O)c(=O)c2C(=O)C(Nc3cccc(Cl)c3F)=CC(=O)c12 |c:23|
OCCn1cc(C(O)=O)c(=O)c2cc(ccc12)-c1ccccc1
OCCn1cc(C(O)=O)c(=O)c2cc(Nc3cccc(Cl)c3F)ccc12
OCCCCn1cc(C(O)=O)c(=O)c2cc(ccc12)C(=O)c1ccc(Cl)cc1Cl
OCCn1cc(C(O)=O)c(=O)c2cc(NC(=O)c3ccccc3)ccc12
CCn1cc(C(O)=O)c(=O)c2C(=O)C=CC(=O)c12 |c:13|
CN(C)CCn1cc(C(O)=O)c(=O)c2cc(Cc3ccc(Cl)cc3Cl)ccc12
COCCn1cc(C(O)=O)c(=O)c2cc(Cc3ccc(Cl)cc3Cl)ccc12
OC(=O)\C=C\c1ccc(O)c(O)c1\C(=C\c1ccc(O)c(O)c1)C(O)=O
OC(=O)\C=C\c1ccc(O)c2OC3C(C(=O)c4cc(O)c(O)cc34)c12
c1cc(c(cc1\C=C\C(=O)O)O)O
OC(=O)Cc1c(O)c(O)ccc1\C=C\C(O)=O
OC1=C(C(OC1=O)c1ccc(F)cc1)c1ccc(O)cc1 |t:1|
OC1=C(C(OC1=O)c1ccc(OCc2ccccc2)cc1)c1ccc(O)cc1 |t:1|
OC1=C(C(OC1=O)c1ccc(O)cc1)c1ccc(O)cc1 |t:1|
OC1=C(C(OC1=O)c1ccc(O)cc1)c1ccc(F)cc1 |t:1|
OC1=C(C(OC1=O)c1cc(O)cc(O)c1)c1ccc(F)cc1 |t:1|
OC1=C(C(OC1=O)c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1)c1ccc(F)cc1 |t:1|
OC1=C(C(OC1=O)c1cc(OCc2ccccc2)cc(OCc2ccccc2)c1)c1ccc(O)cc1 |t:1|
OC1=C(C(OC1=O)c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1)c1ccc(O)cc1 |t:1|
OC1=C(C(OC1=O)c1ccccc1)c1ccc(O)cc1 |t:1|
OC1=C(C(OC1=O)c1ccc(OCc2ccccc2)cc1)c1ccc(F)cc1 |t:1|
OC1=C(C(OC1=O)c1cc(OCc2ccccc2)cc(OCc2ccccc2)c1)c1ccc(F)cc1 |t:1|
OC1=C(C(OC1=O)c1cc(O)cc(O)c1)c1ccc(O)cc1 |t:1|
OC1=C(C(OC1=O)c1ccc(O)c(O)c1)c1ccc(O)cc1 |t:1|
OC1=C(COC1=O)c1ccc(O)cc1 |t:1|
Clc1ccc(NC(=O)c2cc(c(SCc3ccccc3)cc2Cl)S(=O)(=O)Nc2nc3ccccc3c(=O)[nH]2)cc1
Clc1cc(SCc2ccccc2)c(cc1C(=O)Nc1ccccc1)S(=O)(=O)Nc1nc2ccccc2c(=O)[nH]1
NC(=O)c1cc(c(SCc2ccccc2)cc1Cl)S(=O)(=O)Nc1nc2ccccc2c(=O)[nH]1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2cc(sc2c(=O)n1Cc1ccco1)-c1ccsc1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2cc(sc2c(=O)n1Cc1ccccc1)-c1ccc(Cl)cc1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2ccsc2c(=O)n1Cc1ccco1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2ccsc2c(=O)n1Cc1ccccc1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2ccccc2c(=O)n1Cc1ccco1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2n[nH]cc2c(=O)n1N
Cc1sc2nc(NS(=O)(=O)c3cc(C)c(Cl)cc3S)n(N)c(=O)c2c1C
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2cc(sc2c(=O)n1N)C(C)(C)C
Cc1cc(c(SCc2ccccc2)cc1Cl)S(=O)(=O)Nc1nc2ccsc2c(=O)[nH]1
Cc1cc(c(SCc2ccccc2)cc1Cl)S(=O)(=O)Nc1nc2cscc2c(=O)[nH]1
COc1ccc(NC(=O)c2cc(c(SCc3ccccc3)cc2Cl)S(=O)(=O)Nc2nc3ccccc3c(=O)[nH]2)cc1
Cc1ccc(NC(=O)c2cc(c(SCc3ccccc3)cc2Cl)S(=O)(=O)Nc2nc3ccccc3c(=O)[nH]2)cc1
Cc1cc(c(SCc2ccccc2)cc1Cl)S(=O)(=O)Nc1nc2ccccc2c(=O)[nH]1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2cc(sc2c(=O)n1Cc1ccccc1)-c1ccccc1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2cscc2c(=O)n1Cc1ccccc1
Cc1csc2nc(NS(=O)(=O)c3cc(C)c(Cl)cc3S)n(N)c(=O)c12
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2ccsc2c(=O)n1N
COc1cc2nc(NS(=O)(=O)c3cc(C)c(Cl)cc3S)n(N)c(=O)c2cc1OC
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc(N)n[nH]1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2ccccc2c(=O)n1N
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2cc(sc2c(=O)n1Cc1ccccc1)C(C)(C)C
Cc1cc(c(SCc2ccccc2)cc1Cl)S(=O)(=O)Nc1nc2cc(Cl)ccc2c(=O)[nH]1
Cc1cc(c(SCc2ccccc2)cc1Cl)S(=O)(=O)Nc1nc(=O)c2ccccc2n1C
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2cscc2c(=O)n1N
COc1ccc(cc1O)-c1c2c(n3ccc4cc(OC)c(OC)cc4c13)c(=O)oc1cc(OS(O)(=O)=O)c(OC)cc21
[H][C@@]12C[C@H](C)C[C@H](C(O)=O)[C@@]1([H])[C@](C)(C(=O)CCO)C([C@H](C)CCCC)=C(O)C2=O |r,t:26|
[H][C@@]12[C@H](O)[C@H](C)C[C@H](O)[C@@]1([H])[C@](C)(C(=O)\C=C/O)C([C@H](C)CCCCCC)=C(O)C2=O |r,t:27|
OCC(O)C#CC#CCCCCC#CC#C\C=C\Br
OCC(O)C#CC#CCCCCCCC#C\C=C/Br
OS(=O)(=O)OCCC#CC#CCCCCC#CC#C\C=C\Br
OC(COS(O)(=O)=O)C#CC#CCCCCCCCC\C=C\Br
OC(COS(O)(=O)=O)C#CC#CCCCCCCC#C\C=C\Br
OCC(O)C#CC#CCCCCCCC#C\C=C\Br
OCC(O)C#CC#CCCCCCCCC\C=C\Br
OCC(O)C#CC#CCCCC\C=C\C#C\C=C\Br
CN1CC(CC1=O)c1nc(C(=O)NCc2ccc(F)cc2S(C)(=O)=O)c(O)c2ncccc12
CN(C)C(=O)CN1CC(CC1=O)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
Oc1c(nc(C2CNC(=O)C2)c2cccnc12)C(=O)NCc1ccc(F)cc1
CCN1CC(CC1=O)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
CN1CC(CC1=O)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
CCN1CC(CC1=O)c1nc(C(=O)NCc2ccc(F)cc2S(C)(=O)=O)c(O)c2ncccc12
CC(C)N1CC(CC1=O)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
Cc1cc2O[B-](F)(F)OC(=C/C=C/C3=[O+][B-](F)(F)Oc4cc(C)oc(=O)c34)c2c(=O)o1
COc1ccc(Br)cc1\C=C\C1=[O+][B-](F)(F)Oc2cc(\C=C\c3ccc(cc3)N(C)C)oc(=O)c12 |t:12|
COc1ccc(\C=C\C(=O)c2c(O)cc(\C=C\c3ccc(cc3)N(C)C)oc2=O)cc1
CN(C)c1ccc(\C=C\C(=O)c2c(O)cc(\C=C\c3ccc(cc3)N(C)C)oc2=O)cc1
CN(C)c1ccc(\C=C\C2=[O+][B-](F)(F)Oc3cc(\C=C\c4ccc(cc4)N(C)C)oc(=O)c23)cc1 |t:9|
CN(C)c1ccc(\C=C\C=C\C(=O)c2c(O)cc(C)oc2=O)cc1
CN1\C(=C\C=C\C(=O)c2c(O)cc(C)oc2=O)C(C)(C)c2ccccc12
Cc1cc(O)c(C(=O)\C=C\c2ccc(Br)cc2)c(=O)o1
Cc1cc2O[B-](F)(F)[O+]=C(\C=C\c3ccc(Br)s3)c2c(=O)o1 |t:8|
CN(C)c1ccc(\C=C\C(=O)c2c(O)cc(C)oc2=O)s1
Cc1cc2O[B-](F)(F)[O+]=C(\C=C\c3ccc(Br)cc3)c2c(=O)o1 |t:8|
CN(C)c1ccc(\C=C\C2=[O+][B-](F)(F)Oc3cc(C)oc(=O)c23)cc1 |t:9|
Cc1cc2O[B-](F)(F)[O+]=C(\C=C\c3ccc(F)cc3)c2c(=O)o1 |t:8|
Cc1cc(O)c(C(=O)\C=C\c2ccc(F)cc2)c(=O)o1
CN(C)c1ccc(\C=C\C=C\C2=[O+][B-](F)(F)Oc3cc(C)oc(=O)c23)cc1 |t:11|
COc1ccc(\C=C\C=C\C2=[O+][B-](F)(F)Oc3cc(C)oc(=O)c23)cc1 |t:10|
COc1ccc(\C=C\C=C\C(=O)c2c(O)cc(C)oc2=O)cc1
COc1ccc(\C=C\C2=[O+][B-](F)(F)Oc3cc(\C=C\c4ccc(cc4)N(C)C)oc(=O)c23)cc1 |t:8|
CN(C)c1ccc(\C=C\C2=[O+][B-](F)(F)Oc3cc(C)oc(=O)c23)s1 |t:9|
COc1ccc(Br)cc1\C=C\C(=O)c1c(O)cc(\C=C\c2ccc(cc2)N(C)C)oc1=O
Cc1cc(O)c(C(=O)\C=C\c2ccc(Br)s2)c(=O)o1
CN1\C(=C\C=C\C2=[O+][B-](F)(F)Oc3cc(C)oc(=O)c23)C(C)(C)c2ccccc12 |t:6|
ON1C(=O)Cc2ccc(NC(=O)Cc3ccc(F)cc3)cc2C1=O
ON1C(=O)Cc2ccc(NC(=O)Cc3ccccc3)cc2C1=O
c1ccc2c(c1)CC(=O)N(C2=O)O
ON1C(=O)Cc2ccc(cc2C1=O)[N+]([O-])=O
ON1C(=O)Cc2ccc(I)cc2C1=O
CC(=O)Nc1ccc2CC(=O)N(O)C(=O)c2c1
ON1C(=O)Cc2ccc(NC(=O)c3ccc(F)cc3)cc2C1=O
ON1C(=O)Cc2ccc(cc2C1=O)-c1ccc(F)cc1
ON1C(=O)Cc2ccc(cc2C1=O)-c1ccc(O)cc1
ON1C(=O)Cc2ccc(cc2C1=O)-c1ccc(cc1)C(F)(F)F
ON1C(=O)Cc2ccc(Br)cc2C1=O
CCCCC(=O)Nc1ccc2CC(=O)N(O)C(=O)c2c1
ON1C(=O)Cc2ccc(NC(=O)c3cccc(c3)[N+]([O-])=O)cc2C1=O
ON1C(=O)Cc2ccc(cc2C1=O)-c1ccccc1
ON1C(=O)Cc2ccc(Cl)cc2C1=O
ON1C(=O)Cc2ccc(cc2C1=O)-c1ccc(O)c(O)c1
ON1C(=O)Cc2ccc(NC(=O)c3ccccc3)cc2C1=O
ON1C(=O)Cc2ccc(O)cc2C1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(F)c2F)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2F)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2c(F)cccc2F)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(F)cc(F)c2)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(F)c(F)c(F)c2)c2cccc(OC)c12
COc1cccc2n(Cc3ccccc3F)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3cccc(F)c3F)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3ccc(F)cc3F)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3cc(F)ccc3F)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3cc(F)cc(F)c3)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3ccc(F)c(F)c3F)cc(C(=O)\C=C(/O)C(O)=O)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccccc2F)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(F)c2)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(F)ccc2F)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2c(F)ccc(F)c2F)c2cccc(OC)c12
COc1cccc2n(Cc3cccc(F)c3)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3c(F)cccc3F)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3c(F)ccc(F)c3F)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3ccc(F)c(F)c3)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3cc(F)c(F)c(F)c3)cc(C(=O)\C=C(/O)C(O)=O)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)c(F)c2)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)c(F)c2F)c2cccc(OC)c12
CCCCCCC(C)OC(=O)\C=C\c1ccc(O)c(O)c1
c1ccc(cc1)CCOC(=O)/C=C/c2ccc(c(c2)O)O
Oc1ccc(\C=C\C(=O)Oc2ccc3ccccc3c2)cc1O
COc1cc(\C=C\C(O)=O)cc(c1O)[N+]([O-])=O
COc1cc(\C=C\C(=O)OCCc2ccccc2)cc(c1O)[N+]([O-])=O
Oc1cc(\C=C\C(=O)OCCc2ccccc2)cc(c1O)[N+]([O-])=O
CC1(C)C2CCC1(C)C(C2)OC(=O)\C=C\c1cc(O)c(O)c(c1)[N+]([O-])=O |TLB:10:8:1:5.4|
COc1cc(\C=C\C(O)=O)cc(Cl)c1O
COc1cc(\C=C\C(=O)OC2CC3CCC2(C)C3(C)C)cc(Cl)c1O |THB:9:10:17:14.13|
COc1cc(\C=C\C(=O)OCCc2ccccc2)cc(Br)c1O
COc1c(O)ccc(\C=C\C(O)=O)c1[N+]([O-])=O
COc1c(O)ccc(\C=C\C(=O)OC2CC3CCC2(C)C3(C)C)c1[N+]([O-])=O |THB:12:13:20:17.16|
OC(=O)\C=C\c1ccc(O)c(O)c1[N+]([O-])=O
CC1(C)C2CCC1(C)C(C2)OC(=O)\C=C\c1ccc(O)c(O)c1[N+]([O-])=O |TLB:10:8:1:5.4|
CC(C)(C)OC(=O)\C=C\c1ccc(O)c(O)c1
CC(C)(COC(=O)\C=C\c1ccc(O)c(O)c1)[N+]([O-])=O
CCCCCCCCOC(=O)\C=C\c1ccc(O)c(O)c1
CCOC(=O)/C=C/c1ccc(c(c1)O)O
CCCOC(=O)\C=C\c1ccc(O)c(O)c1
Oc1ccc(\C=C\C(=O)OCC=C)cc1O
CCCCOC(=O)\C=C\c1ccc(O)c(O)c1
CCCCCCCCCCCCCCCCCCOC(=O)\C=C\c1ccc(O)c(O)c1
CCCCCCCOC(=O)\C=C\c1ccc(O)c(O)c1
Oc1ccc(\C=C\C(=O)OCC#C)cc1O
Oc1ccc(\C=C\C(=O)OC2CCCCC2)cc1O
CC(C)OC(=O)\C=C\c1ccc(O)c(O)c1
CCC(C)OC(=O)\C=C\c1ccc(O)c(O)c1
Oc1ccc(\C=C\C(=O)Oc2ccccc2)cc1O
CC1(C)C2CCC1(C)C(C2)OC(=O)\C=C\c1ccc(O)c(O)c1 |TLB:10:8:1:5.4|
COc1cc(\C=C\C(=O)OC2CC3CCC2(C)C3(C)C)cc(c1O)[N+]([O-])=O |THB:9:10:17:14.13|
COc1cc(ccc1O)\C=C\C(=O)O
COc1cc(\C=C\C(O)=O)cc(Br)c1O
COc1c(O)ccc(\C=C\C(=O)OCCc2ccccc2)c1[N+]([O-])=O
OC(=O)\C=C\c1cc(O)c(O)c(c1)[N+]([O-])=O
Oc1ccc(\C=C\C(=O)OCc2ccccc2)cc1O
COc1cc(\C=C\C(=O)OCCc2ccccc2)cc(Cl)c1O
COC(=O)\C=C\c1ccc(O)c(O)c1
COc1cc(\C=C\C(=O)OC2CC3CCC2(C)C3(C)C)cc(Br)c1O |THB:9:10:17:14.13|
Oc1ccc(\C=C\C(=O)OCCc2ccccc2)c(c1O)[N+]([O-])=O
CC(C)Cn1c2ccccc2c(O)c(C(=O)Nc2ccccc2S(N)(=O)=O)c1=O
COc1ccc2n(C)c(=O)c(C(O)=O)c(O)c2c1
Cn1c2ccc(Cc3ccc(F)cc3)cc2c(O)c(C(O)=O)c1=O
CCOC(=O)c1c(O)c2cc(OC)ccc2n(C)c1=O
CCOC(=O)c1c(O)c2cc(Cc3ccccc3)ccc2n(C)c1=O
CCCCCn1c2ccccc2c(O)c(C(=O)Nc2cc(ccc2O)[N+]([O-])=O)c1=O
Cn1c2ccc(Oc3ccccc3)cc2c(O)c(C(O)=O)c1=O
CCOC(=O)c1c(O)c2cc(Cc3ccc(F)cc3)ccc2n(C)c1=O
CCCCCn1c2ccc(Cc3ccc(F)cc3)cc2c(O)c(C(O)=O)c1=O
Cn1c2ccc(Cc3ccccc3)cc2c(O)c(C(O)=O)c1=O
CCN(C(=O)CN1CCOCC1)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CCN(C(=O)c1ccncc1)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CCN(C(=O)c1nnc(C)o1)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CCN(C(=O)c1cscn1)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CC(=O)N1CCN(Cc2cccn3c2nc(C(=O)NCc2ccc(F)cc2)c(O)c3=O)CC1
Oc1c(nc2c(CN3CCOCC3)cccn2c1=O)C(=O)NCc1ccc(F)cc1
Cc1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CN(C)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CCNc1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CCN(C(=O)c1ccno1)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CN(C)C(=O)C(=O)N(C)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CCCN(C(=O)C(=O)N(C)C)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CC(C)N(C(=O)C(=O)N(C)C)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CCN(C(=O)C(=O)N1CCCC1)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CCN(C(=O)C(=O)N1CCN(C)CC1)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CCN(C(=O)C(=O)N1CCOCC1)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CCN(C(=O)CN(C)C)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Oc1c(nc2c(CNC(=O)c3ccccc3)cccn2c1=O)C(=O)NCc1ccc(F)cc1
Oc1c(nc2c(NC(=O)c3ccccc3)cccn2c1=O)C(=O)NCc1ccc(F)cc1
CNc1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CCN(C(=O)c1ccccn1)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CCN(C(=O)C(=O)N(C)C)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CCN(CC)C(=O)C(=O)N(CC)c1cccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Oc1c(nc2ccccn2c1=O)C(=O)NCc1ccc(F)cc1
OC(=O)C(\O)=C\C(=O)c1cccc(NC(=O)c2ccccc2Cl)c1
OC(=O)C(\O)=C\C(=O)c1cccc(NC(=O)c2cccc(Cl)c2)c1
OC(=O)C(\O)=C\C(=O)c1cccc(NC(=O)\C=C\c2ccc(O)cc2)c1
OC(=O)C(\O)=C\C(=O)c1cccc(NC(=O)\C=C\c2ccc(Cl)cc2)c1
COc1ccc(\C=C\C(=O)Nc2cccc(c2)C(=O)\C=C(/O)C(O)=O)cc1
COc1cc(\C=C\C(=O)Nc2cccc(c2)C(=O)\C=C(/O)C(O)=O)ccc1O
OC(=O)C(\O)=C\C(=O)c1cccc(NC(=O)c2ccccc2)c1
OC(=O)C(\O)=C\C(=O)c1cccc(NC(=O)Cc2ccccc2)c1
OC(=O)C(\O)=C\C(=O)c1cccc(NC(=O)c2ccco2)c1
OC(=O)C(\O)=C\C(=O)c1cccc(NC(=O)c2ccccc2O)c1
OC(=O)C(\O)=C\C(=O)c1cccc(NC(=O)c2cc(cc(c2O)[N+]([O-])=O)[N+]([O-])=O)c1
Cc1cccc(C(=O)Nc2cccc(c2)C(=O)\C=C(/O)C(O)=O)c1O
COc1ccccc1C(=O)Nc1cccc(c1)C(=O)\C=C(/O)C(O)=O
COc1cccc(c1)C(=O)Nc1cccc(c1)C(=O)\C=C(/O)C(O)=O
COc1ccc(cc1)C(=O)Nc1cccc(c1)C(=O)\C=C(/O)C(O)=O
OC(=O)C(\O)=C\C(=O)c1cccc(NC(=O)c2ccc(O)cc2)c1
OC(=O)C(\O)=C\C(=O)c1cccc(NC(=O)\C=C\c2ccc(F)cc2)c1
OC(C(O)=O)C(O)(Cc1ccc(O)c(O)c1)C(O)=O
OC(=O)[C@@H](OC(=O)\C=C\c1ccc(O)c(O)c1)[C@H](OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O |r|
Cc1cc2c(SC(=NS2(=O)=O)C(=O)c2ccc(Cl)c(Cl)c2)cc1Cl |c:6|
Cc1cc2c(SC(=NS2(=O)=O)C(=O)c2ccc3ccccc3c2)cc1Cl |c:6|
Cc1cc(Cl)cc2SC(=NS(=O)(=O)c12)C(=O)c1ccc(Cl)c(Cl)c1 |c:8|
Clc1ccc(cc1)C(=O)C1=NS(=O)(=O)c2ccc(Cl)cc2S1 |t:10|
Cc1cc2c(SC(NS2(=O)=O)C(=O)c2ccccc2)cc1Cl
COc1ccc(cc1)C(=O)C1NS(=O)(=O)c2cc(C)c(Cl)cc2S1
Cc1cc2c(SC(NS2(=O)=O)C(=O)c2ccc(Br)cc2)cc1Cl
Cc1cc2c(SC(NS2(=O)=O)C(=O)c2ccc(Cl)c(Cl)c2)cc1Cl
Cc1cc2c(SC(NS2(=O)=O)C(=O)c2ccc3ccccc3c2)cc1Cl
Cc1cc(Cl)cc2SC(NS(=O)(=O)c12)C(=O)c1ccc(Cl)c(Cl)c1
Cc1cc(Cl)cc2SC(NS(=O)(=O)c12)C(=O)c1ccc2ccccc2c1
Clc1ccc(cc1)C(=O)C1NS(=O)(=O)c2ccc(Cl)cc2S1
Cc1cc2c(SC(=NS2(=O)=O)C(=O)c2ccccc2)cc1Cl |c:6|
Cc1cc2c(SC(=NS2(=O)=O)C(=O)c2ccc(Br)cc2)cc1Cl |c:6|
Cc1cc2c(SC(=NS2(=O)=O)C(=O)c2ccc(Cl)cc2)cc1Cl |c:6|
Cc1cc(Cl)cc2SC(=NS(=O)(=O)c12)C(=O)c1ccc(Cl)cc1 |c:8|
Clc1ccc2c(SC(=NS2(=O)=O)C(=O)c2ccc(Cl)c(Cl)c2)c1 |c:7|
Cc1cc2c(SC(NS2(=O)=O)C(=O)c2cccc(c2)[N+]([O-])=O)cc1Cl
Clc1ccc2c(SC(NS2(=O)=O)C(=O)c2ccc3ccccc3c2)c1
Clc1ccc(cc1Cl)C(=O)C1NS(=O)(=O)c2ccccc2S1
Cc1cc(Cl)cc2SC(=NS(=O)(=O)c12)C(=O)c1ccc2ccccc2c1 |c:8|
COc1ccc(cc1)C(=O)C1=NS(=O)(=O)c2cc(C)c(Cl)cc2S1 |t:11|
Cc1cc2c(SC(NS2(=O)=O)C(=O)c2ccc(Cl)cc2)cc1Cl
Clc1ccc2c(SC(NS2(=O)=O)C(=O)c2ccc(Cl)c(Cl)c2)c1
Clc1ccc2c(SC(=NS2(=O)=O)C(=O)c2ccc3ccccc3c2)c1 |c:7|
Cc1cc2c(SC(=NS2(=O)=O)C(=O)c2cccc(c2)[N+]([O-])=O)cc1Cl |c:6|
Cc1cc(Cl)cc2SC(NS(=O)(=O)c12)C(=O)c1ccc(Cl)cc1
[#8]-[#6](=O)-c1cc(F)ccc1-c1ccc(\[#6]=[#6]-2\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)o1
[#8]-[#6](=O)-c1cc(ccc1Cl)-c1ccc(\[#6]=[#6]-2\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)o1
[#8]-[#6](=O)-c1cccc(-c2ccc(\[#6]=[#6]-3\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-3=O)o2)c1-[#8]
[#8]-[#6](=O)-c1cc(-[#8])c(-[#8])c(c1)-c1ccc(\[#6]=[#6]-2\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)o1
[#6]-[#8]-c1cc(cc(-[#8]-[#6])c1-c1ccc(\[#6]=[#6]-2\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)o1)-[#6](-[#8])=O
[#6]-c1c(cccc1-[#7+](-[#8-])=O)-c1ccc(\[#6]=[#6]-2\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)o1
[#6]-c1cc(oc1\[#6]=[#6]-1\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-1=O)-c1ccc(-[#6](-[#8])=O)c(-[#8])c1
OC(=O)c1cc(ccc1Cl)-c1ccc(\C=C2/SC(=S)NC2=O)o1
OC(=O)c1cc(O)c(O)c(c1)-c1ccc(\C=C2/SC(=S)NC2=O)o1
OC(=O)c1ccc(cc1O)-c1ccc(\C=C2/NC(=S)NC2=O)o1
OC(=O)c1cc(ccc1O)-c1ccc(\C=C2/NC(=S)NC2=O)o1
[#8]-[#6](=O)-c1ccc(cc1-[#8])-c1ccc(\[#6]=[#6]-2\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)o1
[#8]-[#6](=O)-c1cc(ccc1-[#8])-c1ccc(\[#6]=[#6]-2\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)o1
[#6]-[#8]-c1cc(-c2ccc(\[#6]=[#6]-3\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-3=O)o2)c(Cl)cc1-[#6](-[#8])=O
[#6]-c1ccc(cc1-c1ccc(\[#6]=[#6]-2\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)o1)-[#6](-[#8])=O
OC(=O)c1ccc(cc1O)-c1ccc(\C=C2/SC(=S)NC2=O)o1
Cc1cc(oc1\C=C1/SC(=S)NC1=O)-c1ccc(C(O)=O)c(O)c1
Cc1cc(oc1\C=C1/NC(=S)NC1=O)-c1ccc(C(O)=O)c(O)c1
[#8]-[#6](=O)-c1cc2-[#8]-[#6]-[#8]-c2c(c1)-c1ccc(\[#6]=[#6]-2\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)o1
COc1cc(-c2ccc(\C=C3/SC(=S)NC3=O)o2)c(Cl)cc1C(O)=O
COc1cc(oc1\C=C1/SC(=S)NC1=O)-c1ccc(C(O)=O)c(O)c1
COC(=O)C(=O)O[C@@]1(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H](O)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O |r,wU:9.9,7.42,wD:25.28,23.24,7.6,(-2.29,6.46,;-3.81,6.19,;-4.32,4.73,;-5.84,4.45,;-3.33,3.56,;-3.84,2.11,;-1.81,3.84,;-.81,2.67,;.53,1.91,;.54,.37,;1.88,-.39,;3.21,.39,;4.55,-.37,;3.2,1.93,;4.52,2.71,;4.51,4.25,;5.84,5.03,;5.83,6.57,;4.49,7.33,;4.48,8.87,;3.16,6.55,;1.82,7.31,;3.17,5.01,;-.79,-.41,;-.78,-1.95,;-2.13,.35,;-2.14,1.89,;-3.46,-.43,;-3.44,-1.97,;-4.77,-2.75,;-2.1,-2.73,;-2.09,-4.27,;-.75,-5.03,;.58,-4.25,;1.92,-5.01,;1.93,-6.55,;3.27,-7.31,;.6,-7.33,;.61,-8.87,;-.74,-6.57,;.17,3.86,;-.37,5.3,;1.69,3.6,)|
Cc1cc(O)c(C=O)c2Oc3c(C)c(C(O)=O)c(O)c(COC(=O)\C=C\C(O)=O)c3OC(=O)c12
NC(=O)c1c[nH]c2ccc(Cc3ccccc3)cc2c1=O
OC(=O)c1c[nH]c2ccc(Cc3cccc(Cl)c3)cc2c1=O
OC(=O)c1c[nH]c2ccc(Cc3ccccc3F)cc2c1=O
Cc1ccccc1Cc1ccc2[nH]cc(C(O)=O)c(=O)c2c1
OC(=O)c1c[nH]c2ccc(Cc3cc(Cl)ccc3Cl)cc2c1=O
OC(=O)c1c[nH]c2ccc(Cc3cccc(Cl)c3Cl)cc2c1=O
Cn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)ccc12
CCCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)ccc12
NC(=O)Cn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)ccc12
NC(=O)CCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)ccc12
OCCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)ccc12
OCCCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)ccc12
OCCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)c(F)cc12
COc1cc2n(CCO)cc(C(O)=O)c(=O)c2cc1Cc1cccc(Cl)c1Cl
OCCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)c(cc12)C(F)(F)F
C[C@@H](CO)n1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3F)ccc12 |r|
CCC[C@@H](CO)n1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3F)ccc12 |r|
CC(C)[C@@H](CO)n1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3F)ccc12
CC(C)(C)[C@@H](CO)n1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3F)ccc12 |r|
CCC[C@@H](CO)n1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3F)c(OC)cc12 |r|
COc1cc2n(cc(C(O)=O)c(=O)c2cc1Cc1cccc(Cl)c1F)[C@H](CO)C(C)(C)C |r|
Cn1cc(C(=O)C(O)=O)c(=O)c2cc(Cc3ccccc3)ccc12
OC(=O)c1cnc2ccc(Cc3ccccc3)cc2c1O
OCCn1cc(C(O)=O)c(=O)c2c(F)c(Cc3cccc(Cl)c3Cl)ccc12
OC(=O)c1c[nH]c2ccc(Cc3ccccc3C(F)(F)F)cc2c1=O
OC(=O)CCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)ccc12
OCCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)cc(F)c12
CC[C@@H](CO)n1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3F)ccc12 |r|
COc1ccccc1Cc1ccc2[nH]cc(C(O)=O)c(=O)c2c1
CCOC(=O)c1cnc2ccc(Cc3ccccc3)cc2c1O
OC(=O)c1c[nH]c2ccc(Cc3ccccc3Cl)cc2c1=O
OC(=O)c1c[nH]c2ccc(Cc3c(Cl)cccc3Cl)cc2c1=O
CCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)ccc12
CCCCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)ccc12
NCCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)ccc12
OCCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(F)c3Cl)ccc12
OCCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)c(cc12)C#N
C[C@H](CO)n1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3F)ccc12 |r|
OC[C@H](C1CCCCC1)n1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3F)ccc12 |r|
CC(C)n1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)ccc12
OC(=O)c1c[nH]c2ccc(Cc3ccc(Cl)cc3)cc2c1=O
OC(=O)Cn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)ccc12
Cc1cc2n(CCO)cc(C(O)=O)c(=O)c2cc1Cc1cccc(Cl)c1Cl
COc1cc2n(cc(C(O)=O)c(=O)c2cc1Cc1cccc(Cl)c1F)[C@H](CO)C1CCCCC1 |r|
OC[C@H](c1ccccc1)n1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3F)ccc12 |r|
OCCn1cc(C(O)=O)c(=O)c2cc(Cc3cccc(Cl)c3Cl)c(Cl)cc12
Cn1cc(C(O)=O)c(=O)c2cc(Cc3ccccc3)ccc12
COc1c2CCc3cc4C5Sc6ccccc6N5C(=O)c4c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc4C5NCCCN5C(=O)c4c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc4C5SCC(N5C(=O)c4c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12)C(O)=O
COc1c2CCc3cc(C4NCc5ccccc5N4)c(C(O)=O)c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc(\C=N\C45CC6CC(CC(C6)C4)C5)c(C(O)=O)c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12 |TLB:14:15:13.18.12:19,THB:14:13:15.16.20:19,16:15:12:18.17.19,16:17:14.15.20:12|
COc1c2CCc3cc(\C=N\NC(=O)c4ccccc4)c(C(O)=O)c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc(C(O)=O)c(C(O)=O)c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc(\C=N\NC(=O)c4ccccc4O)c(C(O)=O)c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc(\C=N\Nc4ccc(cc4)[N+]([O-])=O)c(C(O)=O)c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc4cnn(CC(O)=O)c(=O)c4c(OCc4ccccc4)c3-c2c(OCc2ccccc2)c2C(=O)c3cc(OCc4ccccc4)c(C)c(OCc4ccccc4)c3C(=O)c12
CCCn1ncc2cc3CCc4c(OC)c5C(=O)c6c(O)c(C)c(O)cc6C(=O)c5c(O)c4-c3c(O)c2c1=O
COc1c2CCc3cc4cnn(CCOC(C)=O)c(=O)c4c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc4cn[nH]c(=O)c4c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc4cnn(-c5ccc(cc5)C(O)=O)c(=O)c4c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc4cnn(C(N)=N)c(=O)c4c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
CO\N=C\c1cc2CCc3c(OC)c4C(=O)c5c(O)c(C)c(O)cc5C(=O)c4c(O)c3-c2c(O)c1C(O)=O
CCCn1ncc2cc3CCc4c(OC)c5C(=O)c6c(OC(C)=O)c(C)c(OC(=O)OC)cc6C(=O)c5c(O)c4-c3c(O)c2c1=O
COc1c2CCc3cc4C(O)N(N(C)C)C(=O)c4c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
CCCn1ncc2cc3CCc4c(OC)c5C(=O)c6c(OC(C)=O)c(C)c(OC(C)=O)cc6C(=O)c5c(OC(C)=O)c4-c3c(OC(C)=O)c2c1=O
COc1c2CCc3cc4cnn(-c5ccccc5)c(=O)c4c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc(\C=N\NC(C)(C)C)c(C(O)=O)c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc(\C=N\NS(=O)(=O)c4ccc(C)cc4)c(C(O)=O)c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc(\C=N\NC(N)=N)c(C(O)=O)c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc4cnn(CC(O)=O)c(=O)c4c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
CCOC(=O)Cn1ncc2cc3CCc4c(OC)c5C(=O)c6c(O)c(C)c(O)cc6C(=O)c5c(O)c4-c3c(O)c2c1=O
COc1c2CCc3cc4C5NCc6ccccc6N5C(=O)c4c(O)c3-c2c(O)c2C(=O)c3cc(O)c(C)c(O)c3C(=O)c12
COc1c2CCc3cc4cnn(-c5ccccc5)c(=O)c4c(OC(C)=O)c3-c2c(OC(C)=O)c2C(=O)c3cc(OC(C)=O)c(C)c(OC(C)=O)c3C(=O)c12
COC(=O)Oc1cc2C(=O)c3c(O)c-4c(CCc5cc6cnn(-c7ccccc7)c(=O)c6c(O)c-45)c(OC)c3C(=O)c2c(O)c1C
Oc1ccc2CN(Cc3cccc(F)c3)C(=O)c2c1O
Oc1ccc2CN(Cc3ccccc3F)C(=O)c2c1O
Oc1ccc2CN(Cc3ccc(F)c(F)c3)C(=O)c2c1O
Oc1ccc2CN(Cc3cc(F)ccc3F)C(=O)c2c1O
Oc1ccc2CN(Cc3cccc(F)c3F)C(=O)c2c1O
Oc1ccc2CN(Cc3ccc(F)cc3F)C(=O)c2c1O
Oc1ccc2CN(Cc3ccc(F)c(Br)c3)C(=O)c2c1O
Oc1ccc2CN(Cc3ccc(Cl)c(F)c3)C(=O)c2c1O
Oc1ccc2CN(Cc3cc(Cl)ccc3F)C(=O)c2c1O
c1cc(c(c(c1)Cl)F)CN2Cc3ccc(c(c3C2=O)O)O
Oc1ccc2CN(Cc3ccc(F)c(F)c3F)C(=O)c2c1O
Oc1ccc2CN(Cc3cc(F)c(F)cc3F)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3cc(F)c(F)cc3F)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3c(F)ccc(F)c3Cl)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3cc(Cl)c(F)cc3F)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3c(F)c(F)c(F)c(F)c3F)C(=O)c2c1O
Oc1ccc2CN(Cc3cc(Cl)c(F)cc3F)C(=O)c2c1O
Oc1ccc2CN(Cc3c(F)c(F)c(F)c(F)c3F)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3ccc(F)cc3)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3ccccc3F)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3cccc(Cl)c3)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3cccc(I)c3)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3ccc(F)c(F)c3)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3cc(F)cc(F)c3)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3ccc(F)cc3F)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3c(F)cccc3F)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3ccc(F)c(Br)c3)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3ccc(Cl)c(F)c3)C(=O)c2c1O
c1cc(c(c(c1)Cl)F)CN2C(=O)c3ccc(c(c3C2=O)O)O
Oc1ccc2C(=O)N(Cc3cc(F)c(F)c(F)c3)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3ccc(F)c(F)c3F)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3c(F)ccc(F)c3F)C(=O)c2c1O
Oc1ccc2CN(Cc3cccc(Cl)c3)C(=O)c2c1O
Oc1ccc2CN(Cc3cc(F)cc(F)c3)C(=O)c2c1O
Oc1ccc2CN(Cc3c(F)cccc3F)C(=O)c2c1O
Cc1cc(CN2Cc3ccc(O)c(O)c3C2=O)ccc1F
Oc1ccc2CN(Cc3ccc(Cl)c(Cl)c3)C(=O)c2c1O
Oc1ccc2CN(Cc3c(F)cccc3Cl)C(=O)c2c1O
Oc1ccc2CN(Cc3c(F)ccc(F)c3F)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3cccc(F)c3)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3cccc(F)c3F)C(=O)c2c1O
Cc1cc(CN2C(=O)c3ccc(O)c(O)c3C2=O)ccc1F
Oc1ccc2C(=O)N(Cc3ccc(Cl)c(Cl)c3)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3ccccc3)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3c(F)cccc3Cl)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3cc(F)ccc3F)C(=O)c2c1O
Oc1ccc2CN(Cc3cccc(Br)c3)C(=O)c2c1O
Oc1ccc2CN(Cc3ccc(F)cc3Cl)C(=O)c2c1O
Oc1ccc2CN(Cc3cc(F)c(F)c(F)c3)C(=O)c2c1O
Oc1ccc2CN(Cc3c(F)ccc(F)c3Cl)C(=O)c2c1O
c1cc(c(cc1CN2C(=O)c3ccc(c(c3C2=O)O)O)Cl)F
Oc1ccc2C(=O)N(Cc3ccc(F)cc3Cl)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3cccc(Br)c3)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3cc(Cl)ccc3F)C(=O)c2c1O
Oc1ccc2CN(Cc3cccc(I)c3)C(=O)c2c1O
Cc1nnc(o1)C(=O)NC(C)(C)c1nc(C(=O)NCc2ccc(F)cc2)c([O-])c(=O)n1C
CN(C)[C@@H]1CCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O |r|
CN1Cn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)C1(C)C
CC1(C)NC(=O)n2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CC1(C)NCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CN1CCn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)C1(C)C
CC(=O)N1CCn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)C1(C)C
CN(C)C(=O)C(=O)N1CCn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)C1(C)C
CN(C)S(=O)(=O)N1CCn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)C1(C)C
CCN(CC)CCN1CCn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)C1(C)C
CC1(C)N(CC(N)=O)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CNC(=O)CN1CCn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)C1(C)C
CN(C)C(=O)CN1CCn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)C1(C)C
CC1(C)N(CC(=O)N2CCCC2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CN1CCN(CC1)C(=O)CN1CCn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)C1(C)C
CC1(C)N(CCc2ccccn2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CC1(C)N(Cc2ccn[nH]2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Cn1nccc1CN1CCn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)C1(C)C
Cn1ccc(CN2CCn3c(nc(C(=O)NCc4ccc(F)cc4)c(O)c3=O)C2(C)C)n1
CC1(C)N(Cc2cn[nH]c2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CC1(C)N(Cc2cscn2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Cn1cnc(CN2CCn3c(nc(C(=O)NCc4ccc(F)cc4)c(O)c3=O)C2(C)C)n1
CC1(C)N(Cc2nnco2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Cc1noc(CN2CCn3c(nc(C(=O)NCc4ccc(F)cc4)c(O)c3=O)C2(C)C)n1
Cc1nc(CN2CCn3c(nc(C(=O)NCc4ccc(F)cc4)c(O)c3=O)C2(C)C)no1
CC1(C)N(Cc2nnn[nH]2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Cn1nnnc1CN1CCn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)C1(C)C
Cn1nnc(CN2CCn3c(nc(C(=O)NCc4ccc(F)cc4)c(O)c3=O)C2(C)C)n1
CC1(C)NC(=O)Cn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CC1=C(C=C2C(CCC(CC#N)C2(C)C)C1=C)C(=C)CCc1ccc(C)cc1 |c:3,t:1|
CC1(C)N(Cc2cocn2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Cn1cc(CN2CCn3c(nc(C(=O)NCc4ccc(F)cc4)c(O)c3=O)C2(C)C)nn1
CC1(C)NS(=O)(=O)Cn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CC1(C)NCCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CCNC(=O)N1CCn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)C1(C)C
CC1(C)N(CCN2CCOCC2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CC1(C)N(Cc2ccccc2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CC1(C)N(Cc2cnccn2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CC1(C)N(Cc2cnn[nH]2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CC1(C)N(Cc2cnco2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Cc1cnc(CN2CCn3c(nc(C(=O)NCc4ccc(F)cc4)c(O)c3=O)C2(C)C)o1
Cn1nncc1CN1CCn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)C1(C)C
Cc1cc(CN2CCn3c(nc(C(=O)NCc4ccc(F)cc4)c(O)c3=O)C2(C)C)on1
CC1(C)N(CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O)S(C)(=O)=O
CC1(C)N(Cc2ccccn2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Cc1nnc(CN2CCn3c(nc(C(=O)NCc4ccc(F)cc4)c(O)c3=O)C2(C)C)o1
CN(C)CCN1CCn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)C1(C)C
CC1(C)N(CC(O)=O)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
CC1(C)N(CC(=O)N2CCOCC2)CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Oc1cc(cc(O)c1O)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(F)cc1
Oc1cc(cc(O)c1O)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccccc1
Oc1cc(cc(O)c1O)C(=O)Nc1ccc(cc1)S(=O)(=O)NCc1ccc(Cl)cc1
Oc1cc(cc(O)c1O)C(=O)Nc1ccc(cc1)S(=O)(=O)NCc1ccc(F)cc1
Cc1ccccc1NS(=O)(=O)c1ccc(NC(=O)c2cc(O)c(O)c(O)c2)cc1
NS(=O)(=O)c1ccc(NC(=O)c2cc(O)c(O)c(O)c2)cc1
CCCCc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3cc(O)c(O)c(O)c3)cc2)cc1
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3cc(O)c(O)c(O)c3)cc2)cc1C
Oc1cc(cc(O)c1O)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(Br)cc1
Oc1cc(cc(O)c1O)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(F)c(F)c1
Oc1cc(cc(O)c1O)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)cc1
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)c3cc(O)c(O)c(O)c3)cc2)c1
Oc1ccc(\C=C\C(=O)Nc2ccc(cc2)S(=O)(=O)Nc2ccccc2)cc1O
CC(=O)Oc1cc(cc(OC(C)=O)c1OC(C)=O)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccccc1C
CC(=O)Oc1cc(cc(OC(C)=O)c1OC(C)=O)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccccc1
Oc1cc(cc(O)c1O)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c(Cl)c1
Oc1ccc(cc1O)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccccc1
Oc1cc(cc(O)c1O)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1cccc(Br)c1
Oc1cc(cc(O)c1O)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(F)c(F)c1F
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3cc(O)c(O)c(O)c3)cc2)cc1
Oc1cc(cc(O)c1O)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)[N+]([O-])=O
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3cc(O)c(O)c(O)c3)cc2)cc1
OC(=O)C(=O)CC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(Br)cc2c1=O
CCOC(=O)C(=O)CC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(Br)cc2c1=O
OC(=O)C(=O)CC(=O)c1ccc2n(Cc3ccc(F)cc3)cc(C(=O)CC(=O)C(O)=O)c(=O)c2c1
CN1CCC[C@@]1(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1 |r|
CC(=O)N1CCC[C@@]1(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1 |r|
CC(=O)N1CCCCC1(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1
CN1CCCCC1(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
CN1CCN(CC1(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C)S(C)(=O)=O
Oc1c(nc([nH]c1=O)C1CCCN1)C(=O)NCc1ccc(F)cc1
CC(=O)N1CCCC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1
CN1CCCCC1c1nc(O)c(O)c(n1)C(=O)NCc1ccc(F)cc1
CC(=O)N1CCCCC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1
CN1CCCCC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
CN1CCN(C(C1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1)C(C)=O
CN1CCN(C(C1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1)C(=O)c1cnccn1
CN1CCCCC1(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1
CN(C)S(=O)(=O)N1CCN(C)C(C)(C1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
CC1(CCCCN1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1
CN1CCCC1c1nc(O)c(O)c(n1)C(=O)NCc1ccc(F)cc1
Cc1nc(C)c(s1)C(=O)N1CCCCC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1
CN(C)S(=O)(=O)N1CCN(C)C(C1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
C[C@]1(CCCN1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1 |r|
CN1CCN(C(C)=O)C(C)(C1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1
CN1CCN(CC1(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C)C(C)=O
Cc1nc(C)c(s1)C(=O)N1CCCCC1(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1
CN1CCN(CC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C)S(C)(=O)=O
CN1CCN(C(=O)c2cnccn2)C(C)(C1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1
Oc1nc(nc(C(=O)NCc2ccc(F)cc2)c1O)C1CCCCN1
CN1CCN(CC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C)C(C)=O
OC(=O)C(\O)=C\C(=O)c1cc(OCc2ccccc2)cc(OCc2ccccc2)c1
CN(C(C)=O)c1cc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
CC(=O)N1CCN(CC1)c1cc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
CN1CCN(CC1)c1cc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
Oc1c(ccc2cccnc12)C(=O)NCc1ccc(F)cc1
Oc1c(ccc2cccnc12)C(=O)c1cccc(Cc2ccccc2)c1
Oc1c2C(=O)N(Cc3ccc(F)cc3)Cc2c(C(=O)N2CCOCC2)c2cccnc12
Oc1c2C(=O)N(Cc3ccc(F)cc3)Cc2c(C(=O)NCc2ccccn2)c2cccnc12
CCOC(=O)c1cccc(c1)-c1c2CN(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
CCOc1ccc(cc1)-c1c2CN(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
COc1c2CN(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
COc1c2C(=O)N(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
OC(=O)C(\O)=C\C(=O)c1ccc(Oc2ccccc2)cc1
OC(=O)C(\O)=C\C(=O)c1cccc(Br)c1
OC(=O)C(\O)=C\C(=O)c1cccc(CN=[N+]=[N-])c1
OC(=O)C(\O)=C\C(=O)c1cc(CN=[N+]=[N-])cc(CN=[N+]=[N-])c1
OC(=O)C(\O)=C\C(=O)c1cccc(Cc2ccc(F)cc2)c1
OC(=O)C(\O)=C\C(=O)c1cccc(Cc2ccccc2F)c1
OC(=O)C(\O)=C\C(=O)c1ccc(Cc2ccccc2)s1
OC(=O)C(\O)=C\C(=O)c1csc(Cc2ccccc2)c1
OC(=O)C(\O)=C\C(=O)c1cccc(Cc2cccc(F)c2)c1
OC(=O)C(\O)=C\C(=O)c1cccc(Cc2ccc(Cl)cc2)c1
OC(=O)C(\O)=C\C(=O)c1ccccc1Cc1ccccc1
OC(=O)C(\O)=C\C(=O)c1cccn1Cc1ccc(cc1)-c1ccccc1
CN(C)S(=O)(=O)Oc1c2CN(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
CN(C)C(=O)Oc1c2C(=O)N(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
CN(CCNc1cc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12)C(C)=O
CN(C)C(=O)C(=O)N(C)c1cc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
COc1cnc2c(O)c3C(=O)N(Cc4ccc(F)cc4)Cc3c(OC)c2c1
Oc1c2C(=O)N(Cc3ccc(F)cc3)Cc2c(-c2c(F)cccc2F)c2cccnc12 |(-1.61,-44.23,;-1.62,-42.69,;-2.95,-41.93,;-4.42,-42.4,;-4.9,-43.87,;-5.33,-41.15,;-6.67,-41.92,;-8,-41.14,;-7.98,-39.61,;-9.31,-38.83,;-10.65,-39.59,;-11.98,-38.81,;-10.66,-41.14,;-9.33,-41.91,;-4.41,-39.9,;-2.94,-40.38,;-1.61,-39.61,;-1.61,-38.07,;-.28,-37.31,;1.06,-38.08,;-.28,-35.77,;-1.61,-35,;-2.95,-35.78,;-2.94,-37.32,;-4.27,-38.09,;-.28,-40.39,;1.04,-39.61,;2.38,-40.37,;2.39,-41.93,;1.04,-42.7,;-.29,-41.93,)|
CN(C)C(=O)Oc1c2CN(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
OC(=O)C(\O)=C\C(=O)C(=O)c1cccc(c1)C(=O)c1ccccc1
OC(=O)C(\O)=C\C(=O)c1cccc(Cc2cccc(Cl)c2)c1
COc1ccc(Cc2cccc(c2)C(=O)\C=C(/O)C(O)=O)cc1
OC(=O)C(\O)=C\C(=O)c1ccn(Cc2ccccc2)c1
OC(=O)C(\O)=C\C(=O)C1C=CSC1Cc1ccccc1 |c:9|
OC(=O)C(\O)=C\C(=O)c1cccn1CCCc1ccccc1
OC(=O)C(\O)=C\C(=O)c1cccc(Cc2ccccc2Cl)c1
CCOC(=O)c1ccccc1-c1c2CN(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12 |(27.2,-19.28,;28.36,-20.3,;28.07,-21.81,;29.23,-22.82,;28.93,-24.33,;30.69,-22.32,;30.68,-20.78,;32.02,-20,;33.36,-20.77,;33.36,-22.31,;32.02,-23.08,;32.02,-24.62,;30.69,-25.39,;29.22,-24.9,;28.3,-26.16,;26.96,-26.93,;25.63,-26.15,;25.65,-24.61,;24.32,-23.83,;22.98,-24.59,;21.65,-23.81,;22.97,-26.14,;24.3,-26.91,;29.21,-27.4,;28.74,-28.87,;30.69,-26.93,;32.02,-27.7,;32.02,-29.24,;33.34,-26.93,;34.68,-27.7,;36.02,-26.93,;36.01,-25.38,;34.68,-24.63,;33.35,-25.39,)|
Oc1c2C(=O)N(Cc3ccc(F)cc3)Cc2cc2cccnc12
COc1cccc(Cc2cccc(c2)C(=O)\C=C(/O)C(O)=O)c1
Oc1c(ncc2cccnc12)C(=O)c1cccc(Cc2ccccc2)c1
OC(=O)C(\O)=C\C(=O)c1cccn1Cc1ccccc1
ONC(=O)c1cc2ccn(Cc3ccc(F)cc3C#N)c2cn1
ONC(=O)c1cc2ccn(Cc3ccc(cc3)C#N)c2cn1
NC(=O)c1cc(Cn2ccc3cc(ncc23)C(=O)NO)ccc1F
NC(=O)c1ccc(Cn2ccc3cc(ncc23)C(=O)NO)cc1
CN(O)C(=O)c1cc2ccn(Cc3ccc(F)cc3F)c2cn1
CON(C)C(=O)c1cc2ccn(Cc3ccc(F)cc3F)c2cn1
OCCCN(O)C(=O)c1cc2ccn(Cc3ccc(F)cc3)c2cn1
OC(=O)c1cc2ccn(Cc3ccc(F)cc3)c2cn1
OC(=O)c1cc2ccn(Cc3ccc(F)c(F)c3F)c2cn1
OC(=O)c1cc2ccn(Cc3c(F)cc(Cl)cc3F)c2cn1
OC(=O)c1cc2ccn(Cc3cccc(Cl)c3Cl)c2cn1
OC(=O)c1cc2ccn(Cc3cc(Cl)cs3)c2cn1
ONC(=O)c1cc2ccn(Cc3c(F)ccc(Cl)c3F)c2cn1
ONC(=O)c1cc2ccn(Cc3cccc(c3)C#N)c2cn1
ON(Cc1ccccc1)C(=O)c1cc2ccn(Cc3ccc(F)cc3)c2cn1
CCCN(O)C(=O)c1cc2ccn(Cc3ccc(F)cc3)c2cn1
ONC(=O)c1cc2ccn(Cc3ccc(Cl)s3)c2cn1
OC(=O)c1cc2ccn(Cc3ccccc3F)c2cn1
ONC(=O)c1cc2ccn(Cc3ccc(F)cc3)c2cn1
NC(=O)c1cc(F)ccc1Cn1ccc2cc(ncc12)C(=O)NO
CONC(=O)c1cc2ccn(Cc3ccc(F)cc3F)c2cn1
OC(=O)c1cc2ccn(Cc3ccc(F)cc3F)c2cn1
OC(=O)c1cc2ccn(Cc3cccc(Cl)c3F)c2cn1
ONC(=O)c1cc2ccn(Cc3ccc(F)cc3F)c2cn1
ONC(=O)c1cc2ccn(Cc3cccc(Cl)c3Cl)c2cn1
NC(=O)c1cccc(Cn2ccc3cc(ncc23)C(=O)NO)c1
OCc1cccnc1Cn1ccc2cc(ncc12)C(=O)NO
CN(O)C(=O)c1cc2ccn(Cc3ccc(F)cc3)c2cn1
ONC(=O)c1cc2ccn(Cc3cccc(Cl)c3F)c2cn1
ONC(=O)c1cc2ccn(Cc3ccccn3)c2cn1
CC(C)N(O)C(=O)c1cc2ccn(Cc3ccc(F)cc3)c2cn1
CC(C)CN(O)C(=O)c1cc2ccn(Cc3ccc(F)cc3)c2cn1
Oc1ccc2C(=O)N(Cc3cccc4ccccc34)C(=O)c2c1O
Oc1ccc2C(=O)N(Cc3ccc4ccccc4c3)C(=O)c2c1O
C[C@H](N1Cc2ccc(O)c(O)c2C1=O)c1cccc2ccccc12 |r|
C[C@@H](C1CCc2ccccc12)N1Cc2ccc(O)c(O)c2C1=O |r|
Oc1ccc2C(=O)N(CCc3ccccc3)C(=O)c2c1O
C[C@@H](C1CCCc2ccccc12)N1Cc2ccc(O)c(O)c2C1=O |r|
Oc1ccc2C(=O)N([C@H]3CCCc4ccccc34)C(=O)c2c1O |r|
Oc1ccc2CN(C3Cc4ccccc4C3)C(=O)c2c1O
Oc1ccc2CN(Cc3ccc4ccccc4c3)C(=O)c2c1O
C[C@@H](N1Cc2ccc(O)c(O)c2C1=O)c1ccc(F)cc1 |r|
Oc1ccc2C(=O)N(C3Cc4ccccc4C3)C(=O)c2c1O
Oc1ccc2C(=O)N([C@@H]3CCCc4ccccc34)C(=O)c2c1O |r|
C[C@H](C1CCc2ccccc12)N1Cc2ccc(O)c(O)c2C1=O |r|
C[C@@H](N1Cc2ccc(O)c(O)c2C1=O)c1ccccc1 |r|
C[C@H](C1CCCc2ccccc12)N1Cc2ccc(O)c(O)c2C1=O |r|
Oc1ccc2C(=O)N([C@H]3CCc4ccccc34)C(=O)c2c1O |r|
Oc1ccc2C(=O)N([C@@H]3CCc4ccccc34)C(=O)c2c1O |r|
C[C@@H](N1Cc2ccc(O)c(O)c2C1=O)c1ccc2ccccc2c1 |r|
C[C@H](N1Cc2ccc(O)c(O)c2C1=O)c1ccc(F)cc1 |r|
C[C@H](N1Cc2ccc(O)c(O)c2C1=O)c1ccc2ccccc2c1 |r|
C[C@@H](N1Cc2ccc(O)c(O)c2C1=O)c1cccc2ccccc12 |r|
C[C@H](N1Cc2ccc(O)c(O)c2C1=O)c1ccccc1 |r|
CC(C)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(O)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(C)C)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(O)=O |r|
Oc1nc(nc(C(=O)NCc2nccs2)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCc2cncs2)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCc2csc3ccccc23)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCc2cccs2)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCn2ccnc2)c1O)-c1cccs1
Oc1nc(nc(C(=O)Nc2ccc3ccccc3c2)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCc2cc3ccccc3s2)c1O)-c1cccs1
Oc1nc(nc(C(=O)NCn2cncn2)c1O)-c1cccs1
Nc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(=O)NCCCCCCCCCCCCO)n3cnc4c(N)ncnc34)[C@@H](COP(O)(O)=O)O2)c(=O)n1 |r|
NCCCCCCNP(O)(=O)O[C@H]1C[C@@H](O[C@@H]1COP(O)(=O)O[C@H]1C[C@@H](O[C@@H]1COP(O)(O)=O)n1ccc(N)nc1=O)n1cnc2c(N)ncnc12 |r|
Nc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3O)n3cnc4c(N)ncnc34)[C@@H](CO)O2)c(=O)n1 |r|
NCCCNc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3O)n3cnc4c(N)ncnc34)[C@@H](CO)O2)c(=O)n1 |r|
NC(=N)NCCCCNc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3O)n3cnc4c(N)ncnc34)[C@@H](CO)O2)c(=O)n1
NC(=N)NCCCCCCNc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3O)n3cnc4c(N)ncnc34)[C@@H](CO)O2)c(=O)n1
Nc1ccn([C@H]2C[C@H](OP(S)(=O)O[C@H]3C[C@@H](O[C@@H]3CO)n3cnc4c(N)ncnc34)[C@@H](CO)O2)c(=O)n1 |r|
NCCCCNP(=O)(O[C@H]1C[C@@H](O[C@@H]1CO)n1cnc2c(N)ncnc12)O[C@H]1C[C@@H](O[C@@H]1CO)n1ccc(N)nc1=O |r|
NCCN(CCN)CCCSP(O)(=O)OC[C@H]1O[C@H](C[C@@H]1OP(O)(=O)OC[C@H]1O[C@H](C[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)n1ccc(N)nc1=O |r|
COc1ccc2nc3cc(Cl)ccc3c(NCCCCCCOP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(O)=O)n3cnc4c(N)ncnc34)n3ccc(N)nc3=O)c2c1 |r|
Nc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(O)=O)n3cnc4c(N)ncnc34)[C@@H](COP(O)(=O)SCCCCCC(=O)Nc3ccc(N)c4C(=O)c5ccccc5C(=O)c34)O2)c(=O)n1 |r|
Nc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(O)=O)n3cnc4c(N)ncnc34)[C@@H](COP(O)(=O)OCCCCCCNC(=O)c3ccc4C(=O)c5ccc(cc5C(=O)c4c3)C(=O)NCCCCCCO)O2)c(=O)n1 |r|
Nc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(O)=O)n3cnc4c(N)ncnc34)[C@@H](COP(O)(=O)O[C@H]3C[C@H](OCCCc4ccc5c6cccc7cccc(c8cccc4c58)c67)O[C@@H]3CO)O2)c(=O)n1 |r|
COc1ccc2nc3cc(Cl)ccc3c(NCCC[N+](C)(C)CCCSP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP([O-])(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(O)=O)n3cnc4c(N)ncnc34)n3ccc(N)nc3=O)c2c1 |r|
NCCCCNP(=O)(OC[C@H]1O[C@H](C[C@@H]1O)n1cnc2c(N)ncnc12)OC[C@H]1O[C@H](C[C@@H]1O)n1ccc(N)nc1=O |r|
NCCCCNc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3O)n3cnc4c(N)ncnc34)[C@@H](CO)O2)c(=O)n1 |r|
NC(=N)NCCCCNP(=O)(OC[C@H]1O[C@H](C[C@@H]1O)n1cnc2c(N)ncnc12)OC[C@H]1O[C@H](C[C@@H]1O)n1ccc(N)nc1=O |r|
Nc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(O)=O)n3cnc4c(N)ncnc34)[C@@H](COP(O)(=O)OCCCCCCNCc3ccc4c5cccc6cccc(c7cccc3c47)c56)O2)c(=O)n1 |r|
COc1ccc2nc3cc(Cl)ccc3c(NCCC[N+](C)(C)CCCSP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP([O-])(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(O)=O)n3ccc(N)nc3=O)n3cnc4c(N)ncnc34)c2c1 |r|
NC(=N)NCCCCCNc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3O)n3cnc4c(N)ncnc34)[C@@H](CO)O2)c(=O)n1
Nc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(O)=O)n3cnc4c(N)ncnc34)[C@@H](COP(O)(=O)SCCCCCC(=O)Nc3cccc4C(=O)c5ccccc5C(=O)c34)O2)c(=O)n1 |r|
COc1ccc2nc3cc(Cl)ccc3c(NCCCCSP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(O)=O)n3ccc(N)nc3=O)n3cnc4c(N)ncnc34)c2c1 |r|
NCCCCCNc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3O)n3cnc4c(N)ncnc34)[C@@H](CO)O2)c(=O)n1 |r|
NCCNc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3O)n3cnc4c(N)ncnc34)[C@@H](CO)O2)c(=O)n1 |r|
NC(=N)NCCCCNP(=O)(O[C@H]1C[C@@H](O[C@@H]1CO)n1cnc2c(N)ncnc12)O[C@H]1C[C@@H](O[C@@H]1CO)n1ccc(N)nc1=O |r|
Nc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(=O)NCCCO)n3cnc4c(N)ncnc34)[C@@H](COP(O)(O)=O)O2)c(=O)n1 |r|
NCCCCCCNc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3O)n3cnc4c(N)ncnc34)[C@@H](CO)O2)c(=O)n1 |r|
COc1ccc2nc3cc(Cl)ccc3c(NCCCCCCSP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(O)=O)n3ccc(N)nc3=O)n3cnc4c(N)ncnc34)c2c1 |r|
[H][C@](NC(C)=O)([C@@H](C)CC)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@]([H])([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
[H][C@](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@]([H])(NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@]([H])(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@]([H])(NC(=O)[C@@]([H])(NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(C)=O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC(C)C[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
[H][C@](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@]([H])(NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)CC)([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
Oc1ccc(cc1O)-c1ccc2cc(O)c(O)cc2c1
Oc1cc(cc(O)c1O)-c1ccc2cc(O)c(O)c(O)c2c1
OC1=C(Oc2c(O)cc(cc2O)-c2ccc3cc(O)c(O)c(O)c3c2)c2ccc(cc2C(=O)C1=O)-c1cc(O)c(O)c(O)c1 |c:1|
Oc1ccc2cc(ccc2c1O)-c1ccccc1
Oc1ccc(cc1)-c1ccc2c(O)c(O)ccc2c1
Oc1ccc2cc(ccc2c1O)-c1cccc(c1)C(F)(F)F
Oc1ccc2cc(ccc2c1O)-c1cccc(F)c1
Oc1ccc2cc(ccc2c1O)-c1ccc(F)cc1
Oc1cccc(c1O)-c1ccc2c(O)c(O)ccc2c1
Oc1ccc(cc1O)-c1ccc2c(O)c(O)ccc2c1
Oc1ccc2cc(ccc2c1O)-c1ccccc1F
Oc1cccc(c1)-c1ccc2c(O)c(O)ccc2c1
Oc1ccc2cc(ccc2c1O)-c1ccc(cc1)C(F)(F)F
Oc1ccc2cc(ccc2c1O)-c1ccccc1O
Oc1ccc2cc(ccc2c1O)-c1ccccc1C(F)(F)F
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2c(F)cccc2Cl)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(Cl)c2F)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(F)cc(Cl)c2)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(Cl)ccc2F)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(Cl)cc2F)c2cccc(OC)c12
COc1cccc2n(Cc3ccc(Cl)cc3)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3ccc(F)cc3Cl)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3cc(F)ccc3Cl)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3c(F)cccc3Cl)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3ccc(F)c(Cl)c3)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3cc(F)cc(Cl)c3)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3ccc(Cl)c(F)c3)cc(C(=O)\C=C(/O)C(O)=O)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(Cl)c2)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(F)c2Cl)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(F)ccc2Cl)c2cccc(OC)c12
COc1cccc2n(Cc3ccccc3Cl)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3cccc(Cl)c3)cc(C(=O)\C=C(/O)C(O)=O)c12
COc1cccc2n(Cc3cccc(F)c3Cl)cc(C(=O)\C=C(/O)C(O)=O)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(Cl)cc2)c2cccc(OC)c12
COc1cccc2n(Cc3cc(Cl)ccc3F)cc(C(=O)\C=C(/O)C(O)=O)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)c(Cl)c2)c2cccc(OC)c12
COc1cccc2n(Cc3ccc(Cl)cc3F)cc(C(=O)\C=C(/O)C(O)=O)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccccc2Cl)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2Cl)c2cccc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(Cl)c(F)c2)c2cccc(OC)c12
COc1cccc2n(Cc3cccc(Cl)c3F)cc(C(=O)\C=C(/O)C(O)=O)c12
CC(=O)N1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(F)c(Cl)c2)c(O)c(=O)n1C |r|
CC(=O)N1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(C)c(Cl)c2)c(O)c(=O)n1C |r|
CN1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C |r|
CC(=O)N1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C |r|
COC(=O)N1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C |r|
Cn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)[C@@H]1C[C@H](F)CN1S(C)(=O)=O |r|
CN(C)C(=O)C(=O)N1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C |r|
CN(C)S(=O)(=O)N1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C |r|
Cn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)[C@@H]1C[C@H](F)CN1C1CC1 |r|
CN(C)C(=O)N1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C |r|
Cn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)[C@@H]1C[C@H](F)CN1C(=O)c1cnccn1 |r|
COC(=O)N1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(C)c(Cl)c2)c(O)c(=O)n1C |r|
Cn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)[C@@H]1C[C@H](F)CN1Cc1ccon1 |r|
CC(=O)N1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(F)c(C)c2)c(O)c(=O)n1C |r|
COC(=O)N1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(F)c(Cl)c2)c(O)c(=O)n1C |r|
CC1(C)Oc2ccc3C(=O)C(=C(O)C(=O)c3c2C=C1)C1=C(C(=O)c2ccccc2C1=O)C1=C(O)C(=O)c2c(ccc3OC(C)(C)C=Cc23)C1=O |c:19,36,50,t:10,22|
COc1ccc2C(=O)C(C3=C(O)C(=O)c4c(ccc5OC(C)(C)C=Cc45)C3=O)=C(C(=O)c2c1)C1=C(O)C(=O)c2c(ccc3OC(C)(C)C=Cc23)C1=O |c:9,23,30,38,52|
CC1(C)Oc2ccc3C(=O)C(=C(O)C(=O)c3c2C=C1)C1=C(C(=O)c2c(ccc3OC(C)(C)C=Cc23)C1=O)C1=C(O)C(=O)c2c(ccc3OC(C)(C)C=Cc23)C1=O |c:19,35,43,57,t:10,22|
CC1(C)CCc2c(O1)ccc1C(=O)C(C3=C(O)C(=O)c4c(ccc5OC(C)(C)C=Cc45)C3=O)=C(C(=O)c21)C1=C(O)C(=O)c2c(ccc3OC(C)(C)C=Cc23)C1=O |c:15,29,36,43,57|
CC(C)Oc1ccc2C(=O)C(C3=C(O)C(=O)c4c(ccc5OC(C)(C)C=Cc45)C3=O)=C(C(=O)c2c1)C1=C(O)C(=O)c2c(ccc3OC(C)(C)C=Cc23)C1=O |c:11,25,32,40,54|
CC1(C)Oc2ccc3C(=O)C(C4=C(C(=O)N(Cc5ccccc5)C4=O)C4=C(O)C(=O)c5c(ccc6OC(C)(C)C=Cc56)C4=O)=C(O)C(=O)c3c2C=C1 |c:27,41,57,t:11,48|
OC1=C(C(=O)c2ccccc2C1=O)C1=C(C(=O)c2ccccc2C1=O)C1=C(O)C(=O)c2ccccc2C1=O |c:29,t:1,15|
COc1cc2C(=O)C(O)=C(C(=O)c2cc1OC)C1=C(C(=O)c2cc(OC)c(OC)cc2C1=O)C1=C(O)C(=O)c2cc(OC)c(OC)cc2C1=O |c:8,37,t:19|
COc1cc2C(=O)C(O)=C(C(=O)c2cc1OC)C1=C(C(=O)c2ccccc2C1=O)C1=C(O)C(=O)c2cc(OC)c(OC)cc2C1=O |c:8,33,t:19|
COc1ccc2C(=O)C(=C(O)C(=O)c2c1)C1=C(C(=O)c2ccccc2C1=O)C1=C(O)C(=O)c2cc(OC)ccc2C1=O |c:31,t:8,17|
CC1(C)CCc2c(O1)ccc1C(=O)C(=C(O)C(=O)c21)C1=C(C(=O)c2c3CCC(C)(C)Oc3ccc2C1=O)C1=C(O)C(=O)c2c3CCC(C)(C)Oc3ccc2C1=O |c:43,t:14,22|
COc1cccc2C(=O)C(O)=C(C(=O)c12)C1=C(C(=O)c2ccccc2C1=O)C1=C(O)C(=O)c2cccc(OC)c2C1=O |c:10,31,t:17|
CCCOc1ccc2C(=O)C(C3=C(O)C(=O)c4c(ccc5OC(C)(C)C=Cc45)C3=O)=C(C(=O)c2c1)C1=C(O)C(=O)c2c(ccc3OC(C)(C)C=Cc23)C1=O |c:11,25,32,40,54|
Oc1ccc(cc1O)C(=O)NCCCN1CCN(CC1)C(=O)\C=C\c1ccccc1
Cc1ccc(\C=C\C(=O)N2CCN(CCCNC(=O)c3ccc(O)c(O)c3)CC2)cc1
Oc1ccc(cc1O)C(=O)NCCCN1CCN(CC1)C(=O)\C=C\c1ccccc1Cl
Oc1cccc(\C=C\C(=O)N2CCN(CCCNC(=O)c3ccc(O)c(O)c3)CC2)c1
Oc1cc(cc(O)c1O)C(=O)NCCCN1CCN(CC1)C(=O)\C=C\c1ccc(Cl)cc1
Oc1cc(cc(O)c1O)C(=O)NCCCN1CCN(CC1)C(=O)\C=C\c1ccccc1[N+]([O-])=O
Oc1cc(cc(O)c1O)C(=O)NCCCN1CCN(CC1)C(=O)\C=C\c1ccccc1Cl
Oc1ccc(cc1O)C(=O)NCCCN1CCN(CC1)C(=O)\C=C\c1ccc(Cl)cc1
Cc1ccc(\C=C\C(=O)N2CCN(CCCNC(=O)c3cc(O)c(O)c(O)c3)CC2)cc1
Oc1cc(cc(O)c1O)C(=O)NCCCN1CCN(CC1)C(=O)\C=C\c1ccccc1
Oc1cccc(\C=C\C(=O)N2CCN(CCCNC(=O)c3cc(O)c(O)c(O)c3)CC2)c1
[H][C@@]12C3C=CC(C4CC34)[C@]1([H])C(=O)N(NC(=O)c1ccc(Cn3cnc4ccccc34)cc1)C2=O |r,c:3,TLB:7:8:3.4:1.9,7:6:3.4:1.9,THB:11:9:3.4:8.6|
CC[C@H](C)[C@H](NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(C)=O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(C)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
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CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(C)=O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(C)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(C)=O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC(=O)N1CCN(CC1)c1cc(Br)c2nc(C(=O)NCc3ccc(F)cc3)c(O)c(=O)n2c1
Oc1c(nc2c(cc(cn2c1=O)N1CCOCC1)N1CCCS1(=O)=O)C(=O)NCc1cc(Cl)cc(Cl)c1
Oc1c(nc2c(Br)cc(cn2c1=O)N1CCOCC1)C(=O)NCc1ccc(F)cc1
Oc1c(nc2c(OCc3ccc(F)cc3)cc(cn2c1=O)N1CCOCC1)C(=O)NCc1ccc(F)cc1
Oc1c(nc2c(OCC3CC3)cc(cn2c1=O)N1CCOCC1)C(=O)NCc1ccc(F)cc1
CC(C)Oc1cc(cn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O)N1CCOCC1
Oc1c(nc2c3ccc(cc3on2c1=O)N1CCOCC1)C(=O)NCc1ccc(F)cc1
Oc1c(nc2c3ccccc3on2c1=O)C(=O)NCc1ccc(F)cc1
Oc1c(nc2sc(cn2c1=O)N1CCOCC1)C(=O)NCc1ccc(F)cc1
Oc1c(nc2sccn2c1=O)C(=O)NCc1ccc(F)cc1
Oc1c(nc2c3ccccc3[nH]n2c1=O)C(=O)NCc1ccc(F)cc1
Cn1ccc2nc(C(=O)NCc3ccc(F)cc3)c(O)c(=O)n12
Oc1c(nc2cc([nH]n2c1=O)-c1ccccc1)C(=O)NCc1ccc(F)cc1
Oc1c(nc2[nH]c3ccccc3n2c1=O)C(=O)NCc1ccc(F)cc1
Cn1ccn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Oc1c(nc2ccc(cn2c1=O)N1CCOCC1)C(=O)NCc1ccc(F)cc1
Oc1c(nc2ccc(Br)cn2c1=O)C(=O)NCc1ccc(F)cc1
Oc1c(nc2sc3ccccc3n2c1=O)C(=O)NCc1ccc(F)cc1
COc1cccc2c1sc1nc(C(=O)NCc3ccc(F)cc3)c(O)c(=O)n21
Cn1c2ccccc2n2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Oc1c(nc2c(cc(cn2c1=O)N1CCOCC1)N1CCCS1(=O)=O)C(=O)NCc1ccc(F)cc1
Oc1c(nc2c(cc(cn2c1=O)N1CCOCC1)N1CCOCC1)C(=O)NCc1ccc(F)cc1
COc1cc(cn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O)N1CCOCC1
Cc1cc2nc(C(=O)NCc3ccc(F)cc3)c(O)c(=O)n2o1
Cn1c2ccccc2c2nc(C(=O)NCc3ccc(F)cc3)c(O)c(=O)n12
Oc1c(nc2c(Cl)cc(cn2c1=O)N1CCOCC1)C(=O)NCc1ccc(F)cc1
Cc1cn2c(nc(C(=O)NCc3ccc(F)cc3)c(O)c2=O)s1
Oc1c(nc2c(c[nH]n2c1=O)C#N)C(=O)NCc1ccc(F)cc1
Oc1c(nc2c(I)cc(cn2c1=O)N1CCOCC1)C(=O)NCc1ccc(F)cc1
Oc1c(nc2ccc(cn2c1=O)N1CCOCC1)-c1ncc(Cc2ccc(F)cc2)s1
Oc1c(nc2c(cc(cn2c1=O)N1CCOCC1)N1CCCS1(=O)=O)-c1ncc(Cc2ccc(F)cc2)s1
Oc1c(nc2c(Br)cc(cn2c1=O)N1CCOCC1)-c1ncc(Cc2ccc(F)cc2)s1
Oc1c(nc2ccc(cn2c1=O)N1CCOCC1)-c1ncc(Cc2ccc(F)cc2)o1
Oc1c(nc2c(cc(cn2c1=O)N1CCOCC1)N1CCCS1(=O)=O)-c1ncc(Cc2ccc(F)cc2)[nH]1
Oc1c(nc2ccc(cn2c1=O)N1CCOCC1)-c1nc(Cc2ccc(F)cc2)no1
CN1CCN(c2cc(cn3c2nc(-c2ncc(Cc4ccc(F)cc4)[nH]2)c(O)c3=O)N2CCOCC2)S1(=O)=O
Oc1c(nc2ccc(cn2c1=O)N1CCOCC1)-c1ncc(Cc2ccc(F)cc2)[nH]1
Oc1c(nc2c(cc(cn2c1=O)N1CCOCC1)N1CCOC1=O)-c1ncc(Cc2ccc(F)cc2)[nH]1
Oc1c(nc2c(cc(cn2c1=O)N1CCOCC1)N1CCCC1=O)-c1ncc(Cc2ccc(F)cc2)[nH]1
Oc1c(nc2c(I)cc(cn2c1=O)N1CCOCC1)-c1ncc(Cc2ccc(F)cc2)o1
Oc1c(nc2ccc(cn2c1=O)N1CCOCC1)-c1nnc(Cc2ccc(F)cc2)s1
Oc1c(nc2ccc(cn2c1=O)N1CCOCC1)-c1nnc(Cc2ccc(F)cc2)o1
Oc1c(nc2ccc(cn2c1=O)N1CCOCC1)-c1noc(Cc2ccc(F)cc2)n1
Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NCCO)c1=O
COc1cc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cccc(Br)c2)cc(OC)c1OC |c:10|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cccc(Br)c2)cc1OCc1cccc(Cl)c1F |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cccc(Br)c2)cc1Cc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cccc(C)c2)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cccc(c2)-c2ccccc2)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cccc(c2)[N+]([O-])=O)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cccc(F)c2)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cc(Cl)cc(Cl)c2)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2ccc(cc2)C(O)=O)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2ccc(NS(C)(=O)=O)cc2)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2nc3ccccc3s2)cc1OCc1ccc(F)cc1 |c:11|
CCC1=NN(C(=O)\C1=C/c1ccc(OC)c(OCc2ccc(F)cc2)c1)c1cccc(Br)c1 |t:2|
COc1ccc(\C=C2/C(=O)N(N=C2NC(=O)C(F)(F)F)c2cccc(Br)c2)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(O)=O)c2cccc(Br)c2)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(O)=O)c2cccc(c2)[N+]([O-])=O)cc1Cc1ccc(F)cc1 |c:11|
OC(=O)C1=NN(C(=O)\C1=C/c1ccc(OCc2ccc(F)cc2)c(O)c1)c1cccc(c1)[N+]([O-])=O |t:3|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cccc(Br)c2)cc1OC |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cccc(Br)c2)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2ccccc2)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cccc(Cl)c2)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cccc(I)c2)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2ccc(Br)cc2)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2\C(COC(C)=O)=NN(C2=O)c2cccc(Br)c2)cc1OCc1ccc(F)cc1 |c:13|
CCC(=O)OC1=NN(C(=O)\C1=C/c1ccc(OC)c(OCc2ccc(F)cc2)c1)c1cccc(Br)c1 |t:5|
COc1ccc(\C=C2/C(=O)N(N=C2C(O)=O)c2cccc(c2)[N+]([O-])=O)cc1OCc1ccc(F)cc1 |c:11|
OC(=O)C1=NN(C(=O)\C1=C/c1ccc(O)c(OCc2ccc(F)cc2)c1)c1cccc(c1)[N+]([O-])=O |t:3|
COc1ccc(\C=C2\C(OC(C)=O)=NN(C2=O)c2cccc(Br)c2)cc1OCc1ccc(F)cc1 |c:12|
Oc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cccc(Br)c2)cc1OCc1ccc(F)cc1 |c:10|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2ccc(I)cc2)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cccc(Br)c2)c(OC)c1OC |c:11|
COc1ccc(\C=C2/C(=O)N(N=C2C(F)(F)F)c2cccc(c2)C(F)(F)F)cc1OCc1ccc(F)cc1 |c:11|
COc1ccc(\C=C2\C(C)=NN(C2=O)c2cccc(Br)c2)cc1OCc1ccc(F)cc1 |c:9|
NCc1ccc(cc1)-c1ccc(Cc2cc(=O)n(O)c3ncccc23)cc1
NCc1ccc(cc1)-c1cccc(c1)-c1cc(=O)n(O)c2ncccc12
NCc1cccc(c1)-c1cccc(c1)-c1cc(=O)n(O)c2ncccc12
NCc1ccc(cc1)-c1cccc(Cc2cc(=O)n(O)c3ncccc23)c1
On1c2ncccc2ccc1=O
On1c2ncccc2c(cc1=O)-c1cccc(c1)-c1ccccc1
NCc1ccccc1-c1cccc(c1)-c1cc(=O)n(O)c2ncccc12
COc1cc(\C=C\c2ccc3ccc(C([O-])=O)c(O)c3n2)cc(O)c1O
COc1cc(\C=C\c2ccc3ccc(C([O-])=O)c(O)c3n2)cc(OC)c1O
C[N@@](c1c2cccnc2c(c3c1CN(C3=O)Cc4ccc(cc4)F)O)S(=O)(=O)C
CCC1C(=O)N(O)C(=O)c2ccccc12
CCCC1C(=O)N(O)C(=O)c2ccccc12
CC(C)C1C(=O)N(O)C(=O)c2ccccc12
CCCCCC1C(=O)N(O)C(=O)c2ccccc12
CCCCCCc1c(O)n(O)c(=O)c2ccccc12
Oc1c(Cc2ccccc2)c2ccccc2c(=O)n1O
Cc1ccc(CC2C(=O)N(O)C(=O)c3ccccc23)cc1
ON1C(=O)C(Cc2ccc(cc2)C(F)(F)F)c2ccccc2C1=O
CCCCCCCc1c(O)n(O)c(=O)c2ccccc12
CCCCCCC1C(=O)N(O)C(=O)c2ccccc12
CCCCC1C(=O)N(O)C(=O)c2ccccc12
ON1C(=O)C(Cc2ccccc2)c2ccccc2C1=O
ON1C(=O)C(CCc2ccccc2)c2ccccc2C1=O
CC1C(=O)N(O)C(=O)c2ccccc12
ON1C(=O)C(CCCc2ccccc2)c2ccccc2C1=O
COc1cc(OC)c2n(Cc3ccc(F)cc3)cc(C(=O)\C=C(/O)C(O)=O)c2c1
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(OC)cc(OC)c12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(OC)c(OC)cc12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2c(OC)c(OC)ccc12
COc1cc2c(cn(Cc3ccc(F)cc3)c2cc1OC)C(=O)\C=C(/O)C(O)=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2c(OC)cc(OC)cc12
COc1cc(OC)c2c(cn(Cc3ccc(F)cc3)c2c1)C(=O)\C=C(/O)C(O)=O
COc1ccc2c(cn(Cc3ccc(F)cc3)c2c1OC)C(=O)\C=C(/O)C(O)=O
COc1ccc2n(Cc3ccc(F)cc3)cc(C(=O)\C=C(/O)C(O)=O)c2c1OC
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OC)c(OC)c12
[N-]=[N+]=[N-]
Oc1ccc(\C=C\C(=O)c2ccc(NC(=O)Cc3cccs3)cc2)cc1O
Oc1ccc(\C=C\C(=O)c2ccc(NC(=O)c3ccccc3)cc2)cc1O
[H][C@]12C[C@]3([H])C[C@]([H])(C1)CC(C2)(C3)C(=O)Nc1ccc(cc1)C(=O)\C=C\c1ccc(O)c(O)c1 |r,THB:2:3:9:8.1.11,2:1:5.3.12:9,11:1:5:12.10.9,11:10:5:8.2.1|
Oc1ccc(\C=C\C(=O)c2ccc(NC(=O)c3ccc(F)c(F)c3)cc2)cc1O
COc1ccc(cc1)C(=O)Nc1ccc(cc1)C(=O)\C=C\c1ccc(O)c(O)c1
Cc1ccc(\C=C\C(=O)c2ccc(NC(=O)c3cc(F)cc(F)c3)cc2)cc1O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccccc2)c2ccccc12
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2c(Cl)cccc2Cl)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2cc(Cl)ccc2Cl)c1O
COc1cccc(\C=C\C(=O)c2cc(Br)cc(C(O)=O)c2O)c1OC
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2ccc(I)cc2)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2ccc(Cl)cc2)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2cccc(Cl)c2)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2ccccc2)c1O
Oc1ccc(Br)cc1C(=O)NCc1ccc(F)cc1
Cc1cccc(C(=O)NCc2ccc(F)cc2)c1O
CCOc1ccc2ccccc2c1\C=C\C(=O)c1cc(Br)cc(C(O)=O)c1O
COc1ccc(\C=C\C(=O)c2cc(Br)cc(C(O)=O)c2O)cc1OC1CCCC1
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2cccc(Oc3ccc(Cl)cc3)c2)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2ccccc2OCc2ccccc2)c1O
COc1cc(F)c(\C=C\C(=O)c2cc(Br)cc(C(O)=O)c2O)cc1OC
Cc1cc(C)cc(\C=C\C(=O)c2cc(Br)cc(C(O)=O)c2O)c1
OC(=O)c1cc(Cl)cc(C(=O)\C=C\c2ccc(Cl)cc2Cl)c1O
OC(=O)c1cc(Cl)cc(C(=O)\C=C\c2cc(Cl)cc(Cl)c2Cl)c1O
COc1cccc2c(\C=C\C(=O)c3cc(Br)cc(C(O)=O)c3O)cccc12
OC(=O)c1cc(Cl)cc(C(=O)\C=C\c2ccc(Cl)cc2)c1O
OC(=O)c1cc(F)cc(C(=O)\C=C\c2cccc(Cl)c2Cl)c1O
OC(=O)c1cc(F)cc(C(=O)\C=C\c2c(Cl)ccc(Cl)c2Cl)c1O
COc1ccc(\C=C\C(=O)c2cc(Br)cc(C(O)=O)c2O)c(OC)c1OC
OC(=O)c1cc(Cl)cc(C(=O)\C=C\c2cccc(Cl)c2Cl)c1O
OC(=O)c1cc(F)cc(C(=O)\C=C\c2ccc(Cl)cc2)c1O
OC(=O)c1cc(Cl)cc(C(=O)\C=C\c2ccc(Cl)c(Cl)c2)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2cccc(Cl)c2Cl)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2ccccc2Cl)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2c(Cl)ccc(Cl)c2Cl)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2cc(Cl)cc(Cl)c2Cl)c1O
OC(=O)c1cc(F)cc(C(=O)\C=C\c2ccc(Cl)cc2Cl)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2cccc(c2)[N+]([O-])=O)c1O
Oc1c(\C=C\C(=O)c2cc(Cl)cc(Cl)c2Cl)cc(Br)cc1[N+]([O-])=O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2cccc(Br)c2)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2ccc(Br)cc2)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2ccc(Cl)cc2Cl)c1O
Oc1c(\C=C\C(=O)c2c(Cl)ccc(Cl)c2Cl)cc(Br)cc1[N+]([O-])=O
Oc1c(cc(Br)cc1C(=O)\C=C\c1c(Cl)ccc(Cl)c1Cl)C#N
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2ccccc2-c2ccco2)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2ccsc2)c1O
Cc1cc(C(O)=O)c(O)c(c1)C(=O)\C=C\c1c(Cl)ccc(Cl)c1Cl
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2ccc3sccc3c2)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2ccc(Oc3ccc(Cl)cc3)cc2)c1O
COc1ccc(\C=C\C(=O)c2cc(Br)cc(C(O)=O)c2O)c(Cl)c1OC
OC(=O)c1cc(Cl)cc(C(=O)\C=C\c2c(Cl)ccc(Cl)c2Cl)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2ccc(Cl)c(Cl)c2)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2cccc(OC(F)(F)F)c2)c1O
OC(=O)c1cc(F)cc(C(=O)\C=C\c2cc(Cl)ccc2Cl)c1O
OC(=O)c1cc(Cl)cc(C(=O)\C=C\c2cc(Cl)ccc2Cl)c1O
OC(=O)c1cc(Br)cc(C(=O)NCc2ccc(F)cc2)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2cccc(F)c2)c1O
Oc1c(C=O)cc(Br)cc1C(=O)NCc1ccc(F)cc1
OC(=O)c1cc(F)cc(C(=O)CCc2cc(Cl)ccc2Cl)c1O
OC(=O)c1cc(F)cc(C(=O)\C=C\c2cc(Cl)cc(Cl)c2Cl)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2cc3OCOc3cc2Cl)c1O
OC(=O)c1cc(Br)cc(C(=O)\C=C\c2ccccc2F)c1O
[H][C@]12Cn3cc(C(=O)NCc4ccc(F)cc4F)c(=O)c([O-])c3C(=O)N1[C@H](C)CCO2 |r|
CCc1c(C(=O)c2ccccc2)n(COCc2ccccc2)c(=O)n(O)c1=O
CCc1c(C(=O)c2ccccc2)n(COCc2ccc(F)cc2)c(=O)n(O)c1=O
CCc1c(C(=O)c2cc(C)cc(C)c2)n(COCc2ccc(F)cc2)c(=O)n(O)c1=O
CCc1c(C(=O)c2ccccc2)n(COCCc2ccc(F)cc2)c(=O)n(O)c1=O
CCc1c(C(=O)c2cc(C)cc(C)c2)n(COCCc2ccc(F)cc2)c(=O)n(O)c1=O
CCOCn1c(C(=O)c2ccccc2)c(CC)c(=O)n(O)c1=O
CCOCn1c(C(=O)c2cc(C)cc(C)c2)c(CC)c(=O)n(O)c1=O
CCc1c(C(=O)c2cc(C)cc(C)c2)n(COCc2ccccc2)c(=O)n(O)c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3ccc(F)cc3)cc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3ccc(F)cc3)cc2c1=O
CCOC(=O)\C=C\c1ccc2n(Cc3ccc(F)cc3)cc(C(=O)\C=C(/O)C(=O)OCC)c(=O)c2c1
OC(=O)\C=C\c1ccc2n(Cc3ccc(F)cc3)cc(C(=O)\C=C(/O)C(O)=O)c(=O)c2c1
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2ccc(Br)cc2c1=O
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(CN4CCCCC4)c23)C1=O
ON1CCc2c(ncc3n(Cc4ccc(F)c(Cl)c4C#N)ccc23)C1=O
ON1CCc2c(ncc3n(Cc4ncc(F)cc4F)ccc23)C1=O
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(c23)S(=O)(=O)N2CCCC2)C1=O
CN(C)S(=O)(=O)c1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(c23)S(=O)(=O)N2CCOCC2)C1=O
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(CCCOC4CCOCC4)c23)C1=O
CC(C)(O)CCc1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(CCCN4CCOCC4)c23)C1=O
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(CCC(O)=O)c23)C1=O
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(COCC4CCOCC4)c23)C1=O
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(COCc4ccccn4)c23)C1=O
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(CN4CCC(F)(F)C4)c23)C1=O
CN(CC1CC1)Cc1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12
COCCN(C)Cc1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12
COCCN(C)S(=O)(=O)c1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(CCC(F)(F)F)c23)C1=O
CN(CCCc1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12)C(C)=O
CC(C)OCCOCc1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(COCCc4ccccn4)c23)C1=O
CN(C)Cc1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12
ON1CCc2c(ncc3n(Cc4ccc(F)cn4)ccc23)C1=O
ON1CCc2c(ncc3n(Cc4ccc(F)cc4C#N)ccc23)C1=O
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(COCCCc4ccccn4)c23)C1=O
CN(CCO)Cc1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12
CN(O)C(=O)c1cc2c(CN3CCC[C@H]3C(N)=O)cn(Cc3ccc(F)cc3)c2cn1 |r|
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(COCc4ccccc4F)c23)C1=O
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)ccc23)C1=O
CC1CCN(CC1)S(=O)(=O)c1cn(Cc2ccc(F)cc2)c2cnc3C(=O)N(O)CCc3c12
Oc1c2C(=O)N(Cc3ccc(F)c(Cl)c3)C(=O)c2c2CCCCn2c1=O
Oc1c2C(=O)N(Cc3ccc(F)c(Cl)c3)C(=O)c2c2CCCCCn2c1=O
Oc1c2C(=O)N(Cc3cccc(Cl)c3F)C(=O)c2c2CCCCCn2c1=O
Oc1c2C(=O)N(Cc3ccccc3)C(=O)c2c2CCCCCn2c1=O
Oc1c2C(=O)N(Cc3cccc4ccccc34)C(=O)c2c2CCCCCn2c1=O
Oc1c2C(=O)N(Cc3ccc(F)c(Cl)c3)C(=O)c2c2CCCn2c1=O
Oc1c2C(=O)N(Cc3ccc(F)cc3)C(=O)c2c2CCCCCn2c1=O
Oc1c2C(=O)N(Cc3ccc(F)c(Cl)c3)C(=O)c2c2CCCCCCn2c1=O
Oc1c2C(=O)N(Cc3ccc(F)c(F)c3)C(=O)c2c2CCCCCn2c1=O
OC(=O)c1ccc2ccc(\C=C\c3ccccc3)nc2c1O
OC(=O)c1ccc2ccc(\C=C\c3ccco3)nc2c1O
OC(=O)c1ccc2ccc(\C=C\c3ccsc3)nc2c1O
CC(=O)Nc1ccc(\C=C\c2ccc3ccc(C(O)=O)c(O)c3n2)cc1
OC(=O)c1ccc2ccc(\C=C\c3ccc(O)cc3)nc2c1O
COc1ccc(\C=C\c2ccc3ccc(C(O)=O)c(O)c3n2)cc1O
OC(=O)c1ccc2ccc(\C=C\c3ccc(O)c(O)c3O)nc2c1O
COc1cc(\C=C\c2ccc3ccc(C(O)=O)c(O)c3n2)cc(O)c1O
OC(=O)c1ccc2ccc(\C=C\c3cc(Br)c(O)c(Br)c3)nc2c1O
COC(=O)c1ccc2ccc(\C=C\c3ccc(O)c(O)c3)nc2c1O
COc1ccc(\C=C\C(=O)Oc2cccc3ccc(C)nc23)cc1OC
Oc1cccc2ccc(\C=C\c3ccccc3)nc12
Oc1cccc2ccc(\C=C\c3ccc4cccc(O)c4n3)nc12
Nc1cccc2ccc(\C=C\c3ccc(O)c(O)c3)nc12
Oc1ccc(\C=C\c2ccc3ccc(\C=C\c4ccc(O)c(O)c4)c(O)c3n2)cc1O
OC(=O)c1ccc2ccc(\C=C\c3ccc(O)c(c3)C(O)=O)nc2c1O
Cc1ccc2ccc(C(O)=O)c(O)c2n1
Nc1ccc(\C=C\c2ccc3ccc(C(O)=O)c(O)c3n2)cc1
CC(=O)Oc1cccc2ccc(\C=C\c3ccccc3)nc12
Oc1ccc(\C=C\c2ccc3ccccc3n2)cc1O
Oc1ccc(\C=C\c2ccc3cccc(O)c3n2)cc1O
OC(=O)c1ccc2ccc(\C=C\c3ccc(cc3)[N+]([O-])=O)nc2c1O
OC(=O)c1ccc2ccc(\C=C\c3ccc(O)cc3O)nc2c1O
Cc1ccc2cccc(OC(=O)\C=C\c3ccc(O)c(O)c3)c2n1
OC(=O)c1ccc2ccc(\C=C\c3cc(O)cc(O)c3)nc2c1O
CC(=O)Oc1ccc(\C=C\c2ccc3cccc(OC(C)=O)c3n2)cc1OC(C)=O
OC(=O)c1ccc2ccc(\C=C\c3cccnc3)nc2c1O
OC(=O)c1ccc2ccc(\C=C\c3ccc(O)c(O)c3)nc2c1O
COc1cc(\C=C\c2ccc3ccc(C(O)=O)c(O)c3n2)cc(OC)c1O
Cc1ccc2cccc(O)c2n1
Oc1ccc(\C=C\c2ccc3cccc([N+]([O-])=O)c3n2)cc1O
Oc1ccc(\C=C\c2ccc3ccc(C#N)c(O)c3n2)cc1O
Cc1cc(\C=C\c2ccc3ccc(C(O)=O)c(O)c3n2)ccc1O
OC(=O)c1ccc2ccc(\C=C\c3cc(O)c(O)c(I)c3)nc2c1O
Oc1ccc(\C=C\c2ccc3c(Cl)cc(Cl)c(O)c3n2)cc1O
Cc1ccc(NC(=O)CC(O)=O)c(c1)[N+]([O-])=O
CCOC(=O)CC(=O)NCc1ccc(F)cc1
CCOC(=O)CC(=O)Nc1ccc(cc1)C(O)=O
Cc1ccc2c(O)c(ccc2n1)C(O)=O
CCOC(=O)CC(=O)Nc1c(Cl)cccc1Cl
CCOC(=O)CC(=O)Nc1cc(ccc1O)C(O)=O
CCOC(=O)CC(=O)NS(=O)(=O)c1ccc(C)cc1
CCOC(=O)CC(=O)Nc1ccc(C)cc1
CCOC(=O)CC(=O)Nc1ccc2cccc(O)c2n1
CNC(=O)Cc1ccccc1CNC(=O)c1cccc(O)c1O
CNC(=O)c1cc(F)ccc1CNC(=O)c1cccc(O)c1O
CNS(=O)(=O)c1cc(O)c(O)c(c1)C(=O)NCc1ccc(F)cc1
Oc1cc(cc(C(=O)NCC2CCCCC2)c1O)S(=O)(=O)N1CCCCC1
CC(=O)Nc1cc(O)c(O)c(c1)C(=O)NCc1ccc(F)cc1
Oc1cc(cc(C(=O)NCc2ccc(F)cc2)c1O)C#N
Nc1cccc(C(=O)NCc2ccco2)c1O
OC(=O)c1cccc(OCc2ccccc2)c1O
OC(=O)c1cccc(OCc2ccc3ccccc3c2)c1O
OC(=O)c1ccc(OCc2ccccc2)cc1O
OC(=O)c1cc(OCc2ccccc2)ccc1O
OC(=O)c1cc(OCc2ccc(F)cc2)ccc1O
ONC(=O)c1cccc(OCc2ccc(F)cc2)c1O
ONC(=O)c1ccc(OCc2ccc(F)cc2)cc1O
Oc1c(OCc2ccccc2)cccc1C(=O)NCc1ccc(F)cc1
Oc1cccc(C(=O)NCc2ccc(F)c(F)c2)c1O
Oc1cccc(C(=O)NCc2ccc3[nH]ccc3c2)c1O
Oc1cccc(C(=O)NCc2ccco2)c1O
Oc1cccc(C(=O)NCc2ccc(cc2)-c2cccs2)c1O
Oc1cccc(C(=O)NC2CCNCC2)c1O
CC(C)(C)NS(=O)(=O)c1cc(O)c(O)c(c1)C(=O)NCc1ccc(F)cc1
Oc1cc(cc(C(=O)NCc2ccc(cc2)C(F)(F)F)c1O)S(=O)(=O)N1CCCCC1
Oc1cc(cc(C(=O)NCc2cccs2)c1O)S(=O)(=O)N1CCCCC1
ONC(=O)c1c(O)cccc1OCc1ccc(F)cc1
Oc1cccc(C(=O)NCCc2c[nH]c3ccccc23)c1O
Oc1cccc(C(=O)NCc2cccs2)c1O
Oc1cccc(C(=O)NCC2CCCCC2)c1O
Oc1cccc(C(=O)Nc2ccc3[nH]ccc3c2)c1O
CN(C)Cc1ccc(C(=O)NCc2ccc(F)cc2)c(O)c1O
OC(=O)c1c(O)cccc1OCc1ccc2ccccc2c1
CS(=O)(=O)Nc1cc(O)c(O)c(c1)C(=O)NCc1ccc(F)cc1
OC(=O)c1cccc(OCc2ccc(F)cc2)c1O
Oc1cccc(C(=O)NC2CCCCC2)c1O
COc1cc(cc(C(=O)NCc2ccco2)c1O)S(=O)(=O)N1CCCCC1
Oc1cc(cc(C(=O)NCc2ccc(F)cc2)c1O)S(=O)(=O)N1CCCCC1
ONC(=O)c1cc(OCc2ccc(F)cc2)ccc1O
OC(=O)c1ccc(OCc2ccc(F)cc2)cc1O
OC(=O)c1c(O)cccc1OCc1ccc(F)cc1
Oc1cccc(C(=O)NCc2cccc3ccccc23)c1O
Oc1cc(cc(C(=O)NCc2ccco2)c1O)S(=O)(=O)N1CCCCC1
CN(C)Cc1ccc(C(=O)NCc2ccco2)c(O)c1O
OC1=C(C(N(C1=O)c1ccccc1)c1ccc(cc1)[N+]([O-])=O)C(=O)c1ccccc1 |t:1|
COc1ccc(CCN2C(C(C(=O)c3ccccc3)=C(O)C2=O)c2ccccc2)cc1 |t:19|
COc1ccc(CCN2C(C(C(=O)c3ccccn3)=C(O)C2=O)c2cccc(Cl)c2)cc1 |t:19|
CN1C(C(C(=O)c2ccccn2)=C(O)C1=O)c1cccc(Cl)c1 |t:12|
COc1ccc(CCN2C(C(C(=O)c3ccccc3)=C(O)C2=O)c2ccc(O)cc2)cc1 |t:19|
CN1C(C(C(=O)c2ccccc2)=C(O)C1=O)c1cccc(Cl)c1 |t:12|
CN1C(C(C(=O)c2ccccc2)=C(O)C1=O)c1ccc(cc1)[N+]([O-])=O |t:12|
CC(C)CN1C(C(C(=O)c2ccccc2)=C(O)C1=O)c1ccccc1 |t:15|
Oc1c(C(=O)NCc2ccc(F)cc2)c(=O)[nH]c2cccnc12
CC(C)n1c2cccnc2c(O)c(C(=O)NCc2ccc(F)cc2)c1=O
Oc1c(C(=O)NCc2ccc(F)cc2)c(=O)[nH]c2cc(Cc3ccccc3)cnc12
Oc1c(C(=O)NCc2ccc(F)cc2Cl)c(=O)[nH]c2cc(Cc3ccccc3)cnc12
Oc1c(C(=O)NCc2ccc(F)cc2C(F)(F)F)c(=O)[nH]c2cc(Cc3ccccc3)cnc12
COc1ccccc1CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O
COc1ccc(CNC(=O)c2c(O)c3ncc(Cc4ccc(F)cc4)cc3[nH]c2=O)cc1OC
Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NCc2ccc(F)cc2)c1=O
Nc1ccc(Cn2c3cc(Cc4ccccc4)cnc3c(O)c(C(=O)NCc3ccc(F)cc3)c2=O)cc1
Oc1c(C(=O)NCc2ccc(F)cc2)c(=O)n(CCN2CCCC2=O)c2cc(Cc3ccccc3)cnc12
Oc1c(C(=O)NCc2ccc(F)cc2)c(=O)n(CCN2CCCC2=O)c2cc(Cc3ccc(F)cc3)cnc12
Oc1c(C(=O)NCc2ccc(F)cc2)c(=O)n(CC(=O)N2CCCCC2)c2cc(Cc3ccc(F)cc3)cnc12
Oc1c(C(=O)NCc2ccc(F)cc2)c(=O)n(CC(=O)N2CCOCC2)c2cc(Cc3ccc(F)cc3)cnc12
COc1cccc(CNC(=O)c2c(O)c3ncc(Cc4ccc(F)cc4)cc3[nH]c2=O)c1
Oc1c(C(=O)NCc2ccc(F)cc2)c(=O)[nH]c2cc(Cc3ccc(F)cc3)cnc12
Oc1c(C(=O)NCc2ccc(F)cc2)c(=O)n(C2CCCC2)c2cccnc12
COc1ccc(CNC(=O)c2c(O)c3ncc(Cc4ccc(F)cc4)cc3[nH]c2=O)cc1
CC(NC(=O)c1c(O)c2ncc(Cc3ccccc3)cc2[nH]c1=O)c1ccccc1
CS(=O)(=O)c1ccc(Cn2c3cc(Cc4ccccc4)cnc3c(O)c(C(=O)NCc3ccc(F)cc3)c2=O)cc1
CN(C)C(=O)Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NCc2ccc(F)cc2)c1=O
Oc1c(C(=O)NCc2ccc(F)cc2)c(=O)n(CC2CC2)c2cc(Cc3ccccc3)cnc12
CCCn1c2cc(Cc3ccccc3)cnc2c(O)c(C(=O)NCc2ccc(F)cc2)c1=O
COc1ccc(cc1O)-c1c2c(n3ccc4cc(OC)c(OC)cc4c13)c(=O)oc1cc(OS([O-])(=O)=O)c(OC)cc21
Cc1c(nnn1Cc1ccc(F)cc1)C(=O)\C=C(/O)c1ccccc1
COc1ccc(cc1OC)C(\O)=C\C(=O)c1nnn(Cc2ccc(F)cc2)c1C
Cc1c(nnn1Cc1cccc(F)c1)C(=O)\C=C(/O)c1ccccc1
COc1cc(cc(OC)c1OC)C(\O)=C\C(=O)c1nnn(Cc2cccc(F)c2)c1C
Cc1c(nnn1Cc1ccc(F)cc1)C(=O)\C=C(/O)c1ccc(O)c(O)c1
Cc1c(nnn1Cc1ccc(F)cc1)C(=O)\C=C(/O)c1cc(O)c(O)c(O)c1
Cc1c(nnn1Cc1cccc(F)c1)C(=O)\C=C(/O)c1ccc(O)cc1
COc1cc(cc(OC)c1OC)C(\O)=C\C(=O)c1nnn(Cc2ccc(F)cc2)c1C
Cc1c(nnn1Cc1cccc(F)c1)C(=O)\C=C(/O)c1ccc(O)c(O)c1
COc1ccc(cc1)C(\O)=C\C(=O)c1nnn(Cc2ccc(F)cc2)c1C
Cc1c(nnn1Cc1ccc(F)cc1)C(=O)\C=C(/O)c1ccc(O)cc1
Cc1c(nnn1Cc1cccc(F)c1)C(=O)\C=C(/O)c1cc(O)c(O)c(O)c1
COc1ccc(cc1OC)C(\O)=C\C(=O)c1nnn(Cc2cccc(F)c2)c1C
COc1ccc(cc1)C(\O)=C\C(=O)c1nnn(Cc2cccc(F)c2)c1C
Cc1cn([C@H]2C[C@H](OP(C)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(C)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(=O)OCCCCCCNC(=S)Nc3ccc(c(c3)C(O)=O)-c3c4cc(Br)c(O)c(Br)c4oc4c(Br)c(=O)c(Br)cc34)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)[C@@H](COP(C)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3CO)n3cnc4c3nc(N)[nH]c4=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)O2)c(=O)[nH]c1=O |r|
Cc1cn([C@H]2C[C@H](OP(O)(=O)OCCCCCCNC(=S)Nc3ccc(c(c3)C(O)=O)-c3c4cc(Br)c(O)c(Br)c4oc4c(Br)c(=O)c(Br)cc34)[C@@H](COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(S)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(S)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(S)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3CO)n3cnc4c3nc(N)[nH]c4=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)O2)c(=O)[nH]c1=O |r|
Cc1cn([C@H]2C[C@H](OP(O)(=O)OCCCCCCNC(=S)Nc3ccc(c(c3)C(O)=O)-c3c4cc(Br)c(O)c(Br)c4oc4c(Br)c(=O)c(Br)cc34)[C@@H](COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(S)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(S)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(S)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3CO)n3cnc4c3nc(N)[nH]c4=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)O2)c(=O)[nH]c1=O |r|
Cc1cn([C@H]2C[C@H](O)[C@@H](COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3CCO[C@@H]3COP(O)(=O)O[C@H]3CCO[C@@H]3COP(O)(=O)O[C@H]3CCO[C@@H]3COP(O)(=O)O[C@H]3CCO[C@@H]3COP(O)(=O)O[C@H]3CCO[C@@H]3COP(O)(=O)O[C@H]3CCO[C@@H]3COP(O)(=O)OCCCCCCNC(=O)c3cc(Cl)c(C(O)=O)c(c3Cl)-c3c4cc(Cl)c(O)c(Cl)c4oc4c(Cl)c(=O)c(Cl)cc34)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)O2)c(=O)[nH]c1=O |r|
Cc1cn([C@H]2C[C@H](O)[C@@H](COP(O)(=O)OCCCOP(O)(=O)OCCCOP(O)(=O)OCCCOP(O)(=O)OCCCOP(O)(=O)OCCCOP(O)(=O)OCCCOP(O)(=O)OCCCOP(O)(=O)OCCCOP(O)(=O)OCCCOP(O)(=O)OCCCOP(O)(=O)OCCCCCCNC(=O)c3cc(Cl)c(C(O)=O)c(c3Cl)-c3c4cc(Cl)c(O)c(Cl)c4oc4c(Cl)c(=O)c(Cl)cc34)O2)c(=O)[nH]c1=O |r|
CO[C@@H]1[C@H](OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OCCCCCCNC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3cc(Br)c(O)c(Br)c3oc3c(Br)c(=O)c(Br)cc23)n2ccc(=O)[nH]c2=O)n2cnc3c2nc(N)[nH]c3=O)n2ccc(=O)[nH]c2=O)n2cnc3c2nc(N)[nH]c3=O)n2ccc(=O)[nH]c2=O)n2ccc(=O)[nH]c2=O)n2ccc(=O)[nH]c2=O)n2ccc(=O)[nH]c2=O)n2ccc(=O)[nH]c2=O)n2cnc3c2nc(N)[nH]c3=O)[C@@H](CO)O[C@H]1n1cnc2c1nc(N)[nH]c2=O |r|
CO[C@@H]1[C@H](O)[C@@H](COP(O)(=O)O[C@@H]2[C@@H](COP(O)(=O)O[C@@H]3[C@@H](COP(O)(=O)O[C@@H]4[C@@H](COP(O)(=O)O[C@@H]5[C@@H](COP(O)(=O)O[C@@H]6[C@@H](COP(O)(=O)O[C@@H]7[C@@H](COP(O)(=O)O[C@@H]8[C@@H](COP(O)(=O)O[C@@H]9[C@@H](COP(O)(=O)O[C@@H]%10[C@@H](COP(O)(=O)O[C@@H]%11[C@@H](COP(O)(=O)OCCCCCCNC(=O)c%12cc(Cl)c(C(O)=O)c(c%12Cl)-c%12c%13cc(Cl)c(O)c(Cl)c%13oc%13c(Cl)c(=O)c(Cl)cc%12%13)O[C@H]([C@@H]%11OC)n%11cnc%12c%11nc(N)[nH]c%12=O)O[C@H]([C@@H]%10OC)n%10cnc%11c%10nc(N)[nH]c%11=O)O[C@H]([C@@H]9OC)n9ccc(=O)[nH]c9=O)O[C@H]([C@@H]8OC)n8ccc(=O)[nH]c8=O)O[C@H]([C@@H]7OC)n7ccc(=O)[nH]c7=O)O[C@H]([C@@H]6OC)n6ccc(=O)[nH]c6=O)O[C@H]([C@@H]5OC)n5ccc(=O)[nH]c5=O)O[C@H]([C@@H]4OC)n4cnc5c4nc(N)[nH]c5=O)O[C@H]([C@@H]3OC)n3ccc(=O)[nH]c3=O)O[C@H]([C@@H]2OC)n2cnc3c2nc(N)[nH]c3=O)O[C@H]1n1ccc(=O)[nH]c1=O |r|
CCCCCCCCC=C/CCCCCCCC(=O)NCCCOCC(O)COP(S)(=O)O[C@@H]1[C@@H](COP(S)(=O)O[C@@H]2[C@@H](COP(S)(=O)O[C@@H]3[C@@H](COP(S)(=O)O[C@@H]4[C@@H](COP(S)(=O)O[C@@H]5[C@@H](COP(S)(=O)O[C@@H]6[C@@H](COP(S)(=O)O[C@@H]7[C@@H](COP(S)(=O)O[C@@H]8[C@@H](COP(S)(=O)O[C@@H]9[C@@H](COP(S)(=O)O[C@@H]%10[C@@H](COP(S)(=O)O[C@@H]%11[C@@H](COP(S)(=O)OCCCCCCNC(=O)c%12cc(Cl)c(C(O)=O)c(c%12Cl)-c%12c%13cc(Cl)c(O)c(Cl)c%13oc%13c(Cl)c(=O)c(Cl)cc%12%13)O[C@H]([C@@H]%11OC)n%11cnc%12c%11nc(N)[nH]c%12=O)O[C@H]([C@@H]%10OC)n%10cnc%11c%10nc(N)[nH]c%11=O)O[C@H]([C@@H]9OC)n9ccc(=O)[nH]c9=O)O[C@H]([C@@H]8OC)n8ccc(=O)[nH]c8=O)O[C@H]([C@@H]7OC)n7ccc(=O)[nH]c7=O)O[C@H]([C@@H]6OC)n6ccc(=O)[nH]c6=O)O[C@H]([C@@H]5OC)n5ccc(=O)[nH]c5=O)O[C@H]([C@@H]4OC)n4cnc5c4nc(N)[nH]c5=O)O[C@H]([C@@H]3OC)n3ccc(=O)[nH]c3=O)O[C@H]([C@@H]2OC)n2cnc3c2nc(N)[nH]c3=O)O[C@H]([C@@H]1OC)n1ccc(=O)[nH]c1=O |r|
Cc1cn([C@H]2C[C@H](O)[C@@H](COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@@H]3C[C@@H](CO)N(C3)C(=O)CCCCCNC(=O)c3ccc(C(O)=O)c(c3)-c3c4ccc(O)cc4oc4cc(=O)ccc34)n3cnc4c3nc(N)[nH]c4=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)O2)c(=O)[nH]c1=O |r|
Cc1cn([C@H]2C[C@H](O)[C@@H](COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)OCCCCCCNC(=O)c3ccc(C(O)=O)c(c3)-c3c4ccc(O)cc4oc4cc(=O)ccc34)n3cnc4c3nc(N)[nH]c4=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)O2)c(=O)[nH]c1=O |r|
Cc1cn([C@H]2C[C@H](OP(O)(=O)OCCCCCCNC(=S)Nc3ccc(c(c3)C(O)=O)-c3c4ccc(O)cc4oc4cc(=O)ccc34)[C@@H](COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3CO)n3cnc4c3nc(N)[nH]c4=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)O2)c(=O)[nH]c1=O |r|
Cc1cn([C@H]2C[C@H](O)[C@@H](COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)OCCCCCCNC(=O)c3cc(Cl)c(C(O)=O)c(c3Cl)-c3c4cc(Cl)c(O)cc4oc4cc(=O)c(Cl)cc34)n3cnc4c3nc(N)[nH]c4=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)O2)c(=O)[nH]c1=O |r|
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Cc1cn([C@H]2C[C@H](O)[C@@H](COP(O)(=O)O[C@H]3CCO[C@@H]3COP(O)(=O)O[C@H]3CCO[C@@H]3COP(O)(=O)O[C@H]3CCO[C@@H]3COP(O)(=O)O[C@H]3CCO[C@@H]3COP(O)(=O)O[C@H]3CCO[C@@H]3COP(O)(=O)O[C@H]3CCO[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)OCCCCCCNC(=O)c3cc(Cl)c(C(O)=O)c(c3Cl)-c3c4cc(Cl)c(O)c(Cl)c4oc4c(Cl)c(=O)c(Cl)cc34)n3cnc4c3nc(N)[nH]c4=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)O2)c(=O)[nH]c1=O |r|
Cc1cn([C@H]2C[C@H](OP(C)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(=O)OC[C@H]3O[C@H](C[C@@H]3OP(O)(=O)OCCCCCCNC(=S)Nc3ccc(c(c3)C(O)=O)-c3c4cc(Br)c(O)c(Br)c4oc4c(Br)c(=O)c(Br)cc34)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)[C@@H](COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(C)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(C)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3CO)n3cnc4c3nc(N)[nH]c4=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)n3cnc4c3nc(N)[nH]c4=O)O2)c(=O)[nH]c1=O |r|
Cc1cn([C@H]2C[C@H](O)[C@@H](COP(O)(=O)OCCCOP(O)(=O)OCCCOP(O)(=O)OCCCOP(O)(=O)OCCCOP(O)(=O)OCCCOP(O)(=O)OCCCOP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)OCCCCCCNC(=O)c3cc(Cl)c(C(O)=O)c(c3Cl)-c3c4cc(Cl)c(O)c(Cl)c4oc4c(Cl)c(=O)c(Cl)cc34)n3cnc4c3nc(N)[nH]c4=O)n3cnc4c3nc(N)[nH]c4=O)n3cc(C)c(=O)[nH]c3=O)n3cc(C)c(=O)[nH]c3=O)O2)c(=O)[nH]c1=O |r|
COc1ccc(CNC(=O)C\C(C)=N\NC(=O)c2cc3ccccc3cc2O)cc1
COc1ccc(CCNC(=O)C\C(C)=N\NC(=O)c2cc3ccccc3cc2O)cc1OC
Oc1c(C(=O)NCc2ccc(F)cc2)c2cc(Cl)ccc2[nH]c1=O
Oc1c(C(=O)NCc2ccc(F)cc2)c2cc(F)ccc2[nH]c1=O
COc1ccc(CNC(=O)c2c(O)c(=O)[nH]c3ccc(F)cc23)cc1
Oc1c(C(=O)NCc2ccc(F)cc2)c2ccccc2[nH]c1=O
[H][C@]12CSC(=N1)[C@@H](Cc1ccccc1)NC(=O)[C@]1([H])CCCN1C(=O)[C@]1([H])CCCN1C(=O)[C@@H](NC(=O)[C@@]([H])(NC2=O)[C@@H](C)CC)C(C)C |r,c:4|
CN(C)C(=O)c1[nH]cc(C(=O)NCc2ccc(F)cc2)c(=O)c1O
CNC(=O)c1[nH]cc(C(=O)NCc2ccc(F)cc2)c(=O)c1O
COCCNC(=O)c1[nH]cc(C(=O)NCc2ccc(F)cc2)c(=O)c1O
OC(=O)c1[nH]cc(C(=O)NCc2ccc(F)cc2)c(=O)c1O
COC(=O)c1[nH]cc(C(=O)NCc2ccc(F)cc2)c(=O)c1O
NC(=O)c1[nH]cc(C(=O)NCc2ccc(F)cc2)c(=O)c1O
OCCNC(=O)c1[nH]cc(C(=O)NCc2ccc(F)cc2)c(=O)c1O
c1ccc(cc1)C2=C(C(=O)Nc3c2cc(cc3)Cl)CC(=O)O
CC(C)(CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C1(C)C)C(O)=O |r,t:20|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
COc1cccc(CC(NC(=O)CCCC[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(O)=O)c1OC |r,t:25|
Oc1cc(OCc2ccccc2)ccc1C(=O)NCc1cccc(c1)[N+]([O-])=O
Oc1cc(O)c(C(=O)\C=C\c2cccc(O)c2O)c(O)c1
Oc1ccc(C(=O)\C=C\c2cc(F)cc(F)c2)c(O)c1
Oc1ccc(C(=O)\C=C\c2cc(O)ccc2O)c(O)c1
Oc1cc(O)c(C(=O)\C=C\c2ccccc2O)c(O)c1
CC1(C)CC[C@]2(CCCCC(=O)NC(Cc3ccccc3Cl)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:30|
COc1cc(CC(NC(=O)CCCC[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(O)=O)cc(OC)c1 |r,t:23|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OCc6cccc(c6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
COc1ccccc1CC(NC(=O)CCCC[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(O)=O |r,t:27|
Oc1ccc(C(=O)\C=C\c2ccccc2Cl)c(O)c1
Oc1cccc(C(=O)\C=C\c2ccccc2O)c1O
CCCC(C(O)=O)c1c(C)nc2ccc(Cl)cc2c1-c1ccccc1
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OCc6ccccc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
Oc1ccc(cc1O)C(=O)\C=C\c1ccccc1O
Cc1nc2ccccc2c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O |r,wD:23.27,(20.45,-46.03,;19.11,-45.26,;17.78,-46.04,;16.44,-45.27,;15.1,-46.05,;13.77,-45.28,;13.77,-43.73,;15.1,-42.96,;16.44,-43.73,;17.76,-42.94,;17.75,-41.41,;19.09,-40.63,;19.08,-39.09,;20.41,-38.31,;17.74,-38.34,;17.74,-36.8,;16.4,-36.03,;15.06,-36.8,;15.06,-38.35,;16.41,-39.11,;16.42,-40.65,;15.09,-41.43,;19.11,-43.72,;20.44,-42.94,;20.43,-41.4,;21.77,-40.63,;21.76,-39.09,;23.1,-41.39,;23.09,-39.84,;21.78,-43.71,;23.11,-42.93,;21.78,-45.25,)|
Oc1ccc(C(=O)\C=C\c2cccc(O)c2O)c(O)c1
NCCNc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1
Fc1ccc(CNC(=O)c2nc(Br)c3cccnc3c2NCCCNc2c(nc(Br)c3cccnc23)C(=O)NCc2ccc(F)cc2)cc1
C[C@H](Nc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1)c1ccccc1 |r|
Fc1ccc(CNC(=O)c2nc(Br)c3cccnc3c2NCc2ccccc2)cc1
CNc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1
C[C@H](CO)Nc1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12 |r|
OCCNc1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
Oc1c(nc(NCCCCCCNC=O)c2cccnc12)C(=O)NCc1ccc(F)cc1
Oc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1
NCCCNc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1
Fc1ccc(CNC(=O)c2nc(Br)c3cccnc3c2NCc2ccc(F)cc2)cc1
OCCNc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1
Oc1c(nc(NCCc2c[nH]c3ccccc23)c2cccnc12)C(=O)NCc1ccc(F)cc1
CS(=O)(=O)Oc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1
CS(=O)(=O)NCCCCCCN(c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12)S(C)(=O)=O
C[C@@H](CO)Nc1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12 |r|
Cc1ccc(cc1)S(=O)(=O)Oc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1
C[C@@H](Nc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1)c1ccccc1 |r|
CS(=O)(=O)NCCCN(c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12)S(C)(=O)=O
CC(C)c1c(O)c(O)c2C(=O)N(Cc3ccc(F)c(Cl)c3)Cc2c1S(=O)(=O)N1CCOCC1
CCCCc1c(O)c(O)c2C(=O)N(Cc3ccc(F)c(Cl)c3)Cc2c1S(=O)(=O)N(C)C
CN(CC(O)=O)S(=O)(=O)c1cc(O)c(O)c2C(=O)N(Cc3ccc(F)c(Cl)c3)Cc12
Oc1cc(c2CN(Cc3ccc(F)c(Cl)c3)C(=O)c2c1O)S(=O)(=O)N1CCOCC1
Oc1cc(c2CN(Cc3ccc(F)c(Cl)c3)C(=O)c2c1O)S(=O)(=O)NCc1ccccn1
Oc1cc(c2CN(Cc3ccc(F)c(Cl)c3)C(=O)c2c1O)S(=O)(=O)NCCN1CCNCC1
CCN(CC)S(=O)(=O)c1cc(O)c(O)c2C(=O)N(Cc3ccc(F)c(Cl)c3)Cc12
CNS(=O)(=O)c1cc(O)c(O)c2C(=O)N(Cc3ccc(F)c(Cl)c3)Cc12
CN(C)S(=O)(=O)c1ccc(cc1)-c1cc2CN(Cc3ccc(F)c(Cl)c3)C(=O)c2c(O)c1O
CC(C)c1cc2CN(Cc3ccc(F)c(Cl)c3)C(=O)c2c(O)c1O
CCCCc1cc2CN(Cc3ccc(F)c(Cl)c3)C(=O)c2c(O)c1O
CC(C)c1c(O)c(O)c2C(=O)N(Cc3ccc(F)c(Cl)c3)Cc2c1S(=O)(=O)N(C)C
CN(C)S(=O)(=O)c1c2CN(Cc3ccc(F)c(Cl)c3)C(=O)c2c(O)c(O)c1C
OC(=O)CNS(=O)(=O)c1cc(O)c(O)c2C(=O)N(Cc3ccc(F)c(Cl)c3)Cc12
NCCN1CCN(CC1)S(=O)(=O)c1cc(O)c(O)c2C(=O)N(Cc3ccc(F)c(Cl)c3)Cc12
Oc1cc(c2CN(Cc3ccc(F)c(Cl)c3)C(=O)c2c1O)S(=O)(=O)NCCN1CCOCC1
Oc1cc2CN(Cc3ccc(F)c(Cl)c3)C(=O)c2c(O)c1O
Cc1cc2CN(Cc3ccc(F)c(Cl)c3)C(=O)c2c(O)c1O
Oc1cc(c2CN(Cc3ccc(F)c(Cl)c3)C(=O)c2c1O)S(=O)(=O)NCCCBr
CN(C)S(=O)(=O)c1ccc(cc1)-c1c(O)c(O)c2C(=O)N(Cc3ccc(F)c(Cl)c3)Cc2c1S(=O)(=O)N(C)C
CN(C)S(=O)(=O)c1c2CN(Cc3ccc(F)c(Cl)c3)C(=O)c2c(O)c(O)c1O
CN(C)CCCNS(=O)(=O)c1cc(O)c(O)c2C(=O)N(Cc3ccc(F)c(Cl)c3)Cc12
CN1CCN(CC1)S(=O)(=O)c1cc(O)c(O)c2C(=O)N(Cc3ccc(F)c(Cl)c3)Cc12
Oc1c2C(=O)N(Cc3ccc(F)c(Cl)c3)Cc2cc(c1O)-c1ccccc1
Oc1ccc(CCNC(=O)CCc2ccccc2)cc1O
Oc1ccc(\C=C\C(=O)OCCc2ccccc2)c(O)c1O
Oc1cc(\C=C\C(=O)OCCc2ccccc2)cc(O)c1O
Oc1ccc(O)c(\C=C\C(=O)OCCc2ccccc2)c1
Fc1ccc(\C=C\C(=O)OCCc2ccccc2)cc1F
NC(=O)c1cc2ccc(O)c(O)c2oc1=N
Oc1ccc(\C=C\C(=O)OCCCc2ccccc2)cc1O
Oc1ccc(CCNC(=O)CCc2ccc(O)c(O)c2)cc1O
COC(=O)c1cc2ccc(O)c(O)c2cn1
c1cc(c(cc1/C=C(\C#N)/C(=O)N)O)O
Oc1ccc(\C=C\C(=O)OCCc2cccc3ccccc23)cc1O
COc1ccc(\C=C\C(=O)OCCc2ccccc2)cc1OC
Oc1ccc(CCC(=O)OCCc2ccccc2)cc1O
Oc1ccc(\C=C\C(=O)OCCc2ccc3ccccc3c2)cc1O
Oc1cc2cnc(cc2cc1O)C(=O)NCc1ccccc1
COc1ccc(\C=C\C(=O)OCCc2ccccc2)cc1O
Oc1ccc2cc(ccc2c1O)C(=O)OCCc1ccccc1
COc1cc(ccc1O)/C=C/C(=O)OCCc2ccccc2
Oc1ccc2cc(ncc2c1O)C(=O)NCc1ccccc1
COC(=O)c1ccc2c(O)c(O)ccc2c1
Oc1cc(O)c(\C=C\C(=O)OCCc2ccccc2)cc1O
Oc1ccc2cc(ncc2c1O)C(=O)NCCc1ccccc1
Oc1ccc(CCC(=O)NCCc2ccccc2)cc1O
NC(=O)c1cc2cc(O)c(O)cc2oc1=N
Oc1ccc(CCC(=O)NCCc2cc(O)c(O)c(O)c2)cc1O
Oc1cc2ccc(cc2cc1O)C(=O)OCCc1ccccc1
COC(=O)c1cc2cc(O)c(O)cc2cn1
Oc1ccc(CCNC(=O)Cc2ccccc2)cc1O
COc1cc(NC(C)CCCN)c2ncccc2c1
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(F)c2)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1ccc2[nH]cc(C(=O)\C=C(/O)C(=O)OCC)c(=O)c2c1
Cc1cccc(\C=C\c2ccc3ccc(C(O)=O)c(O)c3n2)c1C
COc1cccc(Cn2cc(C(=O)\C=C(/O)C(O)=O)c(=O)c3ccccc23)c1
OC(=O)C(\O)=C\C(=O)c1cn(Cc2c(F)cccc2F)c2ccccc2c1=O
CCN(CC)CCC[C@@H](C)Nc1ccnc2c1ccc(c2)Cl
OC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(F)c2)c2ccccc2c1=O
COc1ccccc1Cn1cc(C(=O)\C=C(/O)C(O)=O)c(=O)c2ccccc12
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccccc2OC)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2c(F)cccc2F)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1ccc2n(Cc3ccc(F)cc3)cc(C(O)=O)c(=O)c2c1
CCOC(=O)C(\O)=C\C(=O)c1ccc2n(cc(C(=O)\C=C(/O)C(=O)OCC)c(=O)c2c1)-c1ccccc1
OC(=O)C(\O)=C\C(=O)c1ccc2[nH]cc(C(=O)\C=C(/O)C(O)=O)c(=O)c2c1
C\C(CC1Nc2c(O)c(ccc2C=C1)C(O)=O)=C1\C=CC(=O)C(O)=C1 |c:13,20,25|
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(OC)c2)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1ccc2n(cc(C(=O)\C=C(/O)C(O)=O)c(=O)c2c1)-c1ccccc1
CC[C@@H](CO)n1cc(CO)c(=O)c2cc(Cc3ccccc3F)c(OC)cc12 |r|
OC(=O)C(\O)=C\C(=O)C1=CC(Cc2ccc(F)cc2)c2ccc(cc2C1=O)C(=O)\C=C(\O)C(O)=O |t:8|
Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)Nc2ccc(F)cc2)cc1O
CC(=O)Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)Nc2ccc(Cl)cc2)cc1OC(C)=O
Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)Nc2cccc(c2)[N+]([O-])=O)cc1O
Cc1ccc(NS(=O)(=O)c2cccc3c(NC(=O)\C=C\c4ccc(O)c(O)c4)cccc23)cc1
Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)Nc2ccc(Cl)cc2)cc1O
Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)NCc2ccccc2)cc1O
Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)Nc2ccccc2)cc1O
CC(=O)Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)Nc2cccc(C)c2C)cc1OC(C)=O
CC(=O)Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)Nc2cccc(c2)[N+]([O-])=O)cc1OC(C)=O
CC(=O)Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)Nc2ccc(C)cc2)cc1OC(C)=O
CC(=O)Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)Nc2ccc(Br)cc2)cc1OC(C)=O
CC(=O)Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)NCc2ccccc2)cc1OC(C)=O
CC(=O)Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)Nc2ccccc2)cc1OC(C)=O
Cc1ccccc1NS(=O)(=O)c1cccc2c(NC(=O)\C=C\c3ccc(O)c(O)c3)cccc12
CC(=O)Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)Nc2ccc(F)cc2)cc1OC(C)=O
Cc1cccc(NS(=O)(=O)c2cccc3c(NC(=O)\C=C\c4ccc(O)c(O)c4)cccc23)c1C
Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)NCCc2ccccc2)cc1O
CC(=O)Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)Nc2ccccc2C)cc1OC(C)=O
CC(=O)Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)NCCc2ccccc2)cc1OC(C)=O
Oc1ccc(\C=C\C(=O)Nc2cccc3c(cccc23)S(=O)(=O)Nc2ccc(Br)cc2)cc1O
Oc1c(C(c2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
Cn1c(cc2ccccc12)C(=O)\C=C(/O)C(O)=O
Oc1c(-c2cccc(c2)-c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
Oc1c(-c2ccccc2-c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12 |(12.57,-6.97,;11.21,-6.25,;9.9,-7.07,;9.94,-8.6,;11.29,-9.34,;11.33,-10.89,;10.02,-11.69,;8.67,-10.95,;8.64,-9.41,;7.3,-8.67,;5.97,-9.47,;6,-11.01,;4.61,-8.73,;3.3,-9.53,;1.95,-8.79,;1.92,-7.25,;3.22,-6.45,;4.58,-7.18,;5.89,-6.36,;7.26,-7.11,;7.21,-5.57,;8.53,-6.33,;8.57,-7.87,;8.48,-4.77,;9.8,-3.97,;9.76,-2.43,;11.07,-1.63,;12.43,-2.36,;12.47,-3.9,;11.17,-4.7,)|
COC(=O)C(=O)CC(=O)c1cn(C)c2cc3OCOc3cc12
Oc1c(C(c2ccc(cc2)[N+]([O-])=O)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
Oc1c(C(c2ccc(OCc3ccccc3)cc2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
CCn1cc(C(=O)\C=C(/O)C(O)=O)c2cc3OCOc3cc12
Oc1c(C(c2cnc3CC=CCc3c2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12 |c:9|
Cn1cc(C(=O)\C=C(/O)C(O)=O)c2cc3OCOc3cc12
Oc1c(C2c3ccccc3Oc3c2c(=O)oc2ccccc32)c(=O)oc2ccccc12
Oc1c(Cc2ccc(Cc3c(O)c4ccccc4oc3=O)cc2)c(=O)oc2ccccc12
Oc1ccc2c(O)c(C(c3ccc4CC=CCc4c3)c3c(O)c4ccc(O)cc4oc3=O)c(=O)oc2c1 |c:14|
Oc1ccc2c(O)c(C(c3ccccn3)c3c(O)c4ccc(O)cc4oc3=O)c(=O)oc2c1
Oc1ccc2c(O)c(C(c3ccc(cc3)C(c3c(O)c4ccc(O)cc4oc3=O)c3c(O)c4ccc(O)cc4oc3=O)c3c(O)c4ccc(O)cc4oc3=O)c(=O)oc2c1
Oc1ccc2c(O)c(C(c3ccccc3)c3c(O)c4ccc(O)cc4oc3=O)c(=O)oc2c1
Oc1ccc2c(O)c(Cc3c(O)c4ccc(O)cc4oc3=O)c(=O)oc2c1
Oc1c(C(c2ccc(\C=C\c3ccccc3)cc2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
Oc1c(C(c2ccc-3c(Cc4ccccc-34)c2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
Oc1c(C(c2ccco2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
Oc1c(C(c2cccs2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
OC(=O)c1ccc(cc1)C(c1c(O)c2ccccc2oc1=O)c1c(O)c2ccccc2oc1=O
COc1cc(ccc1O)C(c1c(O)c2ccccc2oc1=O)c1c(O)c2ccccc2oc1=O
Oc1ccc(cc1)C(c1c(O)c2ccccc2oc1=O)c1c(O)c2ccccc2oc1=O
Oc1c(C(c2ccccc2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
CCn1c(cc2cc3OCOc3cc12)C(=O)CC(=O)C(=O)OC
COC(=O)C(=O)CC(=O)c1cc2cc3OCOc3cc2n1C
OC(=O)C(\O)=C\C(=O)c1cc2cc3OCOc3cc2n1Cc1ccccc1
OC(=O)C(\O)=C\C(=O)c1cc2ccccc2n1Cc1ccccc1
CCn1c(cc2cc3OCOc3cc12)C(=O)\C=C(/O)C(O)=O
Cn1c(cc2cc3OCOc3cc12)C(=O)\C=C(/O)C(O)=O
Oc1c(C2c3c(Oc4c2c(=O)oc2ccccc42)c2ccccc2oc3=O)c(=O)oc2ccccc12
Oc1c(C(c2ccc3CC=CCc3c2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12 |c:9|
CN(C)c1ccc(cc1)C(c1c(O)c2ccccc2oc1=O)c1c(O)c2ccccc2oc1=O
CCn1cc(C(=O)CC(=O)C(=O)OC)c2ccccc12
Cn1cc(C(=O)\C=C(/O)C(O)=O)c2ccccc12
CCn1c(cc2ccccc12)C(=O)\C=C(/O)C(O)=O
Oc1c(C(c2cccc(c2)C(c2c(O)c3ccccc3oc2=O)c2c(O)c3ccccc3oc2=O)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
COC(=O)C(=O)CC(=O)c1cc2ccccc2n1C
Oc1ccc2c(O)c(C(c3cccnc3)c3c(O)c4ccc(O)cc4oc3=O)c(=O)oc2c1
Oc1c(C(c2ccc(cc2)-c2ccccc2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
CCn1cc(C(=O)\C=C(/O)C(O)=O)c2ccccc12
Oc1ccc2c(O)c(C(c3ccc(CCc4ccccc4)cc3)c3c(O)c4ccc(O)cc4oc3=O)c(=O)oc2c1
Cc1csc2c1ncn1c(NS(=O)(=O)c3cc(C)c(Cl)cc3S)nnc21
O=C1NC(=S)SC1NS(=O)(=O)c1ccc(cc1)\N=N\c1ncccn1
Cc1cc2c(SC(=NS2(=O)=O)C(=O)c2ccc(F)cc2)cc1Cl |c:6|
NNS(=O)(=O)c1cccc(OCC(O)=O)c1
CC(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
O=C(Oc1ccc(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c2ccc(OC(=O)c3ccccc3)c(OC(=O)c3ccccc3)c2)cc1OC(=O)c1ccccc1)c1ccccc1
Oc1ccc(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c2ccc(O)c(O)c2O)c(O)c1O
CCCCn1cnnc1NS(=O)(=O)c1cc(C(N)=O)c(Cl)cc1SCC(O)=O
Cc1ccc(cc1)-n1ncnc1-c1nc2ccccc2nc1NS(=O)(=O)c1cc(C(=O)Nc2ccccc2)c(Cl)cc1S
CC(C)Cn1cnnc1NS(=O)(=O)c1cc(C(=O)Nc2ccc(Cl)cc2)c(Cl)cc1S
CC(=O)C1(CCOC1=O)N=Nc1ccc(cc1)S(=O)(=O)Nc1nnc(C)s1 |w:9.9|
Cc1cc2nc3nc(N)nc(NS(=O)(=O)c4cc(C)c(Cl)cc4S)n3c2cc1C
Cc1cc(c(S)cc1Cl)S(=O)(=O)NC1=NCCCN1 |t:14|
CN(CCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(C)c1=O)S(C)(=O)=O
CC(=O)NCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(C)c1=O
Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NCCN2CCOCC2)c1=O
Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NCCCN2CCCC2)c1=O
C[C@@H](CO)CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(C)c1=O |r|
Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NC(C)(C)CO)c1=O
C[C@@H](CO)NC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(C)c1=O |r|
Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NCC(F)F)c1=O
CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(C)c1=O
C[C@@H](O)CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O |r|
C[C@H](CO)NC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O |r|
CSCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O
Oc1c(C(=O)NC2CCS(=O)(=O)CC2)c(=O)[nH]c2cc(Cc3ccc(F)cc3)cnc12
CN1CCN(CCCNC(=O)c2c(O)c3ncc(Cc4ccc(F)cc4)cc3[nH]c2=O)CC1
Oc1c(C(=O)NCCCN2CCCC2)c(=O)[nH]c2cc(Cc3ccc(F)cc3)cnc12
OCCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O
COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O
CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O
C[C@@H](CO)NC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O |r|
CC(C)OCCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O
Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NCCCO)c1=O
C[C@H](O)CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O |r|
Oc1c(C(=O)NCCCN2CCOCC2)c(=O)[nH]c2cc(Cc3ccc(F)cc3)cnc12
CC(C)(CO)CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O
CCOCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O
Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NCCN2CCNC2=O)c1=O
C[C@H](CO)NC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(C)c1=O |r|
CCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(C)c1=O
CC(C)(CO)NC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O
CN(CCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O)S(C)(=O)=O
Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NCCCN2CCCC2=O)c1=O
Oc1c(C(=O)NCCN2CCCCC2)c(=O)[nH]c2cc(Cc3ccc(F)cc3)cnc12
CC(C)CCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O
C[C@H](CO)CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(C)c1=O |r|
OCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O
Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NC2(CO)CCCC2)c1=O
Oc1c(C(=O)NCCCN2CCCC2=O)c(=O)[nH]c2cc(Cc3ccc(F)cc3)cnc12
NC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2[nH]c1=O
COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(C)c1=O
Oc1c(C(=O)NCCN2CCOCC2)c(=O)[nH]c2cc(Cc3ccc(F)cc3)cnc12
C[C@H](O)CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(C)c1=O |r|
COCCN1C(=S)NC(=O)\C(=C\NNC(=O)c2cc(Cl)ccc2O)C1=O
Oc1c(Br)cc(Br)cc1\C=N\NC(=O)CP(=O)(c1ccccc1)c1ccccc1
Oc1ccc(Br)cc1\C=N\NC(=O)C1=NNC2CCCCC12 |t:14|
Cc1occc1C(=O)NN\C=C1\C(=O)N(C(=O)c2ccccc12)c1ccccc1Cl
Oc1ccc(\C=N\N2CCN(CC2)c2ccccc2)cc1O
CC\N=c1\scc(-c2cc(OC)ccc2OC)n1\N=C(/C)c1ccco1
Cn1cccc1\C=N\N1CCN(Cc2ccccc2)CC1
Cc1ccc(N\N=C2/Sc3ccccc3C2=O)cc1
CN(C)c1ccc(cc1)\N=N\c1ccc(Cl)cc1
N(\N=C(\N=N\c1ccccc1)/c1ccccc1)c1ccccc1
COc1cc(\C=N\Nc2ccc(cc2[N+]([O-])=O)S(=O)(=O)Nc2ccccc2C(O)=O)ccc1O
Cc1nnc(NN)c2c3ccccc3[nH]c12
Oc1ccc(Br)cc1\C=N\NC(=O)COc1ccc(Cl)cc1Cl
Oc1ccc2ccccc2c1\C=N\NC(=O)c1n[nH]c2CCCc12
COc1ccc(OC)c(\C=N\NC(=O)c2n[nH]c3CCCc23)c1
Oc1ccc2ccccc2c1\C=N\NC(=O)c1ccncc1
Oc1ccccc1\C=N\NC(=O)c1cnccn1
Oc1ccc(\C=N\NC(=O)c2ccncc2)c(O)c1
COCC\N=c1\scc(-c2cccs2)n1\N=C\c1cc(Br)c(O)c(OC)c1
FC(F)(F)c1ccccc1\C=N\N1CCN(Cc2ccccc2)CC1
CC(=O)c1ccc(cc1)N=Nc1ccc(C[P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1
CCN(CC)c1ccc(\C=C2/CCC(\C=N\N=C\c3cccnc3)=C2N2CCOCC2)cc1 |c:24|
C\C(=N/Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccccc1)c1cc(O)ccc1O
COc1ccc(O)c(\C=N\NC(=O)c2sc3ccccc3c2O)c1
Oc1ccc2ccccc2c1\C=N\NC(=O)c1cc[nH]n1
Clc1ccc(\C=N\NC(=O)c2cnccn2)c(Cl)c1
COc1cc(Br)cc(\C=N\NC(=O)c2ccccn2)c1O
Brc1ccccc1-c1cs\c(=N\CC=C)n1\N=C\c1ccccn1
Oc1ccc(Br)cc1\C=N\NC(=O)c1cccnc1
Oc1ccc(Br)cc1\C=N\Nc1cccc2cccnc12
CCOc1cccc(\C=N\NC(=O)c2n[nH]c3CCCc23)c1O
CCNc1nc(NCC)nc(n1)C(=O)NN
Cc1sc2ncnc(N\N=C\c3c(O)ccc4ccccc34)c2c1C
COc1c(Cl)cc(Cl)cc1\C=N\NC(=O)c1ccncc1
C\C(=N/N1CCN(Cc2ccccc2Cl)CC1)c1ccc(cc1)[N+]([O-])=O
OC1=Cc2ccccc2\C(=N/Nc2ccc(Cl)cc2)C1=O |t:1|
COc1ccccc1NS(=O)(=O)c1ccc(N\N=C(/C)c2ccccc2Br)c(c1)[N+]([O-])=O
COc1ccccc1N1CCN(CC1)\N=C\c1ccc(Cl)c(c1)[N+]([O-])=O
Fc1ccc(cc1)C(CC(=O)c1cccs1)Sc1cccc2cccnc12
Cc1ccc(cc1)S(=O)(=O)NC(=O)Oc1cccc2cccnc12
Oc1ccc(CN2CCN(Cc3ccccc3)CC2)c2cccnc12
CCOC(=O)C1CCCN(Cc2ccc(O)c3ncccc23)C1
CCOC(=O)N1CCN(Cc2ccc(O)c3ncccc23)CC1
CCN1CCN(Cc2ccc(O)c3ncccc23)CC1
Cc1cccc(NCc2ccc(O)c3ncccc23)c1
Oc1ccc(CNc2ccccc2F)c2cccnc12
COc1cccc(NCc2ccc(O)c3ncccc23)c1
Cc1ccc(NCc2ccc(O)c3ncccc23)cc1
Cc1cccc(NCc2ccc(O)c3ncccc23)c1C
Oc1c(Cl)cc(Cl)c2cccnc12
CCOCc1ccc(O)c2ncccc12
CCC(=O)NC(c1ccccc1OC)c1ccc2cccnc2c1O
COc1cccc(c1)C(NC(C)=O)c1ccc2cccnc2c1O
CC(=O)NC(c1ccccc1)c1cc(Cl)c2cccnc2c1O
CCC(=O)NC(c1cccs1)c1cc([N+]([O-])=O)c2cccnc2c1O
CCC(=O)NC(c1ccc(OC)c(OC)c1)c1cc(Cl)c2cccnc2c1O
Oc1ccccc1C(Nc1nccs1)c1ccc2cccnc2c1O
Oc1ccc(CNc2ccc(cc2)C(F)(F)F)c2cccnc12
Cc1cccc(NCc2ccc(O)c3ncccc23)n1
Oc1ccc(CNc2cccc(c2)C(F)(F)F)c2cccnc12
Oc1ccc(Cc2ccc(O)c3ncccc23)c2cccnc12
CCCC(=O)NC(c1ccc(OC)cc1)c1ccc2cccnc2c1O
CN(C)c1ccc(cc1)C(NC(C)=O)c1cc(Cl)c2cccnc2c1O
CCC(=O)NC(c1ccc(OC)cc1)c1cc([N+]([O-])=O)c2cccnc2c1O
CCCC(=O)NC(c1ccccc1)c1ccc2cccnc2c1O
Oc1ccc(CN2CCN(CC2)c2ccccc2)c2cccnc12
Oc1ccc(CN2CCCCC2)c2cccnc12
Cc1ccc(NCc2ccc(O)c3ncccc23)cc1C
CCC(=O)NC(c1ccco1)c1cc(Cl)c2cccnc2c1O
CCOC(=O)C1CCN(Cc2ccc(O)c3ncccc23)CC1
FC(F)Oc1ccc(cc1)C(CC(=O)c1ccco1)Sc1cccc2cccnc12
CCOc1ccc(NCc2ccc(O)c3ncccc23)cc1
Oc1ccc(CN2CCN(CC2)c2ccccn2)c2cccnc12
c1cc2c(ccc(c2nc1)O)Cl
CN1CCN(Cc2ccc(O)c3ncccc23)CC1
COc1ccc(cc1OC)C(NC(C)=O)c1cc([N+]([O-])=O)c2cccnc2c1O
Oc1ccc(CNc2ccccc2Cl)c2cccnc12
Cc1ccccc1NCc1ccc(O)c2ncccc12
Cc1cccnc1NCc1ccc(O)c2ncccc12
[H][C@@]12[#6]-[#6]-[#6@H](-[#6](-[#6])-[#6]-[#6]-[#6]-[#6](-[#6])-[#6])[C@@]1([#6])[#6]-[#6][C@@]1([H])[C@@]2([H])[#6]-[#6]-[#6]2-[#6]\[#6](-[#6]-[#6][C@]12[#6])=[#6](\c1cc(Cl)c(-[#8])c(c1)-[#6](-[#8])=O)-c1cc(Cl)c(-[#8])c(c1)-[#6](-[#8])=O
[H][C@@]12[#6]-[#6]-[#6@H](-[#6](-[#6])-[#6]-[#6]\[#6]=[#6](/c3cc(Cl)c(-[#8])c(c3)-[#6](-[#8])=O)-c3cc(Cl)c(-[#8])c(c3)-[#6](-[#8])=O)[C@@]1([#6])[#6]-[#6][C@@]1([H])[C@@]2([H])[#6]-[#6][C@]2([H])[#6]C(F)(F)[#6]-[#6][C@]12[#6]
[#6]-[#6]-[#6]-[#6]-[#6]\[#6]=[#6](\c1cc(Cl)c(-[#8])c(c1)-[#6](=O)-[#7]-[#8])-c1cc(Cl)c(-[#8])c(c1)-[#6](=O)-[#7]-[#8]
[H][C@@]12[#6]-[#6]-[#6@H](-[#6](-[#6])-[#6]-[#6]-[#6]-[#6](-[#6])-[#6])[C@@]1([#6])[#6]-[#6][C@@]1([H])[C@@]2([H])[#6]-[#6]-[#6]2-[#6]-[#6@@H](-[#6]-[#6]\[#6]=[#6](\c3cc(Cl)c(-[#8])c(c3)-[#6](-[#8])=O)-c3cc(Cl)c(-[#8])c(c3)-[#6](-[#8])=O)-[#6]-[#6][C@]12[#6]
[H][C@@]12[#6]-[#6]-[#6@H](-[#6](-[#6])-[#6]-[#6]\[#6]=[#6](/c3cc(Cl)c(-[#8])c(c3)-[#6](-[#8])=O)-c3cc(Cl)c(-[#8])c(c3)-[#6](-[#8])=O)[C@@]1([#6])[#6]-[#6][C@@]1([H])[C@@]2([H])[#6]-[#6][C@]2([H])[#6]-[#6]-[#6]-[#6][C@]12[#6]
[#8]-[#6](=O)-c1cc(cc(Cl)c1-[#8])-[#6](=[#6]/[#6]C12[#6]-[#6]-3-[#6]-[#6](-[#6]-[#6](-[#6]-3)-[#6]1)-[#6]2)\c1cc(Cl)c(-[#8])c(c1)-[#6](-[#8])=O |TLB:17:18:22:16.15.21,THB:17:16:22:18.23.19,19:20:15:18.23.17,19:18:15:20.22.21|
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CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@](C)(CC=C)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
CC(C)C[C@@H]1NC(=O)[C@](C)(CCC\C=C/CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC1=O)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)c1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc12)[C@@H](C)O |r,c:13|
CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CCCC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@](C)(CCCC=C)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
CC(C)C[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CC\C=C\CC[C@](C)(NC1=O)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O |r,t:29|
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CCC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@](C)(CCC=C)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
CC(C)C[C@H](NC(=O)[C@](C)(CCCC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@](C)(CCCC=C)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CCC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@](C)(N)CCCC=C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
[H][C@]1(NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CCC\C=C/CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC1=O)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)CC |r,c:18|
CC(C)C[C@H](NC(=O)[C@](C)(CCCCC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@](C)(CCCCC=C)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@](C)(CCCC=C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@](C)(CCCC=C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@]1(C)CCC\C=C/CCC[C@](C)(N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r,c:30|
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)c1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc12)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
CC(C)C[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CCCC\C=C\CCCC[C@](C)(NC1=O)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O |r,t:31|
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@]1(C)CCC\C=C\CCC[C@](C)(NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r,t:59|
CC(C)C[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CCC\C=C/CCC[C@](C)(NC1=O)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O |r,c:30|
O[C@@H]1CCC[C@H]1NC(=O)C(=O)\C=C(/O)c1cc(Cc2ccc(F)cc2F)cn(Cc2ccccc2F)c1=O |r|
[H][C@@]12Cn3cc(C(=O)NCc4ccc(F)cc4F)c(=O)c(O)c3C(=O)N1[C@@H](C)CO2 |r|
[H][C@]12Cn3cc(C(=O)NCc4ccc(F)cc4)c(=O)c(O)c3C(=O)N1CC[C@@H](C)O2 |r|
CN1C(=O)C(C(=O)NCc2ccc(F)cc2)c2ccccc2C1=O
ON1C(=O)C(C(=O)Nc2cccc(F)c2)c2ccccc2C1=O
ON1C(=O)C(C(=O)NCc2ccc(O)cc2O)c2ccccc2C1=O
COc1ccc(NC(=O)C2C(=O)N(O)C(=O)c3ccccc23)cc1Cl
COc1ccc(CCNC(=O)C2C(=O)N(O)C(=O)c3ccccc23)cc1OC
COc1ccc(CNC(=O)C2C(=O)N(O)C(=O)c3ccccc23)c(OC)c1
COc1ccc(CNC(=O)C2C(=O)N(O)C(=O)c3ccccc23)cc1
ON1C(=O)C(C(=O)NCc2ccccc2)c2ccccc2C1=O
ON1C(=O)C(C(=O)NCc2ccc(F)cc2)c2ccccc2C1=O
COc1ccc(CNC(=O)C2C(=O)N(O)C(=O)c3ccccc23)cc1OC
ON1C(=O)C(C(=O)Nc2ccc(F)cc2)c2ccccc2C1=O
ON1C(=O)C(C(=O)Nc2ccccc2)c2ccccc2C1=O
Fc1ccc(CNC(=O)C2C(=O)NC(=O)c3ccccc23)cc1
Cc1ccc(CNC(=O)C2C(=O)N(O)C(=O)c3ccccc23)cc1
CN(C(=O)C1C(=O)N(O)C(=O)c2ccccc12)c1ccccc1
ON1C(=O)C(C(=O)NCc2ccc(O)c(O)c2)c2ccccc2C1=O
ON1C(=O)C(C(=O)NCCc2ccc(O)c(O)c2)c2ccccc2C1=O
ON1C(=O)C(C(=O)NCCc2ccc(F)cc2)c2ccccc2C1=O
CNC(=O)c1[nH]cnc1C(=O)Nc1ccccn1
Oc1ccccc1NC(=O)c1nc[nH]c1C(=O)N1CCOCC1
O=C(Nc1ccccn1)c1nc[nH]c1C(=O)N1CCNCC1
O=C(Nc1ccccn1)c1nc[nH]c1C(=O)N1CCOCC1
OC(=O)c1[nH]cnc1C(=O)Nc1ccccn1
OC(=O)c1[nH]cnc1C(=O)Nc1ccc(F)cc1
Oc1ccccc1NC(=O)c1nc[nH]c1C(=O)N1CCNCC1
OC1CCN(CC1)C(=O)c1[nH]cnc1C(=O)Nc1ccccc1O
OC1CCN(CC1)C(=O)c1[nH]cnc1C(=O)Nc1ccccn1
OC(=O)c1[nH]cnc1C(=O)NCc1ccc(F)cc1
COC(=O)c1[nH]cnc1C(=O)Nc1ccc(F)cc1
Nc1ccc(NC(=O)c2nc[nH]c2C(O)=O)cc1
OC(=O)c1[nH]cnc1C(=O)Nc1ccccc1
NNC(=O)c1[nH]cnc1C(=O)Nc1ccccn1
Cc1ccc(NC(=O)c2[nH]cnc2C(=O)NN)cc1
OC(=O)c1[nH]cnc1C(=O)Nc1ccc(cc1)[N+]([O-])=O
CCC(=O)NCCCn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C(C)(C)C
CC(=O)NCCCn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C(C)(C)C
CC(C)(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1CCCNC(=O)C1CC1
CC(C)(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1CCCN
CC(C)(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1CCCNS(=O)(=O)C1CC1
CC(C)(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1CCCNS(=O)(=O)c1ccccc1
Cn1cnc(c1)S(=O)(=O)NCCCn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C(C)(C)C
CC(=O)Nc1ccc(cc1)S(=O)(=O)NCCCn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C(C)(C)C
CC(C)(C)c1nc(C(=O)[N-]Cc2ccc(F)cc2)c(O)c(=O)n1CCCNC(=O)C1CC1
CCC(=O)NCCCn1c(nc(C(=O)[N-]Cc2ccc(F)cc2)c(O)c1=O)C(C)(C)C
CC(C)(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1CCC[N-]S(=O)(=O)c1ccccc1
CC(C)(C)C(=O)NCCCn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C(C)(C)C
CCS(=O)(=O)NCCCn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C(C)(C)C
CC(C)(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1CCCNC(=O)c1ccco1
CCCC(=O)NCCCn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C(C)(C)C
CC(C)(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1CCCNC(=O)c1cccs1
CC(C)(C)OC(=O)NCCCn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C(C)(C)C
CC(C)(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1CCC[N-]S(=O)(=O)C1CC1
CC(C)(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1CCCNC(=O)Cc1cccs1
CC(C)(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1CCCNC(=O)c1ccccc1
COc1ccc2c(c1)cc(C(=O)CC(=O)C(O)=O)c1c(F)cccc21
OC(=O)C(=O)CC(=O)c1ccc2ccc3c(Cl)cccc3c2c1
OC(=O)C(=O)CC(=O)c1ccc2c(ccc3ccc(Cl)cc23)c1
OC(=O)C(=O)CC(=O)c1ccc2ccc3ccccc3c2c1F
OC(=O)C(=O)CC(=O)c1ccc2c(ccc3c(Cl)cccc23)c1
OC(=O)C(=O)CC(=O)c1ccc2c(ccc3cc(Cl)ccc23)c1
OC(=O)C(=O)CC(=O)c1ccc2ccc3cc(F)ccc3c2c1F
COc1ccc2c(c1)cc(C(=O)CC(=O)C(O)=O)c1ccccc21
OC(=O)C(=O)CC(=O)c1ccc2ccc3c(F)cccc3c2c1
OC(=O)C(=O)CC(=O)c1ccc2c(ccc3c(F)cccc23)c1
CCOc1ccccc1Cn1cccc1\C=C\C(=O)CC(=O)C(O)=O
Cc1ccc(Cn2cccc2C=CC(=O)CC(=O)C(O)=O)cc1 |w:12.13|
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccc(F)cc1F
CCOC(=O)C(=O)CC(=O)C=Cc1cccn1Cc1ccc(F)cc1 |w:10.9|
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cc(F)cc(F)c1
COc1ccc(Cn2cccc2C=CC(=O)CC(=O)C(O)=O)cc1 |w:13.14|
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccccc1OC
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccccc1F
OC(=O)C(=O)CC(=O)c1ccc(NC(=O)c2ccccc2)s1
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccc(Cl)cc1Cl
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccc(F)c(F)c1
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1c(F)cccc1F
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccc(F)cc1F
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cccc(F)c1F
COc1ccccc1Cn1cccc1\C=C\C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccc(cc1)C#N
CCOC(=O)C(=O)CC(=O)C=Cc1cccn1Cc1ccc(OC)cc1 |w:10.9|
OC(=O)C(=O)CC(=O)C=Cc1cccn1Cc1ccc(Cl)cc1 |w:8.7|
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cccc(Cl)c1
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccccc1F
Cc1cccc(Cn2cccc2\C=C\C(=O)CC(=O)C(O)=O)c1
Cc1ccccc1Cn1cccc1\C=C\C(=O)CC(=O)C(O)=O
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cc(Cl)cc(Cl)c1
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1c(Cl)cccc1Cl
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccc(F)c(F)c1
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cc(F)ccc1F
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cc(C)cc(C)c1
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccccc1OCC
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cccc(c1)C#N
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccccc1C#N
CCOC(=O)C(=O)CC(=O)C=Cc1cccn1Cc1ccc(Cl)cc1 |w:10.9|
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cccc(F)c1
CCOC(=O)C(=O)CC(=O)C=Cc1cccn1Cc1ccc(C)cc1 |w:10.9|
CCOC(=O)C(=O)CC(=O)C=Cc1cccn1Cc1ccccc1 |w:10.9|
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccccc1C
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cc(F)ccc1F
Cc1cc(C)cc(Cn2cccc2\C=C\C(=O)CC(=O)C(O)=O)c1
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccccc1C#N
OC(=O)C(=O)CC(=O)C=Cc1cccn1Cc1ccc(F)cc1 |w:8.7|
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cc(F)cc(F)c1
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cccc(F)c1F
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cccc(Cl)c1
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccc(Cl)cc1Cl
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cccc(F)c1
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1c(F)cccc1F
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cccc(C)c1
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1c(Cl)cccc1Cl
CCOC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1ccc(cc1)C#N
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cc(Cl)cc(Cl)c1
OC(=O)C(=O)CC(=O)\C=C\c1cccn1Cc1cccc(c1)C#N
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]-[#6]-1=[#6]-[#6]-c2ccc(-[#8])c(-[#8])c2-[#6]-1 |t:6|
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]-1-[#6](-[#6])=[#6]-[#6]-c2c(-[#8])ccc(-[#8])c-12 |c:7|
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]-1-[#6](-[#6])=[#6]-[#6]-c2c(-[#8])c(-[#8])ccc-12 |c:7|
OP(O)(=O)C(Cc1ccc(Cl)c(Cl)c1)P(O)(O)=O
OC(Cc1ccc(Cl)c(Cl)c1)(P(O)(O)=O)P(O)(O)=O
NC(Cc1ccc(Cl)c(Cl)c1)(P(O)(O)=O)P(O)(O)=O
OC(Cc1ccc(Cl)cc1)(P(O)(O)=O)P(O)(O)=O
OP(O)(=O)C(Cc1ccc(Cl)c(Cl)c1)(Cc1ccc(Cl)c(Cl)c1)P(O)(O)=O
COC(=O)[C@H](COC(=O)\C=C\c1ccc(OC(C)=O)c(OC(C)=O)c1)NC(=O)\C=C\c1ccc(OC(C)=O)c(OC(C)=O)c1
Oc1c(C(c2ccc(cc2)C(=O)c2ccccc2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
O=C(CN1CCCC1)Nc1ccc(Cc2ccc(NC(=O)CN3CCCC3)cc2)cc1
COc1cccc2cc(C(=O)NCc3ccc(F)cc3F)c(=O)n(O)c12
On1c2ncccc2cc(C(=O)NCc2ccc(F)c(F)c2)c1=O
Oc1c(C(=O)NCc2ccc(F)cc2F)c(=O)[nH]c2ncccc12
Oc1c(C(=O)NCc2ccc(F)c(F)c2)c(=O)n(O)c2ncccc12
Oc1c(C(=O)NCc2ccc(F)c(F)c2)c(=O)[nH]c2ncccc12
On1c2ncccc2cc(C(=O)NCc2ccc(F)cc2F)c1=O
Oc1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12
Oc1c(C(=O)NCc2ccc(F)c(Cl)c2)c(=O)n(O)c2ncccc12
Oc1cccc2cc(C(=O)NCc3ccc(F)cc3F)c(=O)n(O)c12
Oc1cccc2cc(C(=O)NCc3ccc(F)c(F)c3)c(=O)n(O)c12
On1c2ccccc2cc(C(=O)NCc2ccc(F)cc2F)c1=O
Oc1c(C(=O)NCc2ccc(F)c(Cl)c2)c(=O)[nH]c2ncccc12
Oc1cccc2cc(C(=O)NCc3ccc(F)c(Cl)c3)c(=O)n(O)c12
On1c2ncccc2cc(C(=O)NCc2ccc(F)c(Cl)c2)c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)c(Cl)c2)c2c(Cl)cccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc2c1=O
CC(=O)N1CCN(CC1)c1ccc2c(c1)n(Cc1ccc(F)cc1)cc(C(=O)\C=C(/O)C(O)=O)c2=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(F)ccc2F)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc3ccccc3n2)c2ccccc2c1=O
COc1ccc(Cn2cc(C(=O)\C=C(/O)C(O)=O)c(=O)c3ccccc23)cc1
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccccc2F)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc3ccccc3c2)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(Cl)c2F)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccccc2)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(C)cc(C)c2)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(C)cc2C)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(Cl)cc2Cl)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)c(F)c2)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(F)ccc2F)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(cc2)[N+]([O-])=O)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(OC)cc2)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(O)cc2)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccccc2)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccncc2)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccncc2)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(CCCCc2ccccc2)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccccc2F)c2c(Cl)cccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)c(Cl)c2)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(cc2)[N+]([O-])=O)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(O)cc2)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccccc2F)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cccc(Cl)c2F)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2F)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)c(F)c2)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(F)cc(F)c2)c2ccccc2c1=O
Cc1ccc(Cn2cc(C(=O)\C=C(/O)C(O)=O)c(=O)c3ccccc23)c(C)c1
Cc1cc(C)cc(Cn2cc(C(=O)\C=C(/O)C(O)=O)c(=O)c3ccccc23)c1
OC(=O)C(\O)=C\C(=O)c1cn(CCCCc2ccccc2)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2cc(F)cc(F)c2)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2F)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)c(Cl)c2)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(Cl)cc2Cl)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)c(Cl)c2)c2c(Cl)cccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc3ccccc3n2)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2c(Cl)cccc2Cl)c2ccccc2c1=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2c(Cl)cccc2Cl)c2ccccc2c1=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc3ccccc3c2)c2ccccc2c1=O
CCCCn1cc(C(O)=O)c(=O)c2ccc(Oc3ccnc(Nc4ccc(cc4)C#N)n3)cc12
COc1ccc2nc(\C=C3/SC(=S)N(C(C(C)C)C(O)=O)C3=O)ccc2c1
COc1ccc(\C=C2/SC(=S)N(C(C(C)C)C(O)=O)C2=O)cc1
CCC(N1C(=S)S\C(=C/c2ccc(OC)cc2)C1=O)C(O)=O
CC(C)C(N1C(=S)S\C(=C/c2ccc(O)cc2)C1=O)C(O)=O
CC(C)C(N1C(=S)S\C(=C/c2cccc3ccccc23)C1=O)C(O)=O
COc1ccc(\C=C2/SC(=S)N(CCC(O)=O)C2=O)cc1
CCOc1cc(\C=C2/SC(=S)N(C(C(C)C)C(O)=O)C2=O)ccc1O
CCC[C@H](C(O)=O)c1c(C)nc2ccc(Cl)cc2c1-c1ccccc1 |r|
Cc1c(c(c2cc(ccc2n1)Br)c3ccc(cc3)Cl)[C@@H](C(=O)O)OC(C)(C)C
Fc1ccc(Nc2ccc(F)c3ccccc23)cc1
OC(=O)c1ccc(Nc2ccc(O)c3ccccc23)cc1
OC(=O)c1cc(Nc2ccc(O)c3ccccc23)ccc1O
COc1ccc(I)cc1Nc1ccc(OC)c2ccccc12
OC(=O)c1ccc(Nc2ccc3ccccc3c2O)cc1
COc1ccc2ccccc2c1Nc1c(OC)ccc2ccccc12
CCOC(=O)c1cn(Cc2ccc(cc2)C(=O)OC)c2ccccc2c1=O
COC(=O)c1ccc(Nc2ccc(OC)c3ccccc23)cc1
Cc1cc2c(-c3ccc(C)cc3)c(ccc2s1)C(OC(C)(C)C)C(O)=O
CCOC(=O)c1c(CC)nc(SCc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)nc1-c1ccc(F)cc1
CCOC(=O)c1c(CC)nc(SCc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)nc1-c1ccc(OC)cc1
CCOC(=O)c1c(nc(SCc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)nc1-c1ccc(F)cc1)-c1ccccc1
CCOC(=O)c1c(nc(SCc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)nc1-c1ccc(OC)cc1)-c1ccccc1
CCOC(=O)c1c(nc(=O)n(Cc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c1-c1ccccc1)-c1ccc(OC)cc1
CCOC(=O)c1c(nc(=O)n(Cc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c1-c1ccccc1)-c1ccccc1
CCOC(=O)c1c(nc(=O)n(Cc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c1C(C)C)-c1ccc(F)cc1
CCOC(=O)c1c(nc(=O)n(Cc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c1C(C)C)-c1ccccc1
CCOC(=O)c1c(CC)n(Cc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c(=O)nc1-c1ccccc1
CCOC(=O)c1c(C)n(Cc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c(=O)nc1Cc1ccccc1
CCOC(=O)c1c(C)n(Cc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c(=O)nc1-c1ccc(F)cc1
CCOC(=O)c1c(CC)nc(SCc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)nc1-c1ccccc1
CCOC(=O)c1c(CC)n(Cc2ccc(Cc3cccc(c3)C(=O)\C=C(/O)C(O)=O)cc2)c(=O)nc1-c1ccccc1
CCOC(=O)c1c(nc(=O)n(Cc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c1-c1ccccc1)-c1ccc(F)cc1
CCOC(=O)c1c(nc(=O)n(Cc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c1C(C)C)-c1ccc(OC)cc1
CCOC(=O)c1c(C)n(Cc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c(=O)nc1-c1ccccc1
CCOC(=O)c1c(nc(=O)n(Cc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c1-c1ccccc1)-c1cc(C)cc(C)c1
CCOC(=O)c1c(CC)n(Cc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c(=O)nc1-c1ccc(OC)cc1
CCOC(=O)c1c(nc(SCc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)nc1-c1ccccc1)-c1ccccc1
CCOC(=O)c1c(CC)n(Cc2ccc(cc2)C(=O)\C=C(/O)C(O)=O)c(=O)nc1-c1ccc(F)cc1
COc1ccc(cc1)C1=Cc2ccc(cc2C(CC(C)=O)N1c1ccc(C)cc1)[N+]([O-])=O |t:9|
COc1ccc(cc1)C1=Cc2ccc(F)cc2C(CC(=O)C(C)O)N1c1ccc(Cl)cc1 |t:9|
COc1ccc(cc1)C1=Cc2ccc(F)cc2C(CC(=O)C(C)O)N1c1ccc(cc1)[N+]([O-])=O |t:9|
COc1ccc(cc1)C1=Cc2ccc(F)cc2C(C[N+]([O-])=O)N1c1ccc(Cl)cc1 |t:9|
COc1ccc(cc1)C1=Cc2ccc(F)cc2C(CC(C)=O)N1c1ccc(O)cc1 |t:9|
COc1ccc(cc1)C1=Cc2ccc(F)cc2C(CC(C)=O)N1c1ccc(cc1)C#N |t:9|
COc1ccc(cc1)C1=Cc2ccc(F)cc2C(CC(=O)CO)N1c1ccc(C)cc1 |t:9|
COc1ccc(cc1)C1=Cc2ccc(F)cc2C(CC(=O)CO)N1c1ccc(cc1)[N+]([O-])=O |t:9|
COc1ccc(cc1)C1=Cc2ccc(F)cc2C(CC(=O)C(C)O)N1c1ccc(C)cc1 |t:9|
COc1ccc(cc1)C1=Cc2ccc(F)cc2C(CC(=O)C(C)O)N1c1ccc(O)cc1 |t:9|
[O-][N+](=O)CC1N(C(=Cc2ccc(cc12)[N+]([O-])=O)c1ccccc1)c1ccc(Cl)cc1 |c:6|
COc1ccc(cc1)C1=Cc2ccc(cc2C(CC(C)=O)N1c1ccc(F)cc1)[N+]([O-])=O |t:9|
COc1ccc(cc1)C1=Cc2ccc(cc2C(CC(C)=O)N1c1ccc(O)cc1)[N+]([O-])=O |t:9|
COc1ccc(cc1)C1=Cc2ccc(F)cc2C(CC(=O)CO)N1c1ccc(cc1)C#N |t:9|
COc1ccc(cc1)C1=Cc2ccc(cc2C(CC(C)=O)N1c1ccc(cc1)C#N)[N+]([O-])=O |t:9|
COc1ccc(cc1)C1=Cc2ccc(F)cc2C(CC(=O)CO)N1c1ccc(Cl)cc1 |t:9|
COc1ccc(cc1)C1=Cc2ccc(F)cc2C(CC(=O)C(C)O)N1c1ccc(cc1)C#N |t:9|
COc1ccc(cc1)C1=Cc2ccc(F)cc2C(CC(=O)C(C)O)N1c1ccc(F)cc1 |t:9|
COc1ccc(cc1)C1=Cc2ccc(F)cc2C(CC(=O)CO)N1c1ccc(O)cc1 |t:9|
Oc1ccc(C[C@H]2COC(=O)[C@@H]2Cc2ccc(O)c(O)c2)cc1O
CCC[C@@H](C(O)=O)c1c(C)nc2ccc(Cl)cc2c1-c1ccccc1 |r|
Oc1c(C(c2ccc(cc2)[N+]([O-])=O)c2c([O-])c3ccccc3oc2=[OH+])c(=O)oc2ccccc12
Oc1c(C(c2ccc3ccccc3c2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
Oc1c(Cc2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
c1ccc2c(c1)C(=CC(=O)O2)O
Oc1ccc2c(O)cc(=O)oc2c1
Oc1ccc2c(O)c(C(c3ccc(\C=C\c4ccccc4)cc3)c3c(O)c4ccc(O)cc4oc3=O)c(=O)oc2c1
CC5C(C)(C(c2c(O)c1ccc(O)cc1oc2=O)c4c(O)c3ccc(O)cc3oc4=O)C[Fe]5678%10C9C6C7C8C9%10
Oc1c(C(c2ccc(cc2)C(c2c(O)c3ccccc3oc2=O)c2c(O)c3ccccc3oc2=O)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
Oc1c(C(c2cc(OCc3ccccc3)cc(OCc3ccccc3)c2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
Oc1c(Cc2ccccc2Cc2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
Oc1c(Cc2cccc(Cc3c(O)c4ccccc4oc3=O)c2)c(=O)oc2ccccc12
Oc1ccc2c(O)c(C(c3ccc4ccccc4c3)c3c(O)c4ccc(O)cc4oc3=O)c(=O)oc2c1
Oc1c(C(c2cnc3ccccc3c2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
OCCOC(=O)CCCCC(=O)c1ccc(O)cc1O
Oc1ccc(C=NNC(=O)NN=Cc2ccc(O)cc2O)c(O)c1 |w:5.4,12.12|
COc1cc(N)ccc1C(=O)NC(CCC(O)=O)C(O)=O
C[C@@H]1C(Oc2cc(O)c(C3OC(CO)C(O)C(O)C3O)c(O)c2C1=O)c1ccc(O)c(O)c1
OCNC(=O)NCOCn1c(=O)n(CO)c(=O)n(CO)c1=O
COc1cc2oc(cc(=O)c2c(O)c1C1OC(CO)C(O)C(O)C1O)-c1ccc(O)cc1
CCC\C=C\C=C\[C@@H]1C[C@@H](O)[C@@H](O)C(=O)[C@H]1CO
Oc1ccccc1C(=O)NC(=O)CC(O)(c1ccccc1)c1ccc(Cl)cc1
OC(CNNC(=O)c1ccccc1O)COc1ccccc1
ONC(=O)C(NO)=CC(=O)c1ccc(O)cc1O |w:7.7|
OC1C(C(C2C(O)c3ccccc3OC2=O)c2ccccc2)C(=O)Oc2ccccc12
Nc1ccccc1C(=O)NNC(=O)c1ccccc1N
O=C(NNC(=O)c1ccccc1)c1ccccc1
c1ccc(c(c1)C(=O)N)O
Oc1ccccc1C(=O)NNC(=O)c1ccccc1S
Oc1ccccc1\C=N\NC(=O)c1ccccc1O
Oc1ccccc1C(=O)NNC(=O)c1ccccc1
Oc1ccccc1C(=O)NCCCNC(=O)c1ccccc1O
CC(=O)NNC(=O)c1ccccc1O
Oc1ccccc1C(=O)NNC(=O)c1cc2ccccc2cc1O
Nc1ccccc1C(=O)NNC(=O)c1ccccc1O
NNC(=O)c1ccccc1N
Oc1ccccc1CNNC(=O)c1ccccc1O
O=C(NNC(=O)c1ccccn1)c1ccccn1
NN(CC(O)COc1ccccc1)C(=O)c1ccccc1O
NNC(=O)c1ccccc1S
NNC(=O)c1ccccc1O
COc1ccc2cc(ccc2c1)C(=O)NCCCNC(=O)c1ccc2cc(OC)ccc2c1
Oc1ccc2cc(ccc2c1)C(=O)NCCCNC(=O)c1ccc2cc(O)ccc2c1
COC(=O)c1ccc2cc(O)c(O)cc2c1
OC(=O)c1ccc2cc(O)ccc2c1
Oc1ccc2cc(ccc2c1O)C(=O)NCCCNC(=O)c1ccc2c(O)c(O)ccc2c1
COc1cc2ccc(cc2cc1OC)C(=O)NCCCNC(=O)c1ccc2cc(OC)c(OC)cc2c1
Oc1ccc(CCNC(=O)CCc2ccc(O)cc2)cc1
Oc1ccc(CCNC(=O)CCc2cccc(O)c2)cc1
OC(=O)c1ccc2c(O)c(O)ccc2c1
Oc1ccc(CCC(=O)NCCCNC(=O)CCc2ccc(O)cc2)cc1
COC(=O)c1ccc2cc(O)ccc2c1
COc1ccc2cc(ccc2c1OC)C(=O)NCCCNC(=O)c1ccc2c(OC)c(OC)ccc2c1
Oc1cc2ccc(cc2cc1O)C(=O)NCCCNC(=O)c1ccc2cc(O)c(O)cc2c1
Oc1cccc(CCC(=O)NCCCNC(=O)CCc2cccc(O)c2)c1
Oc1cc(O)cc(CCC(=O)NCCCNC(=O)CCc2cc(O)cc(O)c2)c1
OC(=O)c1ccc2cc(O)c(O)cc2c1
Oc1cc(O)cc(CCC(=O)NCCc2ccc(O)c(O)c2)c1
Oc1cccc(CCNC(=O)CCc2cccc(O)c2)c1
Oc1cc(O)cc(CCNC(=O)CCc2cc(O)cc(O)c2)c1
Oc1ccc(CCC(=O)NCCc2cccc(O)c2)cc1
Oc1cc(O)cc(CCNC(=O)CCc2ccc(O)c(O)c2)c1
CC(C)(C)OC(C(O)=O)c1c(nc(-c2cnn(Cc3ccccc3)c2)c2ccccc12)-c1ccc2OCCCc2c1
COc1cccc(c1)-c1nc(-c2ccccc2)c(C(OC(C)(C)C)C(O)=O)c2ccccc12
CC(C)(C)OC(C(O)=O)c1c(nc(-c2ccc3OCCCc3c2)c2ccccc12)-c1ccc2OCCCc2c1
CC(C)(C)OC(C(O)=O)c1c(nc(-c2ccc(cc2)-c2ccccc2)c2ccccc12)-c1ccc2OCCCc2c1
CC(C)(C)OC(C(O)=O)c1c(nc(-c2ccc(cc2)C(F)(F)F)c2ccccc12)-c1ccc2OCCCc2c1
CC(C)(C)OC(C(O)=O)c1c(nc(-c2cccc(F)c2)c2ccccc12)-c1ccc2OCCCc2c1
COc1cccc(c1)-c1nc(-c2ccc3OCCCc3c2)c(C(OC(C)(C)C)C(O)=O)c2ccccc12
CC(C)(C)OC(C(O)=O)c1c(nc(-c2ccccc2)c2ccccc12)-c1ccccc1
CC(C)(C)OC(C(O)=O)c1c(nc(-c2nc3cc(Cl)ccc3[nH]2)c2ccccc12)-c1ccc2OCCCc2c1
CC(C)(C)OC(C(O)=O)c1c(nc(-c2cccc(c2)C(O)=O)c2ccccc12)-c1ccc2OCCCc2c1
COc1ccc(cc1)-c1nc(-c2ccc3OCCCc3c2)c(C(OC(C)(C)C)C(O)=O)c2ccccc12
CC(C)(C)OC(C(O)=O)c1c(nc(-c2ccccc2)c2ccccc12)-c1ccc2OCCCc2c1
CC(C)(C)OC(C(O)=O)c1c(nc(-c2ccco2)c2ccccc12)-c1ccc2OCCCc2c1
OC(=O)c1ccc2ccc(\C=C\c3cc(O)c(O)c(O)c3)nc2c1O
Oc1cc(\C=C\c2ccc3ccc(C([O-])=O)c(O)c3n2)cc(O)c1O
Oc1ccc(\C=C\c2ccc3ccc(C([O-])=O)c(O)c3n2)cc1O
Brc1ccccc1C(=O)NNC(=O)c1ccccc1Br
Oc1cccc(C=c2c(=C)[nH]n(C(=O)c3ccc(Cl)cc3)c2=O)c1 |w:6.5|
Oc1ccc(C=c2c(=C)[nH]n(C(=O)c3ccccc3O)c2=O)cc1 |w:5.4|
Fc1ccccc1C(=O)NNC(=O)c1ccccc1F
CCOc1ccccc1C(=O)NNC(=O)c1ccccc1OCC
Oc1ccccc1C=c1c(=C)[nH]n(C(=O)c2ccc(Cl)cc2)c1=O |w:7.7|
Oc1ccc(C=c2c(=C)[nH]n(C(=O)c3ccc(Cl)cc3)c2=O)cc1 |w:5.4|
Clc1ccc(cc1Cl)C(=O)NNC(=O)c1ccccc1
Brc1ccc(cc1)C(=O)NNC(=O)c1ccc(Br)cc1
COc1ccc(C=c2c(=C)[nH]n(C(=O)c3ccccc3O)c2=O)cc1OC |w:6.5|
Fc1ccccc1C(=O)NNC(=O)c1ccc2ccccc2c1
Oc1ccccc1C(=O)NN1C(C(Cl)C1=O)c1ccccc1Cl
COc1cc(cc(OC)c1OC)C(=O)NNC(=O)c1ccc(Cl)cc1
Cc1nn(C(=O)c2ccccc2O)c([O-])c1[CH+]c1cccc(c1)[N+]([O-])=O
Cc1nn(C(=O)c2ccc(Cl)cc2)c([O-])c1[CH+]c1cccc(c1)[N+]([O-])=O
COc1ccc(C=c2c(=C)[nH]n(C(=O)c3ccccc3O)c2=O)cc1 |w:6.5|
COc1cc(C=c2c(=C)[nH]n(C(=O)c3ccc(Cl)cc3)c2=O)cc(OC)c1OC |w:5.4|
Oc1ccccc1C(=O)NN1C(C(Cl)C1=O)c1c(O)ccc2ccccc12
Oc1ccccc1C(=O)NN1C(C(Cl)C1=O)c1cccc(Cl)c1
Oc1ccccc1C(=O)NN1C(C(Cl)C1=O)c1ccc(cc1)[N+]([O-])=O
Clc1ccc(cc1Cl)C(=O)NNC(=O)c1ccc2ccccc2c1
Clc1ccc(cc1Cl)C(=O)NNC(=O)c1ccc(Cl)c(Cl)c1
Clc1ccc(C(=O)NNC(=O)c2ccc3ccccc3c2)c(Cl)c1
COc1ccc(C=c2c(=C)[nH]n(C(=O)c3ccc(Cl)cc3)c2=O)cc1OC |w:6.5|
Oc1ccccc1C(=O)n1[nH]c(=C)c(=Cc2ccco2)c1=O |w:14.15|
COc1cc(C=c2c(=C)[nH]n(C(=O)c3ccccc3O)c2=O)cc(OC)c1OC |w:5.4|
Cc1nn(C(=O)c2ccccc2O)c([O-])c1[CH+]c1ccc(cc1)[N+]([O-])=O
Oc1ccccc1C1C(Cl)C(=O)N1NC(=O)c1ccccc1O
Clc1ccc(C=c2c(=C)[nH]n(C(=O)c3ccc(Cl)cc3)c2=O)cc1 |w:5.4|
COc1cc(cc(OC)c1OC)C1C(Cl)C(=O)N1NC(=O)c1ccccc1O
COc1ccc(cc1OC)C1C(Cl)C(=O)N1NC(=O)c1ccccc1O
OC(=O)c1ccccc1C(=O)NNC(=O)c1ccccc1C(O)=O
COc1ccc(cc1)C1C(Cl)C(=O)N1NC(=O)c1ccccc1O
Oc1ccc(cc1)C1C(Cl)C(=O)N1NC(=O)c1ccccc1O
COc1cc(cc(OC)c1OC)C(=O)NNC(=O)c1ccc(Cl)c(Cl)c1
Oc1ccccc1C=c1c(=C)[nH]n(C(=O)c2ccccc2O)c1=O |w:7.7|
Oc1cccc(c1)C1C(Cl)C(=O)N1NC(=O)c1ccccc1O
COc1cc(C=c2c(=C)[nH]n(C(=O)c3ccccc3O)c2=O)ccc1O |w:5.4|
COc1cc(ccc1O)C1C(Cl)C(=O)N1NC(=O)c1ccccc1O
Fc1ccccc1C(=O)NNC(=O)c1cccc2ccccc12
Oc1cccc(C=c2c(=C)[nH]n(C(=O)c3ccccc3O)c2=O)c1 |w:6.5|
Clc1ccc(cc1Cl)C(=O)NNC(=O)c1cccc2ccccc12
Brc1ccccc1C(=O)NNC(=O)c1cccc2ccccc12
CC(C)Oc1ccc2cccnc2c1-c1cccc2cccnc12 |(37.78,-7.67,;36.45,-8.45,;36.46,-9.99,;35.11,-7.68,;33.78,-8.46,;33.79,-10.01,;32.45,-10.78,;31.11,-10.01,;29.78,-10.78,;28.45,-10.01,;28.45,-8.46,;29.79,-7.69,;31.12,-8.47,;32.45,-7.69,;32.44,-6.15,;33.77,-5.38,;33.76,-3.84,;32.43,-3.08,;31.09,-3.87,;29.76,-3.12,;28.44,-3.89,;28.46,-5.43,;29.79,-6.18,;31.1,-5.4,)|
CC(C)Oc1ccc2cccnc2c1-c1cccc2ccccc12 |(11.63,-5.99,;10.3,-5.22,;10.3,-3.68,;8.96,-5.99,;7.63,-5.22,;7.62,-3.68,;6.28,-2.91,;4.95,-3.7,;3.62,-2.95,;2.3,-3.73,;2.32,-5.27,;3.65,-6.01,;4.96,-5.24,;6.3,-5.99,;6.3,-7.53,;7.64,-8.29,;7.64,-9.84,;6.31,-10.62,;4.97,-9.84,;3.64,-10.61,;2.31,-9.85,;2.31,-8.3,;3.64,-7.53,;4.97,-8.3,)|
CC(=O)c1c(O)c2c(oc1=O)c1cccc(C)c1oc2=O
Cc1ccc2oc(=O)c3c(O)cc(=O)oc3c2c1
Cc1cccc2c1oc(=O)c1c(O)cc(=O)oc21
Oc1cc(=O)oc2c3ccc4ccccc4c3oc(=O)c12
CC(=O)c1c(O)c2c(oc1=O)c1ccccc1oc2=O
CC(=O)CC(=O)c1c(O)c2c(oc1=O)c1ccccc1oc2=O
CC(=O)CC(=O)c1c(O)c2c(oc1=O)c1c(ccc3ccccc13)oc2=O
CC(=O)CC(=O)c1c(O)c2c(oc1=O)c1ccc3ccccc3c1oc2=O
Cc1cc(nn1-c1ccccc1)-c1c(O)c2c(oc1=O)c1ccccc1oc2=O
Cc1cc(=O)c2c(o1)c1c(oc2=O)c2ccccc2oc1=O
Cc1ccc2oc(=O)c3cc(C4=Nc5ccc(cc5N=CC4)C(=O)c4ccccc4)c(=O)oc3c2c1 |c:20,t:11|
CC(=O)c1c(O)c2c(oc1=O)c1cc(C)ccc1oc2=O
Cc1ccc2c(c1)oc(=O)c1c(O)cc(=O)oc21
Oc1cc(=O)oc2c3c(ccc4ccccc34)oc(=O)c12
CC(=O)c1c(O)c2c(oc1=O)c1ccc(C)cc1oc2=O
Oc1c(C2=Nc3ccc(cc3N=CC2)C(=O)c2ccccc2)c(=O)oc2c3ccccc3oc(=O)c12 |c:12,t:3|
Nc1ncnc2c3n(cnc3ccc12)C1COC(COP([O-])([O-])=O)C1
Nc1ncnc2cc3n(cnc3cc12)C1CCC(COP([O-])([O-])=O)O1
Nc1ncnc2cc3n(cnc3cc12)C1COC(COP([O-])([O-])=O)C1
CC(=O)Oc1ccc(\C=C\C(=O)O[C@H]([C@@H](OC(=O)\C=C\c2ccc(OC(C)=O)c(OC(C)=O)c2)C(O)=O)C(O)=O)cc1OC(C)=O
CC(=O)Oc1ccc(\C=C\C(=O)OCCCOC(=O)\C=C\c2ccc(OC(C)=O)c(OC(C)=O)c2)cc1OC(C)=O
Oc1ccc(\C=C\C(=O)OCCCOC(=O)\C=C\c2ccc(O)c(O)c2)cc1O
CC(=O)Oc1ccc(\C=C\C(=O)NCC(NC(=O)\C=C\c2ccc(OC(C)=O)c(OC(C)=O)c2)C(O)=O)cc1OC(C)=O
C[C@H](OC(=O)\C=C\c1ccc(OC(C)=O)c(OC(C)=O)c1)[C@H](C)OC(=O)\C=C\c1ccc(OC(C)=O)c(OC(C)=O)c1
OC(=O)C(COC(=O)\C=C\c1ccc(O)c(O)c1)NC(=O)\C=C\c1ccc(O)c(O)c1
OC(=O)C(COC(=O)\C=C\c1ccc(O)c(O)c1)OC(=O)\C=C\c1ccc(O)c(O)c1
C[C@H](OC(=O)\C=C\c1ccc(O)c(O)c1)[C@H](C)OC(=O)\C=C\c1ccc(O)c(O)c1
COC(=O)[C@@H](CNC(=O)\C=C\c1ccc(OC)c(OC)c1)NC(=O)\C=C\c1ccc(OC)c(OC)c1 |r|
Oc1ccc(\C=C\C(=O)O[C@H]2CCCC[C@@H]2OC(=O)\C=C\c2ccc(O)c(O)c2)cc1O
COC(=O)C(COC(=O)\C=C\c1ccc(OC(C)=O)c(OC(C)=O)c1)NC(=O)\C=C\c1ccc(OC(C)=O)c(OC(C)=O)c1
COC(=O)C(COC(=O)\C=C\c1ccc(OC(C)=O)c(OC(C)=O)c1)OC(=O)\C=C\c1ccc(OC(C)=O)c(OC(C)=O)c1
Oc1ccc(\C=C\C(=O)NCCOC(=O)\C=C\c2ccc(O)c(O)c2)cc1O
CC(=O)Oc1ccc(\C=C\C(=O)OCC(OC(=O)\C=C\c2ccc(OC(C)=O)c(OC(C)=O)c2)C(O)=O)cc1OC(C)=O
CC(=O)Oc1ccc(\C=C\C(=O)O[C@@H]([C@H](OC(=O)\C=C\c2ccc(OC(C)=O)c(OC(C)=O)c2)C(O)=O)C(O)=O)cc1OC(C)=O
CC(=O)NC(COC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
CC(=O)Oc1ccc(\C=C\C(=O)O[C@H]2CCCC[C@@H]2OC(=O)\C=C\c2ccc(OC(C)=O)c(OC(C)=O)c2)cc1OC(C)=O
CC(=O)Oc1ccc(\C=C\C(=O)NCCOC(=O)\C=C\c2ccc(OC(C)=O)c(OC(C)=O)c2)cc1OC(C)=O
COc1ccc(\C=C\C(=O)NC[C@@H](NC(=O)\C=C\c2ccc(OC)c(OC)c2)C(O)=O)cc1OC |r|
COC(=O)C(COC(=O)\C=C\c1ccc(OC(C)=O)c(OC(C)=O)c1)NC(C)=O
Oc1ccc(\C=C\C(=O)OCCOC(=O)\C=C\c2ccc(O)c(O)c2)cc1O
COC(=O)[C@@H](CNC(=O)\C=C\c1ccc(OC(C)=O)c(OC(C)=O)c1)NC(=O)\C=C\c1ccc(OC(C)=O)c(OC(C)=O)c1 |r|
COC(=O)[C@@H](COC(=O)\C=C\c1ccc(OC(C)=O)c(OC(C)=O)c1)NC(=O)\C=C\c1ccc(OC(C)=O)c(OC(C)=O)c1
CC(=O)Oc1ccc(\C=C\C(=O)OCCOC(=O)\C=C\c2ccc(OC(C)=O)c(OC(C)=O)c2)cc1OC(C)=O
c1c(cc(c(c1F)CNC(=O)C2=CN3C[C@@H]4N([C@H]5CC[C@H](C5)O4)C(=O)C3=C(C2=O)O)F)F
On1c(=O)[nH]c2ccc(NS(=O)(=O)c3ccc4ccccc4c3)cc2c1=O
COc1ccc(cc1O)-c1c2-c3cc(OC)c(OC)cc3CCn2c2c1c1cc(OC)c(OS([O-])(=O)=O)cc1oc2=O
COc1ccc(cc1O)-c1c2-c3cc(OC)c(OC)c(OC)c3CC(O)n2c2c1c1cc(OC)c(OS([O-])(=O)=O)cc1oc2=O
COc1ccc(cc1O)-c1c2c(n3ccc4cc(O)c(OC)cc4c13)c(=O)oc1cc(O)c(OC)cc21
COc1ccc(cc1O)-c1c2-c3cc(OC)c(OC)c(OC)c3CCn2c2c1c1cc(OC)c(O)cc1oc2=O
COc1ccc(cc1O)-c1c2c(n3ccc4c(OC)c(OC)c(OC)cc4c13)c(=O)oc1cc(O)c(OC)cc21
Clc1ccc2SC(=O)C3CSCN3C(=O)c2c1
O=C1Sc2ccccc2C(=O)N2CSCC12
COc1ccc2SC(=O)C3CSCN3C(=O)c2c1
Cc1ccc2SC(=O)C3N(CCS3=O)C(=O)c2c1
Brc1ccc2SC(=O)C3SCCN3C(=O)c2c1
O=C1Sc2ccccc2C(=O)N2COCC12
O=C1N2C(CSC2c2ccccc2)CSc2ccccc12
COc1ccc2SC(=O)C3CS(=O)CN3C(=O)c2c1
O=C1Sc2ccccc2C(=O)N2CCCCC12
COc1cc2SC(=O)C3CCCN3C(=O)c2cc1OC
CN(C)Cc1ccc2C(Sc3ccccc3Cn12)c1ccc(F)cc1
Clc1ccc2SC(=O)C3CS(=O)CN3C(=O)c2c1
O=C1Sc2cc3ccccc3cc2C(=O)N2CSCC12
O=C1Sc2ccccc2C(=O)N2CS(=O)CC12
O=C1Sc2ccccc2C(=O)N2CCSC12
COC1Sc2ccccc2C(=O)N2CCCC12
[O-][N+](=O)c1ccc2c(SC(=O)C3CSCN3C2=O)c1
Cc1ccc2SC(=O)C3SCCN3C(=O)c2c1
Cc1ccc2SC(=O)C3CSCN3C(=O)c2c1
Clc1ccc2SC(=O)C3SCCN3C(=O)c2c1
Brc1ccc2SC(=O)C3CSCN3C(=O)c2c1
CN1CCN(Cc2ccc3C(Sc4ccccc4Cn23)c2ccccc2)CC1
O=C1Sc2cc3ccccc3cc2C(=O)N2CCSC12
COc1cc2SC(=O)C3CSCN3C(=O)c2cc1OC
OC1Sc2ccccc2C(=O)N2CCCC12
O=C1Sc2ccccc2Cn2cccc12
OC1(Sc2ccccc2C(=O)N2CCCC12)c1ccccc1
CCOC(=O)C1Sc2ccccc2Cn2cccc12
CN1CCN(CC1)C1Sc2ccccc2C(=O)N2CCCC12
CC(=O)OC1Sc2ccccc2C(=O)N2CCCC12
COc1cc2SCC3CCCN3C(=O)c2cc1OC
On1c(=O)cc([nH]c1=O)C(=O)c1ccc(cc1)-c1ccc(cc1)C(F)(F)F
On1c(=O)cc([nH]c1=O)C(=O)c1ccc(cc1)-c1ccc(Cl)c(F)c1
On1c(=O)cc([nH]c1=O)C(=O)c1ccc(cc1)C(F)(F)F
On1c(=O)cc([nH]c1=O)C(=O)c1ccc(F)cc1
Cc1cc(C)cc(c1)C(=O)c1cc(=O)n(O)c(=O)[nH]1
Cc1ccc(cc1)-c1ccc(cc1)C(=O)c1cc(=O)n(O)c(=O)[nH]1
On1c(=O)cc([nH]c1=O)C(=O)c1ccc(cc1)-c1ccc(F)cc1
On1c(=O)cc([nH]c1=O)C(=O)c1cccc(c1)-c1ccccc1
COc1ccc(cc1)-c1ccc(cc1)C(=O)c1cc(=O)n(O)c(=O)[nH]1
On1c(=O)cc([nH]c1=O)C(=O)c1ccc(cc1)-c1ccc(cc1)C#N
Cc1cc(ccc1F)-c1ccc(cc1)C(=O)c1cc(=O)n(O)c(=O)[nH]1
CCOCn1c(cc(=O)n(O)c1=O)C(=O)c1cccc(c1)-c1ccccc1
CCOCn1c(cc(=O)n(O)c1=O)C(C#N)c1ccc(cc1)-c1ccccc1
On1c(=O)cc([nH]c1=O)C(=O)c1ccc(cc1)-c1ccccc1
CCOCn1c(cc(=O)n(O)c1=O)C(=O)c1ccc(cc1)-c1ccccc1
Cc1cc(C)cc(c1)-c1ccc(cc1)C(=O)c1cc(=O)n(O)c(=O)[nH]1
Cc1ccc(cc1)C(=O)c1cc(=O)n(O)c(=O)[nH]1
COC(=O)c1ccc(cc1)C(=O)c1cc(=O)n(O)c(=O)[nH]1
COC(=O)c1ccc(cc1)-c1ccc(cc1)C(=O)c1cc(=O)n(O)c(=O)[nH]1
COc1ccc(cc1OC)-c1ccc(cc1)C(=O)c1cc(=O)n(O)c(=O)[nH]1
CCOCn1c(cc(=O)n(O)c1=O)C(C#N)c1cc(C)cc(C)c1
COc1cccc(c1)-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2cc(nn12)-c1ccccc1
Cc1nc2cc(nn2c(N2CCC(C)(C)CC2)c1C(OC(C)(C)C)C(O)=O)-c1ccccc1
Cc1nc2cc(nn2c(N2CCCCCC2)c1C(OC(C)(C)C)C(O)=O)-c1ccccc1
Cc1nc2cc(nn2c(C)c1C(OC(C)(C)C)C(O)=O)-c1ccccc1
Cc1ccc(cc1)-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2cc(nn12)-c1ccccc1
COc1ccc(cc1)-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2cc(nn12)-c1ccccc1
Cc1ccccc1-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2cc(nn12)-c1ccccc1 |(28.04,-23.64,;29.36,-22.86,;29.35,-21.33,;30.69,-20.54,;32.02,-21.31,;32.03,-22.85,;30.7,-23.62,;30.71,-25.15,;32.04,-25.92,;33.37,-25.14,;33.36,-23.6,;34.7,-22.83,;34.69,-21.29,;36.03,-23.59,;36.02,-22.04,;34.71,-25.91,;36.04,-25.13,;34.71,-27.45,;32.05,-27.47,;33.38,-28.23,;30.71,-28.24,;29.37,-27.47,;27.91,-27.94,;27,-26.69,;27.91,-25.46,;29.38,-25.93,;25.46,-26.7,;24.7,-25.36,;23.16,-25.36,;22.38,-26.69,;23.16,-28.03,;24.7,-28.03,)|
COc1ccccc1-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2cc(nn12)-c1ccccc1 |(44.98,-21.36,;46.31,-22.12,;47.63,-21.34,;47.62,-19.8,;48.95,-19.02,;50.29,-19.78,;50.3,-21.32,;48.97,-22.1,;48.98,-23.63,;50.31,-24.39,;51.64,-23.61,;51.63,-22.07,;52.96,-21.3,;52.96,-19.76,;54.3,-22.06,;54.29,-20.51,;52.98,-24.38,;54.31,-23.6,;52.98,-25.92,;50.32,-25.94,;51.65,-26.71,;48.98,-26.71,;47.64,-25.95,;46.18,-26.42,;45.27,-25.17,;46.18,-23.93,;47.65,-24.41,;43.73,-25.17,;42.97,-23.84,;41.43,-23.83,;40.65,-25.17,;41.43,-26.51,;42.97,-26.5,)|
Cc1nc2cc(nn2c(-c2cc(F)c3OCCCc3c2C)c1C(OC(C)(C)C)C(O)=O)-c1ccccc1 |(49.75,-47.2,;48.41,-46.44,;47.08,-47.21,;45.74,-46.44,;44.28,-46.91,;43.38,-45.66,;44.28,-44.43,;45.75,-44.9,;47.07,-44.12,;47.06,-42.59,;48.41,-41.82,;48.39,-40.28,;49.72,-39.5,;47.05,-39.52,;47.05,-37.98,;45.71,-37.21,;44.37,-37.99,;44.37,-39.54,;45.72,-40.3,;45.73,-41.83,;44.4,-42.61,;48.41,-44.89,;49.74,-44.11,;49.73,-42.57,;51.07,-41.8,;51.06,-40.26,;52.4,-42.56,;52.39,-41.01,;51.08,-44.88,;52.41,-44.1,;51.08,-46.42,;41.84,-45.67,;41.07,-44.33,;39.53,-44.33,;38.76,-45.66,;39.53,-47,;41.07,-47,)|
Cc1ccc(cc1)-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2ccnn12
Cc1nc2cc(nn2c(-c2cc(F)c3OCCCc3c2C)c1[C@H](OC(C)(C)C)C(O)=O)-c1ccccc1 |r,wD:22.26,(14.1,-46.79,;12.76,-46.03,;11.43,-46.8,;10.09,-46.03,;8.63,-46.5,;7.72,-45.25,;8.63,-44.02,;10.09,-44.49,;11.42,-43.71,;11.41,-42.18,;12.75,-41.41,;12.74,-39.87,;14.07,-39.09,;11.4,-39.11,;11.39,-37.57,;10.05,-36.8,;8.72,-37.58,;8.72,-39.13,;10.07,-39.89,;10.08,-41.42,;8.75,-42.2,;12.76,-44.48,;14.09,-43.7,;14.08,-42.16,;15.41,-41.39,;15.41,-39.85,;16.75,-42.15,;16.74,-40.6,;15.43,-44.47,;16.76,-43.69,;15.43,-46.01,;6.18,-45.26,;5.42,-43.92,;3.88,-43.92,;3.1,-45.25,;3.88,-46.59,;5.42,-46.59,)|
Cc1nc2cc(nn2c(-c2cc(F)c3OCCCc3c2C)c1[C@@H](OC(C)(C)C)C(O)=O)-c1ccccc1 |r,wU:22.26,(31.63,-47.08,;30.29,-46.31,;28.96,-47.08,;27.62,-46.31,;26.16,-46.79,;25.26,-45.54,;26.16,-44.3,;27.62,-44.77,;28.95,-44,;28.94,-42.47,;30.28,-41.69,;30.27,-40.15,;31.6,-39.37,;28.93,-39.4,;28.92,-37.86,;27.58,-37.08,;26.25,-37.87,;26.25,-39.42,;27.6,-40.17,;27.61,-41.71,;26.28,-42.49,;30.29,-44.76,;31.62,-43.99,;31.61,-42.45,;32.94,-41.67,;32.94,-40.13,;34.28,-42.44,;34.27,-40.89,;32.96,-44.75,;34.29,-43.98,;32.96,-46.29,;23.71,-45.55,;22.95,-44.21,;21.41,-44.21,;20.64,-45.54,;21.41,-46.88,;22.95,-46.88,)|
Cc1ccc(Nc2c(C(OC(C)(C)C)C(O)=O)c(C)nc3cc(nn23)-c2ccccc2)cc1
Cc1nc2cc(nn2c(-c2ccccc2)c1C(OC(C)(C)C)C(O)=O)-c1ccccc1
Cc1nc2cc(nn2c(-c2ccc3OCCCc3c2)c1C(OC(C)(C)C)C(O)=O)-c1ccccc1
CC(C)(C)OC(C(O)=O)c1ccccc1-c1ccccc1
Cc1cccc(c1)-c1c(C(OC(C)(C)C)C(O)=O)c(C)nc2cc(nn12)-c1ccccc1
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(O)=O)[C@@]2(C)C[C@@H](C(C)C(O)O)C(=O)C=C12 |t:30|
CCCCC(C)\C=C(/C)C(O)=O
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(O)=O)[C@@]2(C)CC([C@H](C)C=O)C(=O)C=C12 |t:29|
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(O)=O)[C@@]2(C)CC([C@@H](C)C=O)C(=O)C=C12 |t:29|
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(=O)OP(=O)(OCC)OCC)[C@@]2(C)CC(=C(C)C=O)C(=O)C=C12 |w:31.31,t:37|
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(O)=O)[C@@]2(C)CC(=C(C)C=C)C(=O)C=C12 |w:23.23,t:29|
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(=O)OC(NC2CCCCC2)=NC2CCCCC2)[C@@]2(C)CC(=C(C)C=O)C(=O)C=C12 |w:38.40,27.28,t:46|
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(=O)NCCNC(=O)[C@H]2CC[C@@H](OC(=O)C(\C)=C\C(C)CCCC)C3=CC(=O)C(C[C@]23C)=C(C)C=O)[C@@]2(C)CC(=C(C)C=O)C(=O)C=C12 |w:56.58,48.50,t:40,64|
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(O)=O)[C@@]2(C)CC(=C(C)C=O)C(=O)C=C12 |w:23.23,t:29|
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(O)=O)[C@@]2(C)C[C@H]3[C@@H](C)CO[C@]3(O)C[C@H]12
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(O)=O)[C@@]2(C)C[C@H]([C@H](O)C=C12)C(=C)CO |t:25|
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(=O)N[C@@H](CC(C)C)C(=O)OC)[C@@]2(C)CC(=C(C)C=O)C(=O)C=C12 |w:32.32,t:38|
CC1=C2C[C@]3(C)[C@H](CCC=C3C=C2OC1=O)C(O)=O |c:1,9,12|
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(=O)ON[C@@H](C(=O)OC)c2ccccc2)[C@@]2(C)CC(=C(C)C=O)C(=O)C=C12 |w:35.36,t:42|
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(=O)ON[C@H](C(=O)OC)c2ccccc2)[C@@]2(C)CC(=C(C)C=O)C(=O)C=C12 |w:35.36,t:42|
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(=O)N2CCN(CC2)C(=O)[C@H]2CC[C@@H](OC(=O)C(\C)=C\C(C)CCCC)C3=CC(=O)C(C[C@]23C)=C(C)C=O)[C@@]2(C)CC(=C(C)C=O)C(=O)C=C12 |w:58.61,50.53,t:43,67|
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(O)=O)[C@@]2(C)C[C@H]3[C@H](C)CO[C@]3(O)C[C@H]12
CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(O)=O)[C@@]2(C)CC3C(C)C(O)OC3(O)C=C12 |t:31|
OC(=O)c1ccc2ccc(CCc3ccc(O)c(O)c3)nc2c1O
COc1cc(\C=C\c2ccc3ccc(C(O)=O)c(O)c3n2)ccc1O
Cc1noc(C)c1-c1ccc(Nc2cc(=O)n(O)c(=O)n2C)cc1
COc1cccc(OC)c1-c1cccc(Nc2cc(=O)n(O)c(=O)[nH]2)c1
Cc1ccc(cc1)-c1ccc(Nc2cc(=O)n(O)c(=O)[nH]2)cc1
COc1ccc(cc1)-c1ccc(Nc2cc(=O)n(O)c(=O)n2C)cc1
Cn1c(Oc2ccc(cc2)-c2ccc(O)cc2)cc(=O)n(O)c1=O
COc1ccc(cc1)-c1ccccc1Oc1cc(=O)n(O)c(=O)n1C
Cc1ccc(cc1)-c1cccc(Nc2cc(=O)n(O)c(=O)[nH]2)c1
COc1cc(OC)cc(c1)-c1ccc(Nc2cc(=O)n(O)c(=O)[nH]2)cc1
COc1ccc(c(OC)c1)-c1cccc(Nc2cc(=O)n(O)c(=O)[nH]2)c1
Cn1c(Nc2cccc(c2)-c2ccccc2)cc(=O)n(O)c1=O
Cn1c(Oc2cccc(c2)-c2cccc(O)c2)cc(=O)n(O)c1=O
COc1ccc(cc1)-c1cccc(Nc2cc(=O)n(O)c(=O)[nH]2)c1
Cn1c(Nc2cccc(c2)-c2cccc(c2)C#N)cc(=O)n(O)c1=O
Cn1c(Nc2ccc(cc2)-c2cccc(c2)C#N)cc(=O)n(O)c1=O
On1c(=O)cc(Nc2cccc(c2)-c2ccc(F)cc2)[nH]c1=O
COc1cccc(c1)-c1cccc(Nc2cc(=O)n(O)c(=O)n2C)c1
CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(ccc4[nH]3)NS(=O)(=O)C
Cn1c(C(OC(C)(C)C)C([O-])=O)c(-c2ccc3OCCCc3c2)c2ccccc12
Cc1c(c(c2cc(ccc2n1)Br)c3ccc(cc3)Cl)[C@@H](C(=O)O)OC
Cn1c(CC(OC(C)(C)C)C(O)=O)c(-c2ccccc2)c2ccccc12
COc1ccc(cc1)-n1c(C(OC(C)(C)C)C(O)=O)c(C)c2ccccc12
Cn1c(C(OC(C)(C)C)C([O-])=O)c(-c2ccccc2)c2ccccc12
COc1ccc(cc1)-c1c(C(OC(C)(C)C)C([O-])=O)n(C)c2ccccc12
Cn1c(C(OC(C)(C)C)C([O-])=O)c(Cc2ccccc2)c2ccccc12
COc1ccc(cc1)-c1c(C(OC(C)(C)C)C([O-])=O)n(Cc2ccccc2)c2ccccc12
CNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1cccc(F)c1
Nc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1ccccc1
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1ccc(Cl)c(F)c1
On1c(=O)c(C(=O)NCc2ccc(F)cc2)c2NCCCn2c1=O
CNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1ccc(F)cc1
CNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1cccc(Cl)c1F
CCCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1ccccc1
CCCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1cccc(Cl)c1F
On1c(=O)[nH]c(NC2CC2)c(C(=O)NCc2ccccc2)c1=O
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1ccc(F)cc1F
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1cc(F)cc(F)c1
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1ccc(F)c(F)c1
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1cccc(Cl)c1F
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCCc1ccccc1
CCNc1[nH]c(=O)n(O)c(=O)c1C(N)=O
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)Oc1ccccc1
CCNc1c(C(=O)NCc2ccc(F)cc2)c(=O)n(O)c(=O)n1C
CNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1ccccc1
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1cc(F)ccc1F
Cn1c(O)c(C(=O)NCc2ccccc2)c(=O)n(O)c1=O
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1ccc(C)c(F)c1
On1c(=O)[nH]c(Nc2ccccc2)c(C(=O)NCc2ccccc2)c1=O
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1cccc(F)c1
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCCCl
On1c(=O)[nH]c(Nc2ccc(cc2)-c2ccccc2)c(C(=O)NCc2ccccc2)c1=O
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1ccccc1
CC(C)(C)Nc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1ccccc1
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1ccc(F)cc1
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1cc(F)ccc1Cl
CCNc1[nH]c(=O)n(O)c(=O)c1C(=O)Nc1ccccc1
CCNc1c(C(=O)N(C)Cc2ccc(F)cc2)c(=O)n(O)c(=O)n1C
CC(C)Nc1[nH]c(=O)n(O)c(=O)c1C(=O)NCc1ccccc1
CCCCn1cncc1-c1cccc(OC)c1
CCCCn1cncc1-c1ccc(cc1)C(C)(C)C
COc1cccc(c1)-c1cncn1C1CCCCC1
CC(C)(C)c1ccc(cc1)-c1cncn1C1CCCCC1
Fc1ccc(cc1)-c1cncn1-c1ccc(Br)cc1
COc1ccc(-c2cncn2-c2ccc(Br)cc2)c(OC)c1
Cc1nc(nn1Cc1ccc(F)cc1)-c1nc2n(CCOC2(C)C)c(=O)c1O
CC1(C)OCCn2c1nc(-c1nc(Cl)c(Cc3ccc(F)cc3)[nH]1)c(O)c2=O
Cn1cc(Cc2ccc(F)cc2)nc1-c1nc2n(CCOC2(C)C)c(=O)c1O
OC(=O)C(=O)CC(=O)c1cccc(Cc2cccc(F)c2)c1
OC(=O)C(=O)CC(=O)c1cccc(Cc2ccccc2Cl)c1
OC(=O)C(=O)CC(=O)c1cccn1Cc1ccccc1
OC(=O)C(=O)CC(=O)c1ccsc1Cc1ccccc1
OC(=O)C(=O)CC(=O)c1cccc(Cc2ccc(F)cc2)c1
OC(=O)C(=O)CC(=O)c1cccc(Cc2ccc(Cl)cc2)c1
OC(=O)C(=O)CC(=O)c1ccccc1Cc1ccccc1
OC(=O)C(=O)CC(=O)c1cccc(Cc2ccccc2F)c1
OC(=O)C(=O)CC(=O)c1cccc(Cc2cccc(Cl)c2)c1
OC(=O)C(=O)CC(=O)c1ccc(Cc2ccccc2)s1
COc1ccc(Cc2ccccc2)cc1C(=O)CC(=O)C(O)=O
CCOc1ccc(Cc2ccccc2)cc1C(=O)CC(=O)C(O)=O
COc1cc(Cc2ccccc2)cc(c1)C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1cccc(Cc2ccccc2)c1
OC(=O)C(=O)CC(=O)c1csc(Cc2ccccc2)c1
COc1ccc(cc1Cc1ccccc1)C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1ccn(Cc2ccccc2)c1
CC(C)Oc1ccc(Cc2ccccc2)cc1C(=O)CC(=O)C(O)=O
CCOC(=O)c1cc(n[nH]1)-c1cn(Cc2ccc(F)cc2)cc1-c1ccccc1
Nc1ccn([C@H]2C[C@H](OP(O)(=O)OC[C@H]3OC[C@H]([C@@H]3O)n3ccc(=O)[nH]c3=O)[C@@H](COP(O)(O)=O)O2)c(=O)n1 |r|
C\C(=N/NC(=O)C(O)C(O)C(=O)N\N=C(/C)c1c(O)c2ccccc2oc1=O)c1c(O)c2ccccc2oc1=O
CN(C)CCCNC(=O)c1ccc2nc([nH]c2c1)-c1ccc2nc(CNC(=O)CCCCN3CCN(CCCCC(=O)NCc4nc5ccc(cc5[nH]4)-c4nc5ccc(cc5[nH]4)C(=O)NCCCN(C)C)CC3)[nH]c2c1
CN(C)CCCNC(=O)c1ccc2nc([nH]c2c1)-c1ccc2nc(CNC(=O)CCN3CCN(CCC(=O)NCc4nc5ccc(cc5[nH]4)-c4nc5ccc(cc5[nH]4)C(=O)NCCCN(C)C)CC3)[nH]c2c1
CN(C)CCCNC(=O)c1ccc2nc([nH]c2c1)-c1ccc2nc(CNC(=O)CCCN3CCN(CCCC(=O)NCc4nc5ccc(cc5[nH]4)-c4nc5ccc(cc5[nH]4)C(=O)NCCCN(C)C)CC3)[nH]c2c1
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1ccc2nc(CNC(=O)CCCCN3CCN(CCCCC(=O)NCc4nc5ccc(cc5[nH]4)-c4nc5ccc(cc5[nH]4)N4CCN(C)CC4)CC3)[nH]c2c1
CN(C)CCCNC(=O)c1ccc2nc([nH]c2c1)-c1ccc2nc(CNC(=O)CN3CCN(CC(=O)NCc4nc5ccc(cc5[nH]4)-c4nc5ccc(cc5[nH]4)C(=O)NCCCN(C)C)CC3)[nH]c2c1
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1ccc2nc(CNC(=O)CN3CCN(CC(=O)NCc4nc5ccc(cc5[nH]4)-c4nc5ccc(cc5[nH]4)N4CCN(C)CC4)CC3)[nH]c2c1
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1ccc2nc(CNC(=O)CCN3CCN(CCC(=O)NCc4nc5ccc(cc5[nH]4)-c4nc5ccc(cc5[nH]4)N4CCN(C)CC4)CC3)[nH]c2c1
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1ccc2nc(CNC(=O)CCCN3CCN(CCCC(=O)NCc4nc5ccc(cc5[nH]4)-c4nc5ccc(cc5[nH]4)N4CCN(C)CC4)CC3)[nH]c2c1
Cc1ccc2cc(C)c(-c3ccc(O)c(O)c3)c(C)c2c1
Cc1cc2cc(O)c(O)cc2c(C)c1-c1ccccc1F |(14.38,-1.87,;13.05,-2.64,;11.72,-1.85,;10.39,-2.64,;9.04,-1.87,;7.71,-2.64,;6.38,-1.87,;7.71,-4.19,;6.38,-4.96,;9.04,-4.96,;10.37,-4.18,;11.72,-4.96,;11.7,-6.5,;13.05,-4.18,;14.38,-4.95,;14.36,-6.47,;15.68,-7.26,;17.02,-6.5,;17.02,-4.97,;15.71,-4.19,;15.73,-2.65,)|
Cc1cc2cc(O)c(O)cc2c(C)c1-c1ccc(cc1)C(F)(F)F
Cc1cc2cc(O)c(O)cc2c(C)c1-c1ccc(F)cc1
Cc1cc2cc(O)c(O)cc2c(C)c1-c1cccc(c1)C(F)(F)F
Cc1cc2cc(O)c(O)cc2c(C)c1-c1ccccc1
Cc1ccc(cc1)-c1c(C)cc2cc(O)c(O)cc2c1C
Cc1cc2cc(O)c(O)cc2c(C)c1-c1ccc(O)c(O)c1
Cc1cc2cc(O)c(O)cc2c(C)c1-c1ccccc1C(F)(F)F |(11.98,-5.06,;10.62,-5.84,;9.29,-5.07,;7.96,-5.84,;6.63,-5.07,;5.3,-5.84,;3.95,-5.06,;5.3,-7.38,;3.95,-8.15,;6.63,-8.15,;7.96,-7.38,;9.29,-8.15,;9.29,-9.69,;10.62,-7.38,;11.95,-8.15,;11.95,-9.71,;13.28,-10.48,;14.64,-9.71,;14.64,-8.15,;13.3,-7.38,;13.3,-5.84,;13.3,-4.3,;11.76,-5.84,;14.84,-5.84,)|
Oc1cc2CC3OC(Cc4cc(O)c(O)cc34)c2cc1O
Cc1cc2ccc(F)cc2c(C)c1-c1ccc(O)c(O)c1
Cc1cc2ccccc2c(C)c1-c1ccc(O)c(O)c1
Cc1cc2c(F)cccc2c(C)c1-c1ccc(O)c(O)c1
Sc1ccccc1C(=O)NNC(=O)c1ccccc1S
Sc1ccccc1C(=O)NNC(=O)c1ccccc1SSc1ccccc1C(=O)NNC(=O)c1ccccc1S
O=C1NNC(=O)c2ccccc2SSc2ccccc2C(=O)NNC(=O)c2ccccc2SSc2ccccc12
CN(C)C(=O)C(=O)NC12CCC(CC1)Cn1c2nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O |(8.88,-35.92,;8.94,-37.46,;7.64,-38.28,;10.3,-38.18,;10.37,-39.71,;11.61,-37.35,;11.54,-35.81,;12.97,-38.07,;14.27,-37.24,;15.33,-38.38,;16.87,-38.26,;17.75,-36.98,;16.12,-37.47,;15.67,-36.2,;17.28,-35.51,;15.84,-34.94,;14.5,-35.71,;13.18,-34.95,;13.18,-33.41,;11.84,-32.65,;11.83,-31.11,;10.51,-33.42,;9.17,-32.65,;7.84,-33.43,;6.51,-32.66,;5.18,-33.43,;5.18,-34.97,;3.85,-35.75,;6.52,-35.74,;7.85,-34.96,;14.5,-32.64,;14.5,-31.1,;15.83,-33.41,;17.17,-32.65,)|
CN(C)C(=O)C(=O)NC12CCC(CC1)Cn1c2nc(C(=O)NCc2ccc(F)c(C)c2)c(O)c1=O |(11.1,-26.94,;12.4,-26.12,;12.34,-24.58,;13.76,-26.83,;13.83,-28.37,;15.07,-26.01,;15,-24.47,;16.43,-26.72,;17.73,-25.9,;18.79,-27.04,;20.33,-26.91,;21.21,-25.64,;19.57,-26.13,;18.81,-24.8,;20.74,-24.16,;19.3,-23.6,;17.96,-24.37,;16.64,-23.61,;16.64,-22.07,;15.3,-21.31,;15.29,-19.77,;13.97,-22.08,;12.63,-21.31,;11.3,-22.09,;11.31,-23.62,;9.98,-24.39,;8.64,-23.63,;7.31,-24.4,;8.64,-22.09,;7.3,-21.32,;9.97,-21.31,;17.96,-21.29,;17.96,-19.75,;19.29,-22.07,;20.63,-21.31,)|
Oc1c(ccc2cccnc12)C(=O)c1cc(Cc2ccccc2)ccn1
Oc1c(oc2cccnc12)C(=O)c1cccc(Cc2ccccc2)c1
Oc1ccc2oc3ccc(Cc4ccccc4)cc3c(=O)c2c1O
CC1Oc2cc3c(c(OC(C)=O)cc(OC(C)=O)c3c(OC(C)=O)c2C(=O)C1C)-c1c(OC(C)=O)cc(OC(C)=O)c2c(OC(C)=O)c3C(=O)C(C)C(C)Oc3cc12 |(8.26,-9.9,;6.91,-9.15,;5.58,-9.92,;4.25,-9.15,;2.92,-9.94,;1.57,-9.17,;.23,-9.95,;-1.1,-9.18,;-2.43,-9.94,;-3.92,-9.53,;-5.03,-10.62,;-4.32,-8.03,;-1.1,-7.63,;.23,-6.86,;.23,-5.33,;-1.1,-4.56,;-2.43,-5.33,;-1.1,-3.02,;1.57,-7.63,;2.89,-6.84,;2.89,-5.3,;3.29,-3.81,;2.19,-2.71,;4.78,-3.39,;4.23,-7.61,;5.56,-6.84,;5.55,-5.3,;6.91,-7.59,;8.24,-6.8,;.24,-11.48,;-1.1,-12.25,;-2.43,-11.49,;-3.52,-12.58,;-3.13,-14.07,;-5.02,-12.16,;-1.09,-13.79,;.26,-14.56,;.26,-16.08,;-.84,-17.18,;-.46,-18.67,;-2.33,-16.76,;1.59,-13.77,;2.92,-14.54,;2.92,-16.06,;2.92,-17.6,;1.57,-18.37,;4.23,-18.37,;4.21,-13.75,;5.55,-14.52,;5.55,-16.06,;6.88,-13.74,;8.22,-14.5,;6.87,-12.2,;8.19,-11.42,;5.53,-11.44,;4.21,-12.23,;2.89,-11.46,;1.57,-12.23,)|
COc1cc(O)c2c(O)c3C(=O)C(C)C(C)Oc3cc2c1-c1c(OC)cc(OC)c2c(OC)c3C(=O)C(C)C(C)Oc3cc12 |(-4.1,-12.46,;-3.01,-11.38,;-1.67,-12.13,;-1.66,-13.68,;-.33,-14.45,;-.32,-15.98,;1,-13.67,;2.34,-14.42,;2.34,-15.96,;3.65,-13.65,;4.98,-14.42,;4.98,-15.96,;6.31,-13.63,;7.66,-14.39,;6.31,-12.09,;7.62,-11.31,;4.96,-11.33,;3.65,-12.11,;2.31,-11.36,;1,-12.13,;-.33,-11.36,;-.34,-9.84,;-1.67,-9.07,;-3.01,-9.82,;-4.51,-9.42,;-1.67,-7.51,;-.34,-6.74,;-.34,-5.21,;-1.67,-4.44,;1,-7.51,;2.32,-6.73,;2.32,-5.19,;1.22,-4.09,;3.67,-7.48,;5,-6.71,;4.98,-5.17,;6.33,-7.48,;7.66,-6.68,;6.36,-9.03,;7.69,-9.79,;5.01,-9.81,;3.67,-9.04,;2.34,-9.82,;1,-9.05,)|
C[C@H]1Oc2cc3c(c(O)cc(O)c3c(O)c2C(=O)[C@H]1C)-c1c(O)cc(O)c2c(O)c3c(cc12)oc(C)c(C)c3=O |wU:18.21,1.0,(7.61,-9.78,;6.28,-9.01,;4.93,-9.81,;3.6,-9.04,;2.27,-9.81,;.93,-9.04,;-.41,-9.83,;-1.74,-9.06,;-3.07,-9.81,;-1.74,-7.52,;-.41,-6.73,;-.41,-5.21,;.93,-7.5,;2.25,-6.73,;2.25,-5.19,;3.59,-7.5,;4.92,-6.7,;4.91,-5.16,;6.26,-7.47,;7.59,-6.68,;-.4,-11.35,;-1.74,-12.12,;-3.07,-11.37,;-1.73,-13.66,;-.39,-14.43,;-.39,-15.97,;.94,-13.66,;2.27,-14.4,;2.27,-15.94,;3.58,-13.63,;3.58,-12.09,;2.25,-11.35,;.93,-12.12,;4.88,-11.32,;6.23,-12.07,;7.54,-11.3,;6.24,-13.61,;7.58,-14.38,;4.91,-14.4,;4.91,-15.94,)|
COc1cc(O)c2c(OC)c3C(=O)C(C)C(C)Oc3cc2c1-c1c(O)cc(OC)c2c(OC)c3C(=O)C(C)C(C)Oc3cc12 |(-4.08,-12.58,;-2.99,-11.49,;-1.66,-12.26,;-1.65,-13.8,;-.32,-14.57,;-.3,-16.08,;1.01,-13.77,;2.34,-14.54,;2.36,-16.06,;1.26,-17.16,;3.66,-13.75,;4.99,-14.52,;4.98,-16.06,;6.31,-13.75,;7.66,-14.5,;6.31,-12.21,;7.63,-11.42,;4.97,-11.44,;3.65,-12.23,;2.32,-11.46,;1.01,-12.23,;-.32,-11.49,;-.33,-9.95,;-1.66,-9.18,;-3,-9.95,;-1.66,-7.64,;-.33,-6.87,;-.33,-5.33,;-1.66,-4.56,;1.01,-7.64,;2.33,-6.84,;2.33,-5.3,;1.24,-4.21,;3.67,-7.61,;5,-6.84,;4.99,-5.3,;6.33,-7.59,;7.66,-6.8,;6.35,-9.15,;7.7,-9.9,;5.02,-9.92,;3.67,-9.15,;2.34,-9.95,;1.01,-9.18,)|
COc1cc(OC)c2c(OC)c3C(=O)C(C)C(C)Oc3cc2c1-c1c(OC)cc(OC)c2c(OC)c3C(=O)C(C)C(C)Oc3cc12 |(-4.5,-9.53,;-3,-9.95,;-1.67,-9.18,;-1.67,-7.64,;-.34,-6.87,;-.34,-5.33,;-1.67,-4.56,;1,-7.64,;2.32,-6.84,;2.32,-5.3,;1.22,-4.21,;3.66,-7.61,;4.99,-6.84,;4.98,-5.3,;6.33,-7.59,;7.66,-6.8,;6.35,-9.15,;7.68,-9.9,;5,-9.92,;3.67,-9.15,;2.34,-9.95,;1,-9.18,;-.34,-9.95,;-.33,-11.49,;-1.67,-12.26,;-3,-11.49,;-4.1,-12.58,;-1.66,-13.8,;-.32,-14.57,;-.32,-16.08,;-1.65,-16.85,;1.01,-13.77,;2.34,-14.54,;2.34,-16.06,;1.24,-17.16,;3.65,-13.75,;4.98,-14.52,;4.98,-16.06,;6.31,-13.75,;7.65,-14.5,;6.3,-12.21,;7.61,-11.42,;4.95,-11.44,;3.65,-12.23,;2.32,-11.46,;1,-12.23,)|
C[C@@H]1Oc2cc3c(c(O)cc(O)c3c(O)c2C(=O)[C@@H]1C)-c1c(O)cc(O)c2c(O)c3OC(=O)[C@H](C)[C@@H](C)Oc3cc12 |wU:18.21,35.38,1.0,wD:33.36,(12.23,-.68,;10.88,-1.45,;9.55,-.68,;8.22,-1.45,;6.88,-.68,;5.55,-1.45,;4.21,-.68,;2.88,-1.45,;1.54,-.68,;2.88,-3.01,;4.21,-3.78,;4.21,-5.32,;5.55,-3.01,;6.88,-3.78,;6.88,-5.32,;8.22,-3.01,;9.55,-3.78,;9.55,-5.32,;10.88,-3.01,;12.23,-3.79,;4.21,.86,;2.88,1.63,;1.54,.84,;2.88,3.17,;4.21,3.94,;4.21,5.48,;5.55,3.17,;6.88,3.94,;6.88,5.48,;8.22,3.17,;9.41,4.12,;10.9,3.78,;11.86,4.99,;11.58,2.4,;13.12,2.42,;10.9,1.02,;11.88,-.22,;9.41,.67,;8.22,1.63,;6.88,.86,;5.55,1.63,)|
CC1Oc2cc3c(c(O)cc(O)c3c(O)c2C(=O)C1C)-c1c(O)cc(O)c2c(O)c3C(=O)C(C)C(C)Oc3cc12 |(7.61,-9.78,;6.28,-9.01,;4.93,-9.81,;3.6,-9.04,;2.27,-9.81,;.93,-9.04,;-.41,-9.83,;-1.74,-9.06,;-3.07,-9.81,;-1.74,-7.52,;-.41,-6.73,;-.41,-5.21,;.93,-7.5,;2.25,-6.73,;2.25,-5.19,;3.59,-7.5,;4.92,-6.7,;4.91,-5.16,;6.26,-7.47,;7.59,-6.68,;-.4,-11.35,;-1.74,-12.12,;-3.07,-11.37,;-1.73,-13.66,;-.39,-14.43,;-.39,-15.97,;.94,-13.65,;2.27,-14.4,;2.27,-15.94,;3.58,-13.63,;4.91,-14.4,;4.91,-15.94,;6.24,-13.61,;7.58,-14.38,;6.23,-12.07,;7.54,-11.3,;4.88,-11.32,;3.58,-12.09,;2.25,-11.35,;.93,-12.12,)|
COc1cc(O)c2c(OC)c3C(=O)C(C)C(C)Oc3cc2c1-c1c(OC)cc(OC)c2c(OC)c3C(=O)C(C)C(C)Oc3cc12 |(-4.1,-12.58,;-3,-11.49,;-1.67,-12.26,;-1.66,-13.8,;-.32,-14.57,;-.32,-16.08,;1.01,-13.77,;2.34,-14.54,;2.34,-16.06,;1.24,-17.16,;3.65,-13.75,;4.98,-14.52,;4.98,-16.06,;6.31,-13.75,;7.65,-14.5,;6.3,-12.21,;7.61,-11.42,;4.95,-11.44,;3.65,-12.23,;2.32,-11.46,;1,-12.23,;-.33,-11.49,;-.34,-9.95,;-1.67,-9.18,;-3,-9.95,;-4.5,-9.53,;-1.67,-7.64,;-.34,-6.87,;-.34,-5.33,;-1.67,-4.56,;1,-7.64,;2.32,-6.84,;2.32,-5.3,;1.22,-4.21,;3.66,-7.61,;4.99,-6.84,;4.98,-5.3,;6.33,-7.59,;7.66,-6.8,;6.35,-9.15,;7.68,-9.9,;5,-9.92,;3.67,-9.15,;2.34,-9.95,;1,-9.18,)|
CC[C@@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(O)=O)NC(=O)CNC(=O)[C@H](C)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(N)=O
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc2c[nH]cn2)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@@H](Cc3c[nH]cn3)C(=O)NC(CC(N)=O)C(=O)N[C@@H](Cc4ccccc4)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(N)=O
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)[C@@H](C)CC)C(C)C)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CCC(N)=O)C(C)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N5CCCC5C(N)=O
CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(N)=O
OC(=O)C(=O)CC(=O)c1cccc(CN=[N+]=[N-])c1
OC(=O)C(=O)CC(=O)c1cc(CN=[N+]=[N-])cc(CN=[N+]=[N-])c1
OC(=O)C(=O)CC(=O)c1ccc(CN=[N+]=[N-])c(CN=[N+]=[N-])c1
OC(=O)C(=O)CC(=O)c1ccc(CN=[N+]=[N-])cc1
OC(=O)C(=O)CC(=O)c1cccc(CCC#N)c1
CC(C)Oc1ccc(CN=[N+]=[N-])cc1C(=O)CC(=O)C(O)=O
COc1ccc(cc1CN=[N+]=[N-])C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1ccc2C(CCC(N=[N+]=[N-])c2c1)N=[N+]=[N-]
OC(=O)C(=O)CC(=O)c1cccc(OCc2ccccc2)c1
COc1ccc(CN=[N+]=[N-])cc1C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1ccc2C(CC(N=[N+]=[N-])c2c1)N=[N+]=[N-]
NCCCC[C@H](NC(=O)[C@H](CSC[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
NCCCC[C@H](NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
NCCCC[C@H](NC(=O)[C@H](CSCSC[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
NCCCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
NCCCC[C@H](NC(=O)[C@@H](CCSCC[C@@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
NCCCC[C@H](NC(=O)[C@@H](CCSC[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
OC(=O)c1[nH]c(C(O)=O)c(c1-c1ccc(O)c(O)c1)-c1ccc(O)c(O)c1
OC(=O)C(C(C(O)=O)c1ccc(O)c(O)c1)c1ccc(O)c(O)c1
Oc1ccc(cc1O)C1=C(C(=O)NC1=O)c1ccc(O)c(O)c1 |t:9|
OC(=O)C(Cc1ccc(O)c(O)c1)C(Cc1ccc(O)c(O)c1)C(O)=O
Oc1ccc(cc1O)C1=C(C(=O)OC1=O)c1ccc(O)c(O)c1 |t:9|
OC(=O)C(=O)CC(=O)c1cccc(OCc2ccc(cc2)C(=O)c2ccccc2)c1
OC(=O)C(=O)CC(=O)c1cccc(c1)N=[N+]=[N-]
c1ccc(cc1)C(=O)CC(=O)C(=O)O
OC(=O)C(=O)CC(=O)c1cccc(c1)C(=O)c1ccccc1
OC(=O)C(=O)CC(=O)C=Cc1cccn1Cc1ccc(cc1)[N+]([O-])=O |w:8.7|
CCOC(=O)C(=O)CC(=O)C=Cc1cccn1Cc1ccc(cc1)[N+]([O-])=O |w:10.9|
OC(=O)c1ccc2ccc(nc2c1O)C(=O)NNc1ccccc1
COc1cc(CNC(=O)c2ccc3ccc(C(O)=O)c(O)c3n2)cc(O)c1O
OC(=O)c1ccc2ccc(NC(=O)NCc3ccc(O)c(O)c3)nc2c1O
OC(=O)c1ccc2ccc(nc2c1O)C(=O)CC(=O)c1ccccc1
OC(=O)c1ccc2ccc(nc2c1O)C(=O)Nc1ccc(O)c(O)c1
OC(=O)c1ccc2ccc(NC(=O)c3ccccc3)nc2c1O
OC(=O)c1ccc2ccc(nc2c1O)C(=O)NCc1ccc(O)cc1O
OC(=O)c1ccc2ccc(nc2c1O)C(=O)NCc1cc(O)cc(O)c1
OC(=O)c1ccc2ccc(nc2c1O)C(=O)NCc1ccc(O)c(O)c1
OC(=O)c1ccc2ccc(nc2c1O)C(=O)NNc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O
COc1cc(NC(=O)c2ccc3ccc(C(O)=O)c(O)c3n2)cc(O)c1O
COc1ccc(CNC(=O)Nc2ccc3ccc(C(O)=O)c(O)c3n2)cc1
OC(=O)c1ccc2ccc(nc2c1O)C(=O)NCc1ccc(O)c(O)c1O
OC(=O)c1ccc2ccc(NC(=O)Nc3ccc(O)c(O)c3)nc2c1O
OC(=O)c1ccc2ccc(nc2c1O)C(=O)NCc1cccc(O)c1O
OC(=O)C(=O)CC(=O)c1cccc(OCc2ccc(COc3cccc(c3)C(=O)CC(=O)C(O)=O)cc2)c1
Fc1ccccc1Cc1cccc(c1)C(=O)CC(=O)C(=O)NCCCNC(=O)C(=O)CC(=O)c1cccc(Cc2ccccc2F)c1
OC(=O)C(=O)CC(=O)c1cccc(c1)C(c1cccc(c1)C(=O)CC(=O)C(O)=O)c1ccccc1F
Fc1ccccc1Cc1cccc(c1)C(=O)CC(=O)C(=O)N1CCN(CC1)C(=O)C(=O)CC(=O)c1cccc(Cc2ccccc2F)c1
OC(=O)C(=O)CC(=O)c1cccc(OCc2cccc(COc3cccc(c3)C(=O)CC(=O)C(O)=O)c2)c1
Fc1ccccc1Cc1cccc(c1)C(=O)CC(=O)C(=O)NCCNC(=O)C(=O)CC(=O)c1cccc(Cc2ccccc2F)c1
OC(=O)C(=O)CC(=O)c1cccc(OCc2ccccc2COc2cccc(c2)C(=O)CC(=O)C(O)=O)c1
Fc1ccccc1Cc1cccc(c1)C(=O)CC(=O)C(=O)NCCCCCNC(=O)C(=O)CC(=O)c1cccc(Cc2ccccc2F)c1
Fc1ccccc1Cc1cccc(c1)C(=O)CC(=O)C(=O)NCCCCCCNC(=O)C(=O)CC(=O)c1cccc(Cc2ccccc2F)c1
Cn1cc(C(=O)CC(=O)C(O)=O)c2cc3OCOc3cc12
CCn1cc(C(=O)CC(=O)C(O)=O)c2ccccc12
CCn1cc(C(=O)CC(=O)C(O)=O)c2cc3OCOc3cc12
Cn1c(cc2cc3OCOc3cc12)C(=O)CC(=O)C(O)=O
COC(=O)C(=O)CC(=O)c1cc2cc3OCOc3cc2n1Cc1ccccc1
CCn1c(cc2ccccc12)C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1cc2ccccc2n1Cc1ccccc1
OC(=O)C(=O)CC(=O)c1cn(Cc2ccccc2)c2ccccc12
OC(=O)C(=O)CC(=O)c1cc2cc3OCOc3cc2n1Cc1ccccc1
Cn1cc(C(=O)CC(=O)C(O)=O)c2ccccc12
Cn1c(cc2ccccc12)C(=O)CC(=O)C(O)=O
CCn1c(cc2cc3OCOc3cc12)C(=O)CC(=O)C(O)=O
OC(=O)c1nc([nH]c(=O)c1O)-c1ccccc1
OC(=O)c1nc([nH]c(=O)c1O)-c1cccc(O)c1
OC(=O)c1nc([nH]c(=O)c1O)-c1cccc(OCc2ccccc2)c1
c1cc(ccc1C2=NC(=C(C(=O)N2)O)C(=O)O)Cl
CC[C@H](C)[C@H](NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(N)=O
CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCCCCC(NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)[C@@H](C)CC)C(=O)NCCCCC(NC(=O)C(CCCCNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](N)[C@@H](C)CC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)[C@@H](C)CC)C(N)=O
CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(N)=O
CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(N)=O
CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(N)=O
CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(N)=O
CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
CC[C@H](C)[C@@H](N)C(=O)N[C@H](CC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CCCCN)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H]1C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H]1C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(=O)NCCCCC(NC(=O)[C@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCN1C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCN1C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCN1C(=O)[C@@H](CC(C)C)NC(=O)[C@H](N)[C@@H](C)CC)C(N)=O
CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCCCCC(NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)[C@@H](C)CC)C(N)=O
CC(=O)c1ccc2n(Cc3ccc(F)cc3)cc(C(O)=O)c(=O)c2c1
OC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(\C=C\C(=O)c3ccccc3)cc2c1=O
OC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3ccccc3)cc2c1=O
OC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3cccc(Cl)c3Cl)cc2c1=O
OC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3ccc(Cl)c(Cl)c3)cc2c1=O
OC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3cccc4ccccc34)cc2c1=O
OC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3ccc4OCOc4c3)cc2c1=O
OC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3ccc(cc3)-c3ccccc3)cc2c1=O
OC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3ccc(Oc4ccccc4)cc3)cc2c1=O
CCOC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(cc2c1=O)C(C)=O
CCOC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3cccc(Cl)c3Cl)cc2c1=O
CCOC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3ccc(Cl)c(Cl)c3)cc2c1=O
CCOC(=O)\C=C\C(=O)\C=C\c1cccn1Cc1ccccc1Cl
[H][C@]12CC[C@@]3(C)C(=CC(C)=C(C)[C@@]3(C(=O)OC)C(=O)C(C)=O)[C@@]1(CC[C@H](OC(C)=O)C2(C)C)C=O |r,c:6,t:9|
Fc1ccc(Cc2ccc(o2)C(=O)CC(=O)c2nnc[nH]2)cc1
CCc1cc(\C=N\CC\N=C\c2cc(CC)sc2S)c(S)s1
OC(=O)c1cc(Cc2ccc(NC(=O)c3cccc(c3)[N+]([O-])=O)c(c2)C(O)=O)ccc1NC(=O)c1cccc(c1)[N+]([O-])=O
COc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc2ccccc2C(O)=O)cc1
Oc1ccc(C=NNC(=O)c2cc(n[nH]2)C2CC2)c(O)c1 |w:5.4|
COC(=O)c1cc(NS(=O)(=O)c2ccc(NCc3cccnc3)c(N)c2)cc(c1)C(=O)OC
Oc1ccc(Cc2ccc(NC(=O)c3ccccc3F)c(O)c2)cc1NC(=O)c1ccccc1F
Cc1ccc(NC(=O)C(=O)NCc2ccc(\C=N/NC(=O)C(=O)Nc3cc(Cl)ccc3C)o2)cc1C
COc1cc(C=NNC(=O)c2cc(n[nH]2)C2CC2)ccc1O |w:5.4|
OC(=O)c1cc(NS(=O)(=O)c2ccc(NCCCN3CCOCC3)c(c2)[N+]([O-])=O)cc(c1)C(O)=O
CC(CC(=O)Nc1c(C)cc(C)cc1C)=NNC(=O)c1ccc(O)cc1O |w:15.16|
COC(=O)c1c(O)c(=Cc2ccc(CNC(=O)C(=O)Nc3ccc(C)cc3)o2)[nH]c1=C |w:8.8|
COc1ccc2nc(SCC(=O)Nc3ccc(O)c(c3)C(O)=O)[nH]c2c1
OC(COc1ccc(C(=O)c2ccccc2)c(O)c1)COc1ccc(C(=O)c2ccccc2)c(O)c1
COc1ccc(cc1)C(=O)Nc1ccc(Cc2ccc(NC(=O)c3ccc(OC)cc3)c(O)c2)cc1O
O=C(NCc1ccco1)C(=O)NCc1cccc(CNC(=O)C(=O)NCc2ccco2)c1
O=C(NCc1ccco1)c1cc(cc(c1)C(=O)NCc1ccco1)C(=O)NCc1ccco1
CCOC(=O)c1cc(C(=O)OCC)c(=O)[nH]c1SCC(=O)Nc1ccc(Br)cc1
OC(=O)c1cc(Cc2ccc(NC(=O)c3cccs3)c(c2)C(O)=O)ccc1NC(=O)c1cccs1
COC(=O)c1sccc1NC(=O)c1ccc(cc1)C(=O)Nc1ccsc1C(=O)OC
OC(=O)c1cc(NS(=O)(=O)c2ccc(NCc3ccccc3)c(c2)[N+]([O-])=O)cc(c1)C(O)=O
[O-]c1c(nc(N2CCCCS2(=O)=O)c2cccnc12)C(=O)[N-]Cc1ccc(F)cc1
CC(C)Oc1ccc(Cc2ccccc2)cc1C(=O)[CH-]C(=O)C([O-])=O
O=c1n(Cc2cccc3ccccc23)c(=O)c2c1c(=O)c1[nH]cc[nH]c1c2=O
COc1ccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)cc1
Fc1cc(F)cc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)c1
Cc1csc(c1)-c1cccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)c1
Clc1ccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)cc1
COc1cccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)c1OC
C[C@@H](c1ccccc1)n1c(=O)c2c(c1=O)c(=O)c1[nH]cc[nH]c1c2=O
Fc1ccccc1-c1cccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)c1
Oc1c2C(=O)N(Cc3cccc(Br)c3)C(=O)c2c(O)c2ncccc12
COc1ccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)c(OC)c1
C[C@H](c1ccccc1)n1c(=O)c2c(c1=O)c(=O)c1[nH]cc[nH]c1c2=O
Clc1cccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)c1
O=c1n(CCc2ccccc2)c(=O)c2c1c(=O)c1[nH]cc[nH]c1c2=O
Brc1ccccc1Cn1c(=O)c2c(c1=O)c(=O)c1[nH]cc[nH]c1c2=O
Fc1ccccc1-c1ccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)cc1
O=c1n(C2CCCC2)c(=O)c2c1c(=O)c1[nH]cc[nH]c1c2=O
Fc1ccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)cc1
Cc1ccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)cc1
COc1ccccc1Cn1c(=O)c2c(c1=O)c(=O)c1[nH]cc[nH]c1c2=O
COc1cccc(OC)c1Cn1c(=O)c2c(c1=O)c(=O)c1[nH]cc[nH]c1c2=O
Fc1cccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)c1
O=C(N1CCC(CC1)n1c(=O)c2c(c1=O)c(=O)c1[nH]cc[nH]c1c2=O)c1ccccc1
O=c1n(CCc2ccc3OCOc3c2)c(=O)c2c1c(=O)c1[nH]cc[nH]c1c2=O
Cc1ccc2c(O)c3C(=O)N(Cc4cccc(Br)c4)C(=O)c3c(O)c2n1
Brc1cccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH][nH]ccc2c3=O)c1
FC(F)(F)Oc1ccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)cc1
FC(F)(F)c1cccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)c1
Clc1cc(Cl)cc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)c1
O=c1n(CC2CCCCC2)c(=O)c2c1c(=O)c1[nH]cc[nH]c1c2=O
O=c1n(Cc2ccc3OCOc3c2)c(=O)c2c1c(=O)c1[nH]cc[nH]c1c2=O
O=c1n(-c2ccc3OCOc3c2)c(=O)c2c1c(=O)c1[nH]cc[nH]c1c2=O
Cn1c(=O)c2c(c1=O)c(=O)c1[nH]cc[nH]c1c2=O
O=c1n(Cc2ccc(cc2)-c2ccccc2)c(=O)c2c1c(=O)c1[nH]cc[nH]c1c2=O
Fc1cc(Br)ccc1Cn1c(=O)c2c(c1=O)c(=O)c1[nH]cc[nH]c1c2=O
O=c1n(Cc2ccncc2)c(=O)c2c1c(=O)c1[nH]cc[nH]c1c2=O
COc1ccc(OC)c(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)c1
Brc1cccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)c1
Clc1ccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)cc1Cl
Fc1ccc(Br)cc1Cn1c(=O)c2c(c1=O)c(=O)c1[nH]cc[nH]c1c2=O
Fc1ccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)cc1Cl
[H][C@]12CC(=C)[C@]3(C)C(=O)[C@@](C)(O)C(=O)[C@]3(C(=O)OC)[C@]1(C)CC(=O)[C@@]1([H])C(C)(C)C(=O)CC[C@]21C |r|
COc1cc2OC(=O)c3c(C)cc(O)c(C=O)c3Oc2c(O)c1C
[H][C@@]1(O[C@H]2CC[C@@]3(C)[C@@]([H])(CC[C@]4(C)[C@]3([H])CC=C3[C@]5([H])CC(C)(C)CC[C@@]5(CC[C@@]43C)C(O)=O)C2(C)C)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(C)=O |r,t:18|
C\C=C\Oc1cc(C=O)ccc1O
c1ccc2c(c1)C(=O)c3c(cc(c(c3C2=O)N)S(=O)(=O)O)Nc4ccc(c(c4)S(=O)(=O)O)Nc5nc(nc(n5)Cl)Nc6ccccc6S(=O)(=O)O
OS(=O)(=O)c1ccccc1Nc1nc(Cl)nc(Nc2ccccc2S(O)(=O)=O)n1
OS(=O)(=O)c1cccc(Nc2nc(Cl)nc(Nc3cccc(c3)S(O)(=O)=O)n2)c1
Oc1cc(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c2cc(O)c(O)c(O)c2)cc(O)c1O
CC(=O)c1cc(C=CS(=O)(=O)CS(=O)(=O)C=Cc2cc(C(C)=O)c(C(C)=O)c(c2)C(C)=O)cc(C(C)=O)c1C(C)=O |w:16.16,6.5|
CC(=O)c1ccc(C=CS(=O)(=O)CS(=O)(=O)C=Cc2ccc(C(C)=O)c(c2)C(C)=O)cc1C(C)=O |w:7.6,17.17|
COc1cc(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c2ccccc2)cc(O)c1O
COc1cc(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c2cc(O)c(O)c(OC)c2)cc(O)c1O
O=S(=O)(CS(=O)(=O)\C=C\c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1)\C=C\c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1
COc1cc(C=CS(=O)(=O)CS(=O)(=O)C=Cc2ccc(C(C)=O)c(OC)c2)ccc1C(C)=O |w:15.15,5.4|
Oc1ccc(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c2ccc(O)c(O)c2)cc1O
COc1cc(C=CS(=O)(=O)CS(=O)(=O)C=Cc2ccccc2)cc(C(C)=O)c1C(C)=O |w:5.4,15.15|
COc1cc(C=CS(=O)(=O)CS(=O)(=O)C=Cc2cc(OC)c(C(C)=O)c(c2)C(C)=O)cc(C(C)=O)c1C(C)=O |w:15.15,5.4|
CN1C(CC(=O)N=C1O)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12 |c:6|
Oc1c(nc(C2CC(=O)NC(=O)N2)c2cccnc12)C(=O)NCc1ccc(F)cc1
CN1C(CC(=O)N(C)C1=O)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
CN1C(=O)CC(NC1=O)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
OC(=O)\C=C\c1ccc(O)c(Oc2cc3cc(O)c(O)cc3oc2=O)c1
Oc1cc2cc(O)c(=O)oc2cc1O
OC(=O)\C=C\c1ccc(Oc2cc3cc(O)c(O)cc3oc2=O)c(O)c1
OC(=O)C(=O)CC(=O)c1cn(Cc2ccc(F)cc2)c2ccccc12
OC(=O)C(=O)CC(=O)c1cn(Cc2ccccc2)c2ccc(Cl)cc12
CCOC(=O)C(=O)CC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OC)cc12
CC(C)OC(=O)C(=O)CC(=O)c1cccn1Cc1ccc(F)cc1
CCCCOC(=O)C(=O)CC(=O)c1cccn1Cc1ccc(F)cc1
COc1ccc2n(Cc3ccccc3)cc(C(=O)CC(=O)C(O)=O)c2c1
OC(=O)C(=O)CC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(Cl)cc12
OC(=O)C(=O)CC(=O)c1ccc(cc1)C(=O)CC(=O)C(O)=O
Clc1ccc2[nH]cc(C(=O)CC(=O)c3nnc[nH]3)c2c1
NC(=O)C(=O)Nc1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
O=C(CC(=O)c1c[nH]c2ccccc12)c1nnn[nH]1
c1cc2c(c(c(nc2N3CCCCS3(=O)=O)C(=O)NCc4ccc(cc4)F)O)nc1
OC(=O)C(=O)CC(=O)c1cccc(c1)C(=O)CC(=O)C(O)=O
CCOC(=O)C(=O)CC(=O)c1cn(Cc2ccccc2)c2ccc(Cl)cc12
OC(=O)C(=O)CC(=O)c1cccc(NC(=O)c2ccccc2)c1
CCOC(=O)C(=O)CC(=O)c1cn(Cc2ccccc2)c2ccccc12
OC(=O)C(=O)CC(=O)c1ccc(Oc2ccccc2)cc1
CCOC(=O)C(=O)CC(=O)c1cn(Cc2ccc(F)cc2)c2ccccc12
OC(=O)C(=O)CC(=O)c1c[nH]c2ccccc12
OC(=O)C(=O)CC(=O)c1c[nH]c2ccc(Cl)cc12
OC(=O)C(=O)CC(=O)c1ccnc2ccccc12
c1cc(cc(c1)Br)C(=O)CC(=O)C(=O)O
CCOC(=O)C(=O)CC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(Cl)cc12
CCOC(=O)C(=O)CC(=O)c1cn(Cc2ccccc2)c2ccc(OC)cc12
COc1ccc2n(Cc3ccc(F)cc3)cc(C(=O)CC(=O)C(O)=O)c2c1
CCC(=O)C(=O)CC(=O)c1c[nH]c2ccc(Cl)cc12
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2ccc(cc2)-c2ccccc2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
CCC(CC)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:7|
[#6]-[#6](=O)-[#7]-[#6@@H]-1-[#6@H](-[#6]=[#6](-[#8]-[#6@H]-1-[#6@H](-[#8])-[#6@H](-[#8])-[#6]-[#8])-[#6](-[#8])=O)\[#7]=[#6](\[#7])-[#7] |r,c:6|
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2ccc(cc2Cl)-c2cccs2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2ccc(cc2C)-c2cccs2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2ccc(cc2OC)-c2cccs2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2c(C)cc(cc2C)-c2cccs2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2c(F)cc(cc2F)-c2cccs2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2ccc(-c3cccs3)c(Cl)c2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2ccc(cc2Cl)-c2ccsc2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2ccc(cc2C)-c2ccsc2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2ccc(cc2OC)-c2ccsc2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2c(C)cc(cc2C)-c2ccsc2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2ccc(cc2O)-c2ccsc2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2ccc(cc2)-c2cccs2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
COC(Nc1cc(Cl)c(cc1Cl)[N+]([O-])=O)c1ccc2cccc(O)c2n1
Cc1ccc2c(ccc(O)c2n1)N=O
OC(=O)c1ccc2ccc(\C=C\c3cccc(Cl)c3)nc2c1
Oc1cccc2ccc(\C=C\c3cccc(Cl)c3)nc12
Oc1cc(O)cc(c1)C(=O)NN=Cc1ccc(C=NNC(=O)c2cc(O)cc(O)c2)cc1 |w:17.17,11.11|
CC(=O)c1cc(sc1Nc1ccccc1)C(=O)CC(=O)Nc1ccc(cc1)[N+]([O-])=O
COc1ccc(cc1[N+]([O-])=O)C(=O)Nc1ccc(O)c(c1)-c1nc2ccccc2o1
Cc1ccc(cc1)S(=O)(=O)Nc1ccccc1\N=C\c1sc2ccccc2c1O
Oc1ccc(NC(=O)c2cccc3ccccc23)cc1-c1nc2ccccc2o1
COc1cc(CN=Nc2nc(O)c(CC(=O)Nc3ccc(Cl)c(Cl)c3)s2)ccc1O |w:6.5|
Cc1ccc(cc1)C(=O)N\C(=C\c1ccc(o1)-c1ccc(Cl)cc1Cl)C(=O)NCCCO
COc1ccc(CCNC(=O)CC(=O)N\N=C\c2ccco2)cc1OC
Oc1ccc(Br)cc1\C=N\NC(=O)CSc1nc2ccccc2n1Cc1ccccc1
COc1ccc(cc1Cl)N(CC(=O)N\N=C\c1c(O)ccc2ccccc12)S(C)(=O)=O
Oc1ccc(NC(=O)c2cccnc2)cc1-c1nc2cc(Cl)ccc2o1
Clc1ccc(SCc2cc(=O)[nH]c(SCC(=O)Nc3ccc(Cl)cc3Cl)n2)cc1
Oc1ccccc1NC(=S)NC(=O)C=Cc1ccco1 |w:13.13|
Cc1ccc(cc1)C(=O)C1C(N(CCCc2cnc[nH]2)C(=O)C1=O)c1ccc(Cl)cc1
CC(=O)c1cc(sc1Nc1ccccc1)C(=O)CC(=O)Nc1ccccc1
Oc1[nH]c2ccc(Br)cc2c1N=NC(=O)C(=O)CC(=O)c1ccc(Cl)cc1 |w:12.14|
OC(=O)c1cccc(NC(=O)CC2Sc3ccccc3NC2=O)c1
COc1ccc2oc(=O)c(cc2c1)-c1csc(N=NCc2ccccc2O)n1 |w:17.18|
OC(C\N=C\c1ccccc1O)C\N=C\c1ccccc1O
Clc1ccc(\C=C\C(=O)Nc2ccc(NC(=O)c3ccco3)cc2)cc1
CCSc1nnc(s1)N1C(=O)c2ccc(cc2C1=O)C(=O)c1ccc(cc1)C(O)=O
CCOC(=O)c1c(NC(NC(=O)c2ccco2)C(=O)c2ccc(C)cc2)scc1-c1ccccc1
CCOC(=O)CCc1cc(C(=O)OCC)c(CCC(=O)OCC)cc1C(=O)OCC
Cc1[nH]n(-c2ccccc2)c(=O)c1C(c1c(C)n(C)n(-c2ccccc2)c1=O)c1ccc(O)c(O)c1
CC(=O)c1cc(sc1Nc1ccccc1)C(=O)CC(=O)Nc1cccc(c1)[N+]([O-])=O
OC(=O)c1cc(NC(=O)Cc2ccccc2)c(cc1NC(=O)Cc1ccccc1)C(O)=O
OC(=O)c1nc[nH]c1C(=O)Nc1ccc(Br)cc1C(=O)c1ccccc1
COC(=O)c1ccc(C(=O)OC)c(NC(=O)c2ccc(C)c(c2)[N+]([O-])=O)c1
OC(=O)C(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccccc1[N+]([O-])=O
OC(=O)c1cc(NC(=O)c2cccc3ccccc23)c(cc1NC(=O)c1cccc2ccccc12)C(O)=O
Oc1[nH]c2ccc(F)cc2c1\N=N\C(=O)C(\NC(=O)c1ccccc1)=C\C=C\c1ccccc1
Oc1ccc(Br)cc1\C=N\NC(=O)C(\NC(=O)c1ccccc1)=C\C=C\c1ccccc1
Oc1ccc(NC(=O)\C=C\c2ccc(o2)-c2ccccc2[N+]([O-])=O)cc1-c1nc2ccccc2o1
OC(=O)C(=O)\C=C(/O)c1cn(Cc2ccccc2)c(=O)n(Cc2ccccc2)c1=O
OC(=O)C(=O)CC(=O)c1cn(Cc2ccccc2)c(=O)[nH]c1=O
OC(=O)C(=O)\C=C(/O)c1cn(Cc2ccc(F)cc2)c(=O)n(Cc2ccc(F)cc2)c1=O
OC(=O)C(=O)\C=C(/O)c1cn(Cc2ccccc2F)c(=O)n(Cc2ccccc2F)c1=O
OC(=O)C(=O)CC(=O)c1nc2cncnc2n1Cc1ccccc1
OC(=O)C(=O)CC(=O)c1nc2n(Cc3ccccc3)cnc2c(=O)n1Cc1ccccc1
OC(=O)C(=O)\C=C(\O)c1nc2c(ncn(Cc3ccccc3)c2=O)n1Cc1ccccc1
OC(=O)C(=O)CC(=O)c1ncnc2n(Cc3ccccc3)cnc12
CCC(CC)O[C@@H]1C=C(C[C@H](NCc2ccc(Sc3ccccc3)cc2)[C@H]1NC(C)=O)C(O)=O |r,c:7|
c1c2c(cc(c1F)N3CCNCC3)N(C=C(C2=O)C(=O)O)C4CC4
COc1ccc(cc1OC)C1C(C(=O)c2ccc(F)cc2)C(=O)C(=O)N1CCN(C)C
COc1cccc2cc(-c3csc(Nc4cccc(O)c4)n3)c(=O)oc12
Fc1ccc(cc1)C(=O)C1C(N(CCCN2CCOCC2)C(=O)C1=O)c1ccccc1F
COc1ccc(cc1)C(=O)C1C(N(CCN2CCNCC2)C(=O)C1=O)c1ccccc1F
COC(=O)c1c(NC(=O)CC2Nc3ccccc3NC2=O)sc2CCCCc12
COc1cc(ccc1OCC(O)=O)C(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12
CCOC(=O)c1c(NC(=O)CC2Sc3ccc(cc3NC2=O)C(F)(F)F)sc2CCCCc12
NCCCCCCNC(=O)c1c(O)c2ccccc2oc1=O
CN(C)CCCN1C(C(C(=O)c2cccs2)C(=O)C1=O)c1cccs1
COCCCNS(=O)(=O)c1ccc(Oc2cc(O)c3C(=O)c4ccccc4C(=O)c3c2O)cc1
OC(=O)CCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(F)cc1
CCOC(=O)c1c(O)c(=Cc2ccc(CNC(=O)C(=O)Nc3ccccc3)o2)[nH]c1=C |w:9.9|
COc1ccc(C2C(C(=O)c3ccco3)C(=O)C(=O)N2CCN2CCOCC2)c(OC)c1
OC(=O)CCC(=O)Nc1ccc(Cl)c(NC(=O)Cc2ccccc2)c1
CCN(CC)CCN1C(C(C(=O)c2ccccc2)C(=O)C1=O)c1ccc(OC)cc1OC
CN(C)CCN1C(C(C(=O)c2ccc(C)cc2)C(=O)C1=O)c1ccccc1F
NCCCNc1ccc2n(CCNCCO)nc3-c4c(O)ccc(O)c4C(=O)c1c23
OCCN(CCO)Cc1c(O)ccc2cc(C3=NC4C=CC=CC4S3)c(=O)oc12 |c:19,21,t:16|
Oc1ccc(cc1O)C(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12
COc1ccc(cc1OC)C1C(C(=O)c2ccccc2)C(=O)C(=O)N1CCCO
CCOC(=O)c1c(C)c(sc1NC(=O)c1cc2ccccc2oc1=O)C(N)=O
OCCCNC(=O)c1ccc(CSc2nc3sc4CCCc4c3c(=O)[nH]2)cc1
CCOC(=O)C(=O)CC(=O)c1ccc2n(Cc3ccc(F)cc3)cc(C(=O)CC(=O)C(=O)OCC)c(=O)c2c1
CCOC(=O)C(=O)CC(=O)c1ccc2ncc(C(=O)CC(=O)C(=O)OCC)c(O)c2c1
OC(=O)C(=O)CC(=O)c1ccc2ncc(C(=O)CC(=O)C(O)=O)c(O)c2c1
CN(CCN(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12)C(C)=O
CN1CCN(CC1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
CN(C(=O)C(=O)N1CCCC1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
CN(C(=O)C(N)=O)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
CN(C(=O)C(=O)N1CCCCC1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
CN(C)C(=O)CN(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
CN(C(C)=O)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
CNC(=O)C(=O)N(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
CN(C)C(=O)C(=O)N(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
CC(=O)N1CCN(CC1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
CCN1CCN(C(=O)C1=O)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
COc1c2c(C(=O)N(Cc3ccc(F)cc3)C22CC2)c(O)c2ncccc12
CN(C)S(=O)(=O)Oc1c2c(C(=O)N(Cc3ccc(F)cc3)C22CC2)c(O)c2ncccc12
COc1c2C(=C)N(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
COc1c2C(C)N(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
COC(=O)CCSC1N(Cc2ccc(F)cc2)C(=O)c2c1c(OC)c1cccnc1c2O
CN(C)S(=O)(=O)Oc1c2C(=C)N(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
COc1c2C(SCCC(O)=O)N(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
Oc1c2C(=O)N(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
COc1c2C(SCCC(=O)N3CCNCC3)N(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
COC1N(Cc2ccc(F)cc2)C(=O)c2c1c(OC)c1cccnc1c2O
COc1c2c(C(=O)N(Cc3ccc(F)cc3)C2(C)C)c(O)c2ncccc12
CC1N(Cc2ccc(F)cc2)C(=O)c2c1c(OS(=O)(=O)N(C)C)c1cccnc1c2O
COc1c2C(O)N(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
COc1c2CN(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncc(F)cc12
COc1c2CN(Cc3ccc(F)cc3)C(=O)c2c(O)c2nccnc12
CN(C)S(=O)(=O)Oc1c2CN(Cc3ccc(F)cc3)C(=O)c2c(O)c2nccnc12
COc1c2CN(Cc3ccc(F)cc3)C(=O)c2c(O)c2NCCNc12
COc1c2CN(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncn(Cc3ccccc3)c12
CC[C@@H](CCCCc1cn(nn1)[C@@H]1[C@@H](CO)O[C@H]([C@H](O)[C@H]1O)n1cc(nn1)-c1ccc(cc1)-c1cn(nn1)[C@@H]1O[C@H](CO)[C@H]([C@H](O)[C@H]1O)n1cc(nn1)-c1cc(O)c(cc1O)-c1cn(nn1)[C@@H]1O[C@H](CO)[C@H]([C@H](O)[C@H]1O)n1cc(nn1)-c1ccc(cc1)-c1cn(nn1)[C@@H]1O[C@H](CO)[C@H]([C@H](O)[C@H]1O)n1cc(CCCC[C@H](CC)O[C@@H]2OC(=C[C@H](O)[C@H]2NC(C)=O)C(O)=O)nn1)O[C@@H]1OC(=C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:129,148|
COC(=O)C(=O)CC(=O)c1cccn1Cc1ccc(F)cc1
COC(=O)C(=O)CC(=O)c1ccccc1
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H](N)Cc1cnc[nH]1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1cnc[nH]1)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(N)=O
CC(C)C[C@@H](NC(=O)[C@@H](C)NC(=O)CNC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@H](CCCCN)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@H](C)C(=O)N[C@H]([C@H](C)O)C(O)=O |wU:17.24,43.44,8.8,79.81,96.99,97.102,60.61,wD:28.28,68.69,4.4,52.53,91.95,(-.45,4.21,;-.45,2.68,;.88,1.91,;-1.78,1.91,;-1.78,.37,;-3.11,-.39,;-4.45,.37,;-4.45,1.91,;-5.78,-.39,;-5.78,-1.93,;-7.12,.37,;-8.46,-.39,;-8.46,-1.94,;-9.78,.37,;-11.12,-.39,;-12.46,.37,;-12.46,1.91,;-13.8,-.39,;-13.8,-1.94,;-12.46,-2.71,;-12.46,-4.24,;-11.13,-5.01,;-11.13,-6.54,;-9.8,-7.31,;-12.47,-7.31,;-15.13,.37,;-16.47,-.39,;-16.47,-1.94,;-17.81,.37,;-19.15,-.39,;-17.81,1.91,;-16.47,2.69,;-15,2.22,;-14.09,3.47,;-15.01,4.71,;-14.68,6.2,;-15.82,7.24,;-17.29,6.75,;-17.61,5.26,;-16.47,4.24,;-.44,-.39,;-.44,-1.94,;.89,.37,;2.22,-.39,;2.22,-1.94,;3.56,-2.71,;3.56,-4.25,;4.89,-5.02,;4.89,-6.56,;3.56,.37,;3.56,1.91,;4.89,-.39,;6.23,.37,;6.23,1.91,;7.57,2.69,;8.9,1.92,;7.56,4.22,;7.57,-.39,;7.57,-1.94,;8.9,.37,;10.24,-.39,;10.24,-1.94,;11.57,-2.71,;11.56,-4.24,;12.9,-1.95,;11.57,.37,;11.57,1.91,;12.9,-.39,;14.24,.37,;14.24,1.91,;15.57,2.69,;16.91,1.91,;18.24,2.68,;18.24,4.22,;16.9,4.99,;15.57,4.22,;15.57,-.39,;15.58,-1.94,;16.91,.37,;18.24,-.41,;18.23,-1.94,;19.55,-2.72,;19.53,-4.25,;20.85,-5.02,;22.19,-4.26,;23.51,-5.04,;22.19,-2.72,;20.88,-1.96,;19.57,.35,;19.58,1.88,;20.89,-.43,;22.22,.33,;22.23,1.86,;23.55,-.44,;23.54,-1.98,;24.88,.31,;26.2,-.46,;26.19,-1.99,;24.86,-2.75,;27.51,-2.77,;27.53,.3,;28.86,-.48,;27.55,1.83,)|
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C)C(O)=O
CC[C@@H](C)[C@@H](NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](CS)NC(=O)[C@@H](C)N)C(=O)N[C@H](CCCCN)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@H](CCC(O)=O)C(=O)N[C@H](Cc1ccccc1)C(O)=O
NCCCC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CCC(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
[#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6@@H](-[#6])-[#8])-[#6](-[#7])=O
CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(N)=O |wU:38.39,20.20,8.8,58.60,2.2,wD:49.51,4.4,30.31,69.71,(-1.78,-27.25,;-1.78,-25.71,;-.44,-24.94,;.89,-25.71,;-.44,-23.4,;-1.78,-22.63,;-3.11,-23.4,;-3.11,-24.94,;-4.44,-22.63,;-5.78,-23.4,;-4.44,-21.09,;-3.11,-20.32,;-1.78,-21.09,;-.44,-20.32,;-.44,-18.78,;-1.79,-18.01,;-3.11,-18.78,;.89,-22.63,;.89,-21.09,;2.22,-23.4,;3.56,-22.63,;3.56,-21.09,;4.89,-20.32,;6.35,-20.8,;7.27,-19.56,;6.38,-18.31,;4.91,-18.77,;4.89,-23.4,;4.89,-24.94,;6.22,-22.63,;7.56,-23.4,;7.56,-24.94,;8.89,-25.71,;10.23,-24.94,;8.89,-27.25,;8.89,-22.63,;8.89,-21.09,;10.23,-23.4,;11.56,-22.63,;11.56,-21.09,;12.89,-20.32,;14.22,-21.1,;15.56,-20.33,;15.56,-18.79,;14.22,-18.02,;12.89,-18.79,;12.89,-23.4,;12.89,-24.94,;14.23,-22.63,;15.56,-23.4,;15.56,-24.94,;16.89,-25.71,;16.89,-27.25,;18.23,-28.02,;18.23,-29.56,;16.89,-22.63,;16.89,-21.09,;18.23,-23.4,;19.56,-22.63,;19.56,-21.09,;20.9,-20.32,;20.9,-18.78,;22.23,-18.01,;22.23,-16.47,;23.56,-15.7,;20.9,-15.7,;20.9,-23.4,;20.9,-24.94,;22.23,-22.63,;23.56,-23.4,;23.56,-24.94,;24.9,-25.71,;24.9,-27.25,;26.23,-28.02,;26.23,-29.56,;24.9,-22.63,;26.23,-23.4,;24.9,-21.09,)|
CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(N)=O |wU:60.61,8.15,68.68,27.28,41.46,wD:32.38,4.4,49.57,77.77,78.80,18.24,(20.85,-25.96,;20.85,-24.42,;22.18,-23.65,;19.51,-23.65,;19.51,-22.11,;18.18,-21.34,;16.85,-22.11,;16.85,-23.65,;15.51,-21.34,;15.51,-19.8,;16.85,-19.02,;18.31,-19.48,;19.21,-18.22,;18.29,-16.98,;16.83,-17.47,;14.18,-22.11,;12.84,-21.34,;12.84,-19.8,;11.51,-22.11,;11.51,-23.65,;12.84,-24.42,;12.84,-25.96,;11.51,-26.73,;14.18,-26.73,;10.18,-21.34,;8.84,-22.11,;8.84,-23.65,;7.51,-21.34,;7.51,-19.8,;6.18,-22.11,;4.84,-21.34,;4.84,-19.8,;3.51,-22.11,;3.51,-23.65,;4.84,-24.42,;4.84,-25.96,;3.51,-26.73,;6.18,-26.73,;2.18,-21.34,;.84,-22.11,;.84,-23.65,;-.49,-21.34,;-.49,-19.8,;.84,-19.03,;2.18,-19.79,;.85,-17.48,;-1.83,-22.11,;-3.16,-21.34,;-3.16,-19.8,;-4.49,-22.11,;-4.49,-23.65,;-3.16,-24.42,;-3.16,-25.96,;-1.83,-26.73,;-1.83,-28.27,;-.49,-29.04,;-3.16,-29.04,;-5.83,-21.34,;-7.16,-22.11,;-7.16,-23.65,;-8.49,-21.34,;-9.83,-22.11,;-8.49,-19.8,;-7.16,-19.03,;-9.83,-19.03,;20.85,-21.34,;20.85,-19.8,;22.18,-22.11,;23.51,-21.34,;23.51,-19.8,;24.85,-19.03,;24.85,-17.49,;26.18,-16.72,;26.18,-15.18,;24.85,-22.11,;24.85,-23.65,;26.18,-21.34,;27.51,-22.11,;27.51,-23.65,;26.18,-24.42,;28.85,-24.42,;28.85,-21.34,;30.18,-22.11,;28.85,-19.8,)|
[#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](-[#7])=O
CC(C)C[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:27.26,18.18,8.8,wD:38.37,4.4,(-10.21,-17.79,;-10.21,-16.25,;-8.88,-15.48,;-11.55,-15.48,;-11.55,-13.94,;-12.89,-13.17,;-14.23,-13.94,;-14.23,-15.48,;-15.56,-13.17,;-16.9,-13.94,;-15.56,-11.63,;-14.23,-10.86,;-14.23,-9.32,;-12.89,-8.55,;-12.89,-7.01,;-10.21,-13.17,;-10.21,-11.63,;-8.88,-13.94,;-7.54,-13.17,;-7.54,-11.63,;-6.21,-13.94,;-6.21,-15.48,;-4.87,-13.17,;-3.54,-13.94,;-2.21,-13.17,;-2.21,-11.63,;-.88,-13.94,;.46,-13.17,;.46,-11.63,;1.79,-10.86,;1.79,-9.32,;3.12,-8.55,;3.12,-7.01,;4.46,-6.24,;1.79,-6.24,;1.79,-13.94,;1.79,-15.48,;3.12,-13.17,;4.46,-13.94,;4.46,-15.48,;5.79,-16.25,;7.29,-15.84,;8.12,-17.14,;7.15,-18.33,;7.4,-19.84,;6.2,-20.81,;4.76,-20.25,;4.53,-18.73,;5.72,-17.77,;5.79,-13.17,;7.13,-13.93,;5.8,-11.62,)|
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(N)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCC(O)=O)C(N)=O
CC(C)C[C@@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](C)NC(=O)[C@H](N)[C@H](C)O)C(=O)N[C@H](C)C(=O)NCC(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(O)=O |wU:33.41,4.4,56.58,89.90,17.21,wD:8.13,44.54,69.71,63.66,25.29,78.79,61.63,(20.57,-24.53,;20.57,-22.99,;21.9,-22.22,;19.23,-22.22,;19.23,-20.68,;17.9,-19.91,;16.56,-20.68,;16.56,-22.22,;15.23,-19.91,;15.23,-18.37,;16.56,-17.6,;16.56,-16.06,;17.9,-15.29,;17.9,-13.75,;13.9,-20.68,;12.56,-19.91,;12.56,-18.37,;11.23,-20.68,;11.23,-22.22,;12.56,-22.99,;12.56,-24.53,;13.9,-22.22,;9.9,-19.91,;8.56,-20.68,;8.56,-22.22,;7.23,-19.91,;7.23,-18.37,;8.56,-17.6,;9.9,-18.37,;8.56,-16.06,;5.89,-20.68,;4.56,-19.91,;4.56,-18.37,;3.23,-20.68,;3.23,-22.22,;4.56,-22.99,;4.56,-24.53,;5.89,-25.3,;7.23,-24.53,;7.22,-22.98,;5.89,-22.22,;1.89,-19.91,;.56,-20.68,;.56,-22.22,;-.77,-19.91,;-.77,-18.37,;.56,-17.6,;1.89,-18.37,;3.23,-17.61,;3.23,-16.06,;4.56,-15.29,;1.88,-15.29,;.56,-16.07,;-2.11,-20.68,;-3.44,-19.91,;-3.44,-18.37,;-4.78,-20.68,;-4.78,-22.22,;-6.11,-19.91,;-7.44,-20.68,;-7.44,-22.22,;-8.79,-19.91,;-10.1,-20.68,;-8.79,-18.37,;-10.1,-17.6,;-7.44,-17.6,;20.57,-19.91,;20.57,-18.37,;21.9,-20.68,;23.23,-19.91,;23.23,-18.37,;24.57,-20.68,;24.57,-22.22,;25.91,-19.91,;27.23,-20.68,;28.57,-19.91,;28.57,-18.37,;29.9,-20.68,;31.23,-19.91,;31.23,-18.37,;32.57,-17.6,;32.57,-16.06,;33.9,-15.29,;33.9,-13.75,;35.24,-12.98,;32.57,-12.98,;32.57,-20.68,;32.57,-22.22,;33.9,-19.91,;35.24,-20.68,;35.24,-22.22,;36.57,-22.99,;38.06,-22.59,;38.9,-23.88,;37.93,-25.07,;38.18,-26.58,;36.98,-27.55,;35.54,-26.99,;35.3,-25.48,;36.5,-24.52,;36.57,-19.91,;37.91,-20.67,;36.58,-18.36,)|
C[C@H](N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)NCC(N)=O
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(N)=O
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(N)=O
CC(C)C[C@@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](C)NC(=O)[C@H](N)[C@H](C)O)C(=O)N[C@H](C)C(=O)NCC(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:33.41,4.4,56.58,89.90,17.21,wD:8.13,44.54,69.71,63.66,25.29,78.79,61.63,(20.57,-24.53,;20.57,-22.99,;21.9,-22.22,;19.23,-22.22,;19.23,-20.68,;17.9,-19.91,;16.56,-20.68,;16.56,-22.22,;15.23,-19.91,;15.23,-18.37,;16.56,-17.6,;16.56,-16.06,;17.9,-15.29,;17.9,-13.75,;13.9,-20.68,;12.56,-19.91,;12.56,-18.37,;11.23,-20.68,;11.23,-22.22,;12.56,-22.99,;12.56,-24.53,;13.9,-22.22,;9.9,-19.91,;8.56,-20.68,;8.56,-22.22,;7.23,-19.91,;7.23,-18.37,;8.56,-17.6,;9.9,-18.37,;8.56,-16.06,;5.89,-20.68,;4.56,-19.91,;4.56,-18.37,;3.23,-20.68,;3.23,-22.22,;4.56,-22.99,;4.56,-24.53,;5.89,-25.3,;7.23,-24.53,;7.22,-22.98,;5.89,-22.22,;1.89,-19.91,;.56,-20.68,;.56,-22.22,;-.77,-19.91,;-.77,-18.37,;.56,-17.6,;1.89,-18.37,;3.23,-17.61,;3.23,-16.06,;4.56,-15.29,;1.88,-15.29,;.56,-16.07,;-2.11,-20.68,;-3.44,-19.91,;-3.44,-18.37,;-4.78,-20.68,;-4.78,-22.22,;-6.11,-19.91,;-7.44,-20.68,;-7.44,-22.22,;-8.79,-19.91,;-10.1,-20.68,;-8.79,-18.37,;-10.1,-17.6,;-7.44,-17.6,;20.57,-19.91,;20.57,-18.37,;21.9,-20.68,;23.23,-19.91,;23.23,-18.37,;24.57,-20.68,;24.57,-22.22,;25.91,-19.91,;27.23,-20.68,;28.57,-19.91,;28.57,-18.37,;29.9,-20.68,;31.23,-19.91,;31.23,-18.37,;32.57,-17.6,;32.57,-16.06,;33.9,-15.29,;33.9,-13.75,;35.24,-12.98,;32.57,-12.98,;32.57,-20.68,;32.57,-22.22,;33.9,-19.91,;35.24,-20.68,;35.24,-22.22,;36.57,-22.99,;38.06,-22.59,;38.9,-23.88,;37.93,-25.07,;38.18,-26.58,;36.98,-27.55,;35.54,-26.99,;35.3,-25.48,;36.5,-24.52,;36.57,-19.91,;37.91,-20.67,;36.58,-18.36,)|
C[C@@H](O)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(N)=O
CC(C)[C@H](N)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:55.56,44.47,25.29,63.64,72.72,57.59,8.13,wD:4.4,33.41,17.21,83.83,50.51,(20.16,-6.59,;20.16,-5.05,;21.5,-4.28,;18.83,-4.28,;18.83,-2.74,;17.49,-1.97,;16.16,-2.74,;16.16,-4.28,;14.83,-1.97,;14.83,-.43,;16.16,.34,;16.16,1.88,;17.49,2.65,;17.49,4.19,;13.49,-2.74,;12.16,-1.97,;12.16,-.43,;10.82,-2.74,;10.82,-4.28,;12.16,-5.05,;12.16,-6.59,;13.49,-4.28,;9.49,-1.97,;8.15,-2.74,;8.15,-4.28,;6.82,-1.97,;6.82,-.43,;8.15,.34,;9.49,-.43,;8.15,1.88,;5.49,-2.74,;4.16,-1.97,;4.16,-.43,;2.82,-2.74,;2.82,-4.28,;4.16,-5.05,;4.16,-6.6,;5.48,-7.36,;6.82,-6.6,;6.81,-5.05,;5.49,-4.28,;1.49,-1.97,;.15,-2.74,;.15,-4.28,;-1.18,-1.97,;-1.18,-.43,;.15,.33,;-2.52,-2.74,;-3.85,-1.97,;-3.85,-.43,;-5.19,-2.74,;-5.19,-4.28,;-6.51,-1.97,;-7.85,-2.74,;-7.85,-4.28,;-9.18,-1.97,;-10.52,-2.74,;-9.18,-.43,;-10.52,.34,;-7.85,.34,;20.16,-1.97,;20.16,-.43,;21.5,-2.74,;22.83,-1.97,;22.83,-.43,;24.17,-2.74,;24.17,-4.28,;25.5,-1.97,;26.83,-2.74,;28.16,-1.97,;28.16,-.43,;29.5,-2.74,;30.83,-1.97,;30.83,-.43,;32.17,.34,;32.17,1.88,;33.5,2.65,;33.5,4.19,;34.84,4.96,;32.17,4.96,;32.17,-2.74,;32.17,-4.28,;33.5,-1.97,;34.84,-2.74,;34.84,-4.28,;36.16,-5.06,;37.66,-4.65,;38.5,-5.94,;37.53,-7.14,;37.77,-8.65,;36.58,-9.61,;35.14,-9.06,;34.9,-7.54,;36.09,-6.58,;36.16,-1.97,;37.5,-2.73,;36.17,-.43,)|
CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:4.4,35.45,68.70,54.57,16.20,77.78,52.54,wD:24.32,2.2,60.61,47.49,88.89,8.12,(18.96,-16.38,;18.96,-17.91,;20.29,-18.68,;21.61,-17.9,;20.29,-20.22,;18.95,-20.98,;17.62,-20.22,;17.62,-18.68,;16.28,-20.98,;16.28,-22.52,;17.62,-23.3,;17.62,-24.84,;18.95,-22.52,;14.95,-20.22,;13.61,-20.98,;13.61,-22.52,;12.28,-20.22,;12.28,-18.68,;13.61,-17.9,;14.95,-18.68,;13.61,-16.36,;10.94,-20.98,;9.62,-20.22,;9.62,-18.68,;8.28,-20.98,;8.28,-22.52,;9.62,-23.3,;9.61,-24.84,;10.94,-25.6,;12.28,-24.84,;12.27,-23.29,;10.94,-22.52,;6.95,-20.22,;5.61,-20.98,;5.61,-22.52,;4.28,-20.22,;4.28,-18.68,;5.61,-17.9,;6.95,-18.68,;8.28,-17.91,;8.28,-16.37,;9.61,-15.6,;6.94,-15.6,;5.61,-16.37,;2.94,-20.98,;1.61,-20.22,;1.61,-18.68,;.27,-20.98,;.27,-22.52,;-1.05,-20.22,;-2.39,-20.98,;-2.39,-22.52,;-3.72,-20.22,;-5.06,-20.98,;-3.72,-18.68,;-5.06,-17.9,;-2.39,-17.9,;21.61,-20.98,;21.61,-22.52,;22.95,-20.22,;24.28,-20.98,;24.28,-22.52,;25.62,-23.3,;25.62,-24.84,;26.95,-22.52,;25.62,-20.22,;25.62,-18.68,;26.95,-20.98,;28.29,-20.22,;28.29,-18.68,;29.62,-20.98,;29.62,-22.52,;30.96,-20.22,;32.29,-20.98,;33.62,-20.22,;33.62,-18.68,;34.96,-20.98,;36.29,-20.22,;36.29,-18.68,;37.63,-17.9,;37.63,-16.36,;38.96,-15.6,;38.96,-14.05,;40.29,-13.28,;37.63,-13.28,;37.63,-20.98,;37.63,-22.52,;38.96,-20.22,;40.29,-20.98,;40.29,-22.52,;41.62,-23.3,;43.12,-22.9,;43.96,-24.18,;42.98,-25.38,;43.23,-26.89,;42.04,-27.86,;40.59,-27.3,;40.36,-25.78,;41.55,-24.82,;41.62,-20.22,;42.96,-20.98,;41.63,-18.67,)|
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |wU:8.13,44.54,69.71,63.66,25.29,78.79,61.63,wD:33.41,4.4,56.58,89.90,17.21,(22.84,-19.95,;22.84,-18.4,;24.18,-17.63,;21.51,-17.63,;21.51,-16.09,;20.17,-15.32,;18.84,-16.09,;18.84,-17.63,;17.51,-15.32,;17.51,-13.78,;18.84,-13.01,;18.84,-11.47,;20.17,-10.7,;20.17,-9.16,;16.18,-16.09,;14.84,-15.32,;14.84,-13.78,;13.51,-16.09,;13.51,-17.63,;14.84,-18.4,;14.84,-19.95,;16.18,-17.63,;12.17,-15.32,;10.84,-16.09,;10.84,-17.63,;9.5,-15.32,;9.5,-13.78,;10.84,-13.01,;12.17,-13.78,;10.84,-11.47,;8.17,-16.09,;6.84,-15.32,;6.84,-13.78,;5.5,-16.09,;5.5,-17.63,;6.84,-18.4,;6.84,-19.95,;8.16,-20.71,;9.5,-19.95,;9.49,-18.4,;8.17,-17.63,;4.17,-15.32,;2.83,-16.09,;2.83,-17.63,;1.5,-15.32,;1.5,-13.78,;2.83,-13.01,;4.17,-13.79,;5.5,-13.02,;5.5,-11.48,;6.84,-10.71,;4.16,-10.71,;2.83,-11.48,;.16,-16.09,;-1.17,-15.32,;-1.17,-13.78,;-2.51,-16.09,;-2.51,-17.63,;-3.83,-15.32,;-5.17,-16.09,;-5.17,-17.63,;-6.5,-15.32,;-7.84,-16.09,;-6.5,-13.78,;-7.84,-13.01,;-5.17,-13.01,;22.84,-15.32,;22.84,-13.78,;24.18,-16.09,;25.51,-15.32,;25.51,-13.78,;26.85,-16.09,;26.85,-17.63,;28.18,-15.32,;29.51,-16.09,;30.84,-15.32,;30.84,-13.78,;32.18,-16.09,;33.51,-15.32,;33.51,-13.78,;34.85,-13.01,;34.85,-11.47,;36.18,-10.7,;36.18,-9.16,;37.52,-8.39,;34.85,-8.39,;34.85,-16.09,;34.85,-17.63,;36.18,-15.32,;37.52,-16.09,;37.52,-17.63,;38.84,-18.41,;40.34,-18,;41.18,-19.29,;40.21,-20.49,;40.45,-22,;39.26,-22.96,;37.82,-22.41,;37.58,-20.89,;38.77,-19.93,;38.84,-15.32,;40.18,-16.09,;38.85,-13.78,)|
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
[#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](-[#8])=O
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |wU:8.13,44.54,69.71,63.66,25.29,79.80,61.63,wD:33.41,4.4,56.58,90.91,17.21,74.76,(20.71,-24.44,;20.71,-22.9,;22.04,-22.13,;19.37,-22.13,;19.37,-20.59,;18.04,-19.82,;16.7,-20.59,;16.7,-22.13,;15.38,-19.82,;15.38,-18.28,;16.7,-17.51,;16.7,-15.97,;18.04,-15.2,;18.04,-13.67,;14.04,-20.59,;12.71,-19.82,;12.71,-18.28,;11.37,-20.59,;11.37,-22.13,;12.71,-22.9,;12.71,-24.44,;14.04,-22.13,;10.04,-19.82,;8.7,-20.59,;8.7,-22.13,;7.37,-19.82,;7.37,-18.28,;8.7,-17.51,;10.04,-18.28,;8.7,-15.97,;6.04,-20.59,;4.71,-19.82,;4.71,-18.28,;3.37,-20.59,;3.37,-22.13,;4.71,-22.9,;4.71,-24.44,;6.03,-25.21,;7.37,-24.44,;7.36,-22.9,;6.04,-22.13,;2.04,-19.82,;.7,-20.59,;.7,-22.13,;-.63,-19.82,;-.63,-18.28,;.7,-17.51,;2.04,-18.29,;3.37,-17.52,;3.37,-15.97,;4.71,-15.21,;2.03,-15.21,;.7,-15.98,;-1.97,-20.59,;-3.3,-19.82,;-3.3,-18.28,;-4.63,-20.59,;-4.63,-22.13,;-5.96,-19.82,;-7.3,-20.59,;-7.3,-22.13,;-8.63,-19.82,;-9.97,-20.59,;-8.63,-18.28,;-9.97,-17.51,;-7.3,-17.51,;20.71,-19.82,;20.71,-18.28,;22.04,-20.59,;23.38,-19.82,;23.38,-18.28,;24.71,-20.59,;24.71,-22.13,;26.05,-19.82,;27.37,-20.59,;27.37,-22.12,;28.71,-19.82,;28.71,-18.28,;30.04,-20.59,;31.38,-19.82,;31.38,-18.28,;32.71,-17.51,;32.71,-15.97,;34.05,-15.2,;34.05,-13.67,;35.38,-12.87,;32.71,-12.87,;32.71,-20.59,;32.71,-22.13,;34.05,-19.82,;35.38,-20.59,;35.38,-22.13,;36.71,-22.9,;38.2,-22.5,;39.05,-23.79,;38.07,-24.98,;38.31,-26.49,;37.12,-27.46,;35.68,-26.9,;35.45,-25.38,;36.64,-24.43,;36.71,-19.82,;38.05,-20.58,;36.72,-18.28,)|
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |wU:58.60,8.13,41.51,66.68,60.63,22.26,75.76,wD:30.38,4.4,53.55,86.87,17.17,(21.53,-25.24,;21.53,-23.7,;22.87,-22.93,;20.2,-22.93,;20.2,-21.39,;18.86,-20.62,;17.53,-21.39,;17.53,-22.93,;16.2,-20.62,;16.2,-19.08,;17.53,-18.31,;17.53,-16.77,;18.86,-16,;18.86,-14.46,;14.87,-21.39,;13.53,-20.62,;13.53,-19.08,;12.2,-21.39,;12.2,-22.93,;10.86,-20.62,;9.53,-21.39,;9.53,-22.93,;8.19,-20.62,;8.19,-19.08,;9.53,-18.31,;10.86,-19.08,;9.53,-16.77,;6.86,-21.39,;5.53,-20.62,;5.53,-19.08,;4.2,-21.39,;4.2,-22.93,;5.53,-23.7,;5.53,-25.25,;6.86,-26.01,;8.19,-25.24,;8.19,-23.7,;6.86,-22.93,;2.86,-20.62,;1.53,-21.39,;1.53,-22.93,;.19,-20.62,;.19,-19.08,;1.53,-18.31,;2.86,-19.09,;4.2,-18.32,;4.2,-16.77,;5.53,-16.01,;2.85,-16.01,;1.52,-16.78,;-1.14,-21.39,;-2.48,-20.62,;-2.48,-19.08,;-3.81,-21.39,;-3.81,-22.93,;-5.14,-20.62,;-6.47,-21.39,;-6.47,-22.93,;-7.81,-20.62,;-9.14,-21.39,;-7.81,-19.08,;-9.14,-18.31,;-6.47,-18.31,;21.53,-20.62,;21.53,-19.08,;22.87,-21.39,;24.2,-20.62,;24.2,-19.08,;25.54,-21.39,;25.54,-22.93,;26.87,-20.62,;28.2,-21.39,;29.53,-20.62,;29.53,-19.08,;30.87,-21.39,;32.2,-20.62,;32.2,-19.08,;33.54,-18.31,;33.54,-16.77,;34.87,-16,;34.87,-14.46,;36.21,-13.69,;33.54,-13.69,;33.54,-21.39,;33.54,-22.93,;34.87,-20.62,;36.21,-21.39,;36.21,-22.93,;37.53,-23.7,;39.03,-23.3,;39.87,-24.59,;38.9,-25.79,;39.14,-27.3,;37.95,-28.26,;36.51,-27.7,;36.27,-26.18,;37.46,-25.23,;37.53,-20.62,;38.87,-21.38,;37.54,-19.08,)|
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |wU:61.64,8.13,67.69,25.29,76.77,44.54,wD:4.4,56.58,17.21,87.88,33.41,(23.58,-.98,;23.58,.56,;24.92,1.34,;22.25,1.34,;22.25,2.88,;20.91,3.64,;19.58,2.88,;19.58,1.34,;18.25,3.64,;18.25,5.18,;19.58,5.96,;19.58,7.5,;20.91,8.28,;20.91,9.82,;16.92,2.88,;15.58,3.64,;15.58,5.18,;14.25,2.88,;14.25,1.34,;15.58,.56,;15.58,-.98,;16.92,1.34,;12.91,3.64,;11.58,2.88,;11.58,1.34,;10.24,3.64,;10.24,5.18,;11.58,5.96,;12.91,5.18,;11.58,7.5,;8.91,2.88,;7.58,3.64,;7.58,5.18,;6.24,2.88,;6.24,1.34,;7.58,.56,;7.58,-.98,;8.9,-1.75,;10.24,-.98,;10.23,.57,;8.91,1.34,;4.91,3.64,;3.57,2.88,;3.57,1.34,;2.24,3.64,;2.24,5.18,;3.57,5.96,;4.91,5.18,;6.24,5.95,;6.24,7.49,;7.58,8.27,;4.9,8.27,;3.57,7.49,;.9,2.88,;-.43,3.64,;-.43,5.18,;-1.77,2.88,;-1.77,1.34,;-3.09,3.64,;-4.43,2.88,;-4.43,1.34,;-5.76,3.64,;-5.76,5.18,;-7.1,2.88,;23.58,3.64,;23.58,5.18,;24.92,2.88,;26.25,3.64,;26.25,5.18,;27.59,2.88,;27.59,1.34,;28.92,3.64,;30.25,2.88,;31.58,3.64,;31.58,5.18,;32.92,2.88,;34.25,3.64,;34.25,5.18,;35.59,5.96,;35.59,7.5,;36.92,8.28,;36.92,9.82,;38.26,10.59,;35.59,10.59,;35.59,2.88,;35.59,1.34,;36.92,3.64,;38.26,2.88,;38.26,1.34,;39.58,.56,;41.08,.96,;41.92,-.32,;40.95,-1.52,;41.19,-3.03,;40,-4,;38.56,-3.44,;38.32,-1.92,;39.51,-.97,;39.58,3.64,;40.92,2.88,;39.59,5.19,)|
CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |wU:41.43,49.50,24.34,66.68,43.46,75.76,8.8,wD:13.21,58.59,4.4,36.38,86.87,(12.27,-24.06,;12.27,-22.52,;13.61,-21.74,;10.94,-21.74,;10.94,-20.2,;9.6,-19.44,;8.27,-20.2,;8.27,-21.74,;6.93,-19.44,;6.93,-17.9,;5.6,-20.2,;4.27,-19.44,;4.27,-17.9,;2.94,-20.2,;2.94,-21.74,;4.27,-22.52,;4.27,-24.06,;5.59,-24.83,;6.93,-24.06,;6.93,-22.51,;5.6,-21.74,;1.6,-19.44,;.27,-20.2,;.27,-21.74,;-1.07,-19.44,;-1.07,-17.9,;.27,-17.12,;1.6,-17.9,;2.94,-17.13,;2.94,-15.59,;4.27,-14.82,;1.59,-14.82,;.26,-15.59,;-2.4,-20.2,;-3.74,-19.44,;-3.74,-17.9,;-5.07,-20.2,;-5.07,-21.74,;-6.4,-19.44,;-7.73,-20.2,;-7.73,-21.74,;-9.07,-19.44,;-10.4,-20.2,;-9.07,-17.9,;-10.4,-17.12,;-7.73,-17.12,;12.27,-19.44,;12.27,-17.9,;13.61,-20.2,;14.94,-19.44,;14.94,-17.9,;16.27,-17.12,;16.27,-15.58,;17.6,-14.82,;17.6,-13.28,;16.27,-20.2,;16.27,-21.74,;17.6,-19.44,;18.94,-20.2,;18.94,-21.74,;20.27,-22.52,;20.27,-24.06,;21.61,-21.74,;20.27,-19.44,;20.27,-17.9,;21.61,-20.2,;22.94,-19.44,;22.94,-17.9,;24.28,-20.2,;24.28,-21.74,;25.61,-19.44,;26.94,-20.2,;28.27,-19.44,;28.27,-17.9,;29.61,-20.2,;30.94,-19.44,;30.94,-17.9,;32.28,-17.12,;32.28,-15.58,;33.61,-14.82,;33.61,-13.28,;34.95,-12.51,;32.28,-12.51,;32.28,-20.2,;32.28,-21.74,;33.61,-19.44,;34.95,-20.2,;34.95,-21.74,;36.27,-22.52,;37.77,-22.12,;38.61,-23.4,;37.63,-24.6,;37.88,-26.11,;36.69,-27.08,;35.25,-26.52,;35.01,-25,;36.2,-24.05,;36.27,-19.44,;37.61,-20.2,;36.28,-17.89,)|
[#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@@H](-[#7])-[#6](-[#6])-[#6])-[#6](-[#7])=O
CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
C[C@H](N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |wU:57.59,8.8,40.50,65.67,59.62,74.75,21.25,wD:29.37,4.4,85.86,52.54,13.17,(23.29,-25.1,;23.29,-23.56,;24.62,-22.78,;21.95,-22.78,;21.95,-21.24,;20.62,-20.48,;19.28,-21.24,;19.28,-22.78,;17.96,-20.48,;17.96,-18.94,;16.62,-21.24,;15.29,-20.48,;15.29,-18.94,;13.95,-21.24,;13.95,-22.78,;15.29,-23.56,;15.29,-25.1,;16.62,-22.78,;12.62,-20.48,;11.28,-21.24,;11.28,-22.78,;9.95,-20.48,;9.95,-18.94,;11.28,-18.16,;12.62,-18.94,;11.28,-16.62,;8.61,-21.24,;7.29,-20.48,;7.29,-18.94,;5.95,-21.24,;5.95,-22.78,;7.29,-23.56,;7.28,-25.1,;8.61,-25.87,;9.95,-25.1,;9.94,-23.55,;8.61,-22.78,;4.62,-20.48,;3.28,-21.24,;3.28,-22.78,;1.95,-20.48,;1.95,-18.94,;3.28,-18.16,;4.62,-18.94,;5.95,-18.17,;5.95,-16.63,;7.28,-15.86,;4.61,-15.86,;3.28,-16.63,;.61,-21.24,;-.72,-20.48,;-.72,-18.94,;-2.06,-21.24,;-2.06,-22.78,;-3.38,-20.48,;-4.72,-21.24,;-4.72,-22.78,;-6.05,-20.48,;-7.39,-21.24,;-6.05,-18.94,;-7.39,-18.16,;-4.72,-18.16,;23.29,-20.48,;23.29,-18.94,;24.62,-21.24,;25.96,-20.48,;25.96,-18.94,;27.29,-21.24,;27.29,-22.78,;28.63,-20.48,;29.95,-21.24,;31.29,-20.48,;31.29,-18.94,;32.62,-21.24,;33.96,-20.48,;33.96,-18.94,;35.29,-18.16,;35.29,-16.62,;36.63,-15.86,;36.63,-14.32,;37.96,-13.54,;35.29,-13.54,;35.29,-21.24,;35.29,-22.78,;36.63,-20.48,;37.96,-21.24,;37.96,-22.78,;39.29,-23.56,;40.79,-23.16,;41.63,-24.44,;40.65,-25.64,;40.9,-27.15,;39.7,-28.12,;38.26,-27.56,;38.03,-26.04,;39.22,-25.08,;39.29,-20.48,;40.63,-21.24,;39.3,-18.93,)|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |wU:44.46,52.53,27.37,66.68,46.49,8.12,75.76,wD:16.24,61.63,39.41,86.87,4.4,(4.83,-25.42,;4.83,-23.88,;6.16,-23.11,;3.49,-23.11,;3.49,-21.57,;2.16,-20.8,;.82,-21.57,;.82,-23.11,;-.51,-20.8,;-.51,-19.26,;.82,-18.49,;2.16,-19.26,;.82,-16.95,;-1.85,-21.57,;-3.18,-20.8,;-3.18,-19.26,;-4.51,-21.57,;-4.51,-23.11,;-3.18,-23.88,;-3.18,-25.42,;-1.85,-26.19,;-.52,-25.42,;-.52,-23.87,;-1.85,-23.11,;-5.85,-20.8,;-7.18,-21.57,;-7.18,-23.11,;-8.51,-20.8,;-8.51,-19.26,;-7.18,-18.49,;-5.85,-19.27,;-4.51,-18.49,;-4.51,-16.95,;-3.18,-16.18,;-5.86,-16.19,;-7.18,-16.96,;-9.85,-21.57,;-11.18,-20.8,;-11.18,-19.26,;-12.52,-21.57,;-12.52,-23.11,;-13.86,-20.8,;-15.18,-21.57,;-15.18,-23.11,;-16.52,-20.8,;-17.85,-21.57,;-16.52,-19.26,;-17.85,-18.49,;-15.18,-18.49,;4.83,-20.8,;4.83,-19.26,;6.16,-21.57,;7.5,-20.8,;7.5,-19.26,;8.82,-18.49,;8.82,-16.95,;10.16,-16.18,;10.16,-14.64,;8.82,-21.57,;8.82,-23.11,;10.16,-20.8,;11.49,-21.57,;11.49,-23.11,;12.83,-20.8,;12.83,-19.26,;14.16,-21.57,;15.5,-20.8,;15.5,-19.26,;16.83,-21.57,;16.83,-23.11,;18.17,-20.8,;19.49,-21.57,;20.83,-20.8,;20.83,-19.26,;22.16,-21.57,;23.5,-20.8,;23.5,-19.26,;24.83,-18.49,;24.83,-16.95,;26.17,-16.18,;26.17,-14.64,;27.5,-13.87,;24.83,-13.87,;24.83,-21.57,;24.83,-23.11,;26.17,-20.8,;27.5,-21.57,;27.5,-23.11,;28.83,-23.88,;30.33,-23.48,;31.17,-24.77,;30.19,-25.96,;30.43,-27.47,;29.24,-28.44,;27.8,-27.88,;27.57,-26.36,;28.76,-25.41,;28.83,-20.8,;30.17,-21.56,;28.84,-19.26,)|
CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(O)=O
CC[C@@H](C)[C@@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](N)Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@H](C)C(O)=O
CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |wU:63.64,72.72,46.46,4.4,32.34,13.22,30.31,wD:38.38,25.26,8.8,83.83,55.55,(9.65,-19.42,;8.32,-18.65,;8.32,-17.11,;6.98,-19.42,;6.98,-20.96,;5.65,-21.73,;4.32,-20.96,;4.32,-19.42,;2.99,-21.73,;2.99,-23.27,;1.65,-20.96,;.31,-21.73,;.31,-23.27,;-1.02,-20.96,;-1.02,-19.42,;.31,-18.66,;1.63,-19.43,;2.96,-18.66,;2.96,-17.13,;4.28,-16.36,;1.62,-16.36,;.3,-17.13,;-2.36,-21.73,;-3.69,-20.96,;-3.69,-19.42,;-5.03,-21.73,;-5.03,-23.27,;-6.36,-20.96,;-7.69,-21.73,;-7.69,-23.27,;-9.03,-20.96,;-10.36,-21.73,;-9.03,-19.42,;-10.35,-18.66,;-7.7,-18.66,;8.32,-21.73,;8.32,-23.27,;9.65,-20.96,;10.99,-21.73,;10.99,-23.27,;12.33,-24.05,;12.33,-25.59,;13.66,-23.27,;12.33,-20.96,;12.33,-19.42,;13.66,-21.73,;15,-20.96,;15,-19.42,;16.32,-18.65,;16.32,-17.11,;17.66,-16.34,;17.66,-14.8,;16.32,-21.73,;16.32,-23.27,;17.66,-20.96,;19,-21.73,;19,-23.27,;20.33,-24.05,;20.33,-25.59,;21.67,-23.27,;20.33,-20.96,;20.33,-19.42,;21.67,-21.73,;23,-20.96,;23,-19.42,;24.34,-21.73,;24.34,-23.27,;25.67,-20.96,;27,-21.73,;28.34,-20.96,;28.34,-19.42,;29.67,-21.73,;31.01,-20.96,;31.01,-19.42,;32.34,-18.65,;32.34,-17.11,;33.68,-16.34,;33.68,-14.8,;35.02,-14.03,;32.34,-14.03,;32.34,-21.73,;32.34,-23.27,;33.68,-20.96,;35.02,-21.73,;35.02,-23.27,;36.34,-24.05,;37.84,-23.65,;38.68,-24.93,;37.71,-26.13,;37.95,-27.64,;36.76,-28.61,;35.32,-28.05,;35.08,-26.53,;36.27,-25.57,;36.34,-20.96,;37.68,-21.73,;36.35,-19.42,)|
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |wU:54.55,44.45,25.29,62.63,71.71,8.13,56.58,wD:4.4,33.41,49.50,17.21,82.82,(22.26,-18.28,;22.26,-16.74,;23.59,-15.96,;20.92,-15.96,;20.92,-14.42,;19.59,-13.66,;18.26,-14.42,;18.26,-15.96,;16.93,-13.66,;16.93,-12.12,;18.26,-11.34,;18.26,-9.8,;19.59,-9.04,;19.59,-7.5,;15.59,-14.42,;14.26,-13.66,;14.26,-12.12,;12.92,-14.42,;12.92,-15.96,;14.26,-16.74,;14.26,-18.28,;15.59,-15.96,;11.59,-13.66,;10.26,-14.42,;10.26,-15.96,;8.92,-13.66,;8.92,-12.12,;10.26,-11.34,;11.59,-12.12,;10.26,-9.8,;7.59,-14.42,;6.26,-13.66,;6.26,-12.12,;4.92,-14.42,;4.92,-15.96,;6.26,-16.74,;6.26,-18.28,;7.58,-19.04,;8.92,-18.28,;8.91,-16.73,;7.59,-15.96,;3.59,-13.66,;2.26,-14.42,;2.26,-15.96,;.92,-13.66,;.92,-12.12,;-.41,-14.42,;-1.75,-13.66,;-1.75,-12.12,;-3.08,-14.42,;-3.08,-15.96,;-4.41,-13.66,;-5.74,-14.42,;-5.74,-15.96,;-7.08,-13.66,;-8.41,-14.42,;-7.08,-12.12,;-8.41,-11.35,;-5.75,-11.35,;22.26,-13.66,;22.26,-12.12,;23.59,-14.42,;24.93,-13.66,;24.93,-12.12,;26.26,-14.42,;26.26,-15.96,;27.6,-13.66,;28.92,-14.42,;30.26,-13.66,;30.26,-12.12,;31.59,-14.42,;32.93,-13.66,;32.93,-12.12,;34.26,-11.34,;34.26,-9.8,;35.6,-9.04,;35.6,-7.5,;36.93,-6.72,;34.26,-6.72,;34.26,-14.42,;34.26,-15.96,;35.6,-13.66,;36.93,-14.42,;36.93,-15.96,;38.26,-16.74,;39.76,-16.33,;40.6,-17.62,;39.62,-18.82,;39.87,-20.33,;38.67,-21.29,;37.23,-20.74,;37,-19.22,;38.19,-18.26,;38.26,-13.66,;39.6,-14.42,;38.27,-12.11,)|
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O
C[C@@H](O)[C@H](NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCN=C(N)N)NC(=O)CN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(N)=O |wU:3.3,14.27,53.55,54.58,wD:7.6,28.38,44.46,(15.07,2.25,;13.73,1.49,;12.4,2.27,;13.72,-.05,;12.38,-.81,;11.05,-.02,;11.06,1.52,;9.71,-.78,;9.96,-2.3,;8.59,-3.01,;7.49,-1.92,;8.19,-.55,;6.86,-1.31,;6.86,-2.85,;5.53,-.54,;5.53,1,;6.86,1.77,;8.32,1.26,;9.26,2.48,;8.39,3.75,;8.75,5.24,;7.64,6.3,;6.16,5.86,;5.8,4.37,;6.91,3.32,;4.2,-1.31,;2.86,-.54,;2.86,1,;1.53,-1.31,;1.53,-2.85,;2.86,-3.62,;2.86,-5.16,;4.2,-5.93,;4.2,-7.47,;5.53,-8.24,;2.86,-8.24,;.19,-.54,;-1.14,-1.31,;-1.14,-2.85,;-2.47,-.54,;-3.81,-1.31,;15.04,-.83,;15.03,-2.37,;16.38,-.08,;17.71,-.86,;17.69,-2.4,;19.02,-3.18,;19.01,-4.72,;20.33,-5.5,;20.32,-7.04,;19.05,-.1,;19.07,1.44,;20.38,-.88,;21.72,-.13,;21.73,1.41,;20.41,2.2,;23.07,2.17,;23.04,-.91,;23.03,-2.45,;24.39,-.15,)|
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |wU:4.4,51.56,31.45,68.71,86.89,12.12,wD:2.2,45.51,17.29,57.60,77.80,(14.84,-15.56,;14.84,-17.1,;16.18,-17.87,;17.51,-17.1,;16.18,-19.41,;14.84,-20.18,;13.51,-19.41,;13.51,-17.87,;12.17,-20.18,;10.84,-19.41,;9.5,-20.18,;9.5,-21.72,;8.18,-19.41,;8.18,-17.87,;6.84,-20.18,;5.51,-19.41,;5.51,-17.87,;4.17,-20.18,;4.17,-21.72,;5.51,-22.49,;6.84,-21.72,;8,-22.49,;7.52,-23.96,;8.29,-25.28,;7.52,-26.61,;5.98,-26.61,;5.22,-25.27,;5.99,-23.95,;2.84,-19.41,;1.5,-20.18,;1.5,-21.72,;.17,-19.41,;.17,-17.87,;1.5,-17.1,;2.97,-17.57,;3.88,-16.32,;2.96,-15.09,;3.28,-13.59,;2.15,-12.56,;.69,-13.04,;.37,-14.54,;1.5,-15.55,;-1.17,-20.18,;-2.5,-19.41,;-2.5,-17.87,;-3.83,-20.18,;-3.83,-21.72,;-2.5,-22.5,;-5.17,-19.41,;-6.5,-20.18,;-6.5,-21.72,;-7.84,-19.41,;-7.84,-17.87,;-9.17,-20.18,;17.51,-20.18,;17.51,-21.72,;18.84,-19.41,;20.17,-20.18,;20.17,-21.72,;21.51,-22.5,;21.51,-24.04,;22.84,-24.8,;22.85,-26.33,;24.18,-27.09,;21.52,-27.1,;21.51,-19.41,;21.51,-17.87,;22.84,-20.18,;24.18,-19.41,;24.18,-17.87,;25.51,-17.1,;25.51,-15.56,;24.18,-14.79,;26.85,-14.79,;25.51,-20.18,;25.51,-21.72,;26.85,-19.41,;28.18,-20.18,;28.18,-21.72,;29.51,-22.5,;29.51,-24.04,;28.18,-24.8,;30.84,-24.8,;29.51,-19.41,;29.51,-17.87,;30.84,-20.18,;32.18,-19.41,;32.18,-17.87,;33.51,-17.1,;34.85,-17.88,;36.18,-17.11,;36.18,-15.57,;34.84,-14.8,;33.51,-15.57,;33.51,-20.18,;34.85,-19.42,;33.52,-21.73,)|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(N)=O
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(O)=O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(C)C)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCCN)C(O)=O
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(C)C)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(O)=O)C(O)=O
CC[C@H](C)C(NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(C)C)[C@@H](C)CC)C(C)C)C(O)=O
O=S(=O)(CS(=O)(=O)\C=C\c1cc(OCc2ccccc2)c(OCc2ccccc2)c(OCc2ccccc2)c1)\C=C\c1cc(OCc2ccccc2)c(OCc2ccccc2)c(OCc2ccccc2)c1
Brc1cccc(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c2cccc(Br)n2)n1
COc1cc(Br)c(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c2cc(OC)c(OC)cc2Br)cc1OC
Fc1cc(CCS(=O)(=O)CS(=O)(=O)CCc2cc(F)c(F)c(F)c2)cc(F)c1F
COc1cc(OC)c(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c2cc(OC)c(OC)cc2OC)cc1OC
O=S(=O)(CS(=O)(=O)\C=C\c1ccc2[nH]ccc2c1)\C=C\c1ccc2[nH]ccc2c1
Fc1cc(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c2cc(F)c(F)c(F)c2)cc(F)c1F
OC(=O)c1ccc(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c2ccc(cc2)C(O)=O)cc1
O=S(=O)(CCc1ccccc1)CS(=O)(=O)CCc1ccccc1
COc1cc(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c2cc(Br)c(OC)c(OC)c2)cc(Br)c1OC
COc1ccc(Br)cc1\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c1cc(Br)ccc1OC
O=S(=O)(CS(=O)(=O)\C=C\c1ccccc1)\C=C\c1ccccc1
O=S(=O)(CS(=O)(=O)\C=C\c1ccccc1OCc1ccccc1)\C=C\c1ccccc1OCc1ccccc1
O=S(=O)(CS(=O)(=O)\C=C\c1ccc2OCCOc2c1)\C=C\c1ccc2OCCOc2c1
Clc1ccc(Cl)c(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c2cc(Cl)ccc2Cl)c1
Oc1ccc(CCS(=O)(=O)CS(=O)(=O)CCc2ccc(O)c(O)c2)cc1O
COc1cc(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\c2cc(OC)c(OC)cc2[N+]([O-])=O)c(cc1OC)[N+]([O-])=O
CC1=C[C@@H]([C@H]([C@@H](C1)c1ccc(O)cc1O)C(=O)c1ccc(O)cc1O)c1c(O)ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)c1O |t:1|
Cc1c(O)c(cc2cc(C(=O)Nc3ccc(O)c(c3)C(O)=O)c(=O)oc12)[N+]([O-])=O
Oc1ccc(\C=N\NC(=O)c2cc(O)c(O)c(O)c2)c(O)c1
CCCCCCC[C@H]1Cc2cc3C=C(OC)C(=O)C(=O)c3c(O)c2CO1 |r,t:12|
CCCC\C=C\c1c(C)oc(=O)cc1OC
CCCCCCc1c(C)oc(=O)cc1OC
CCCCCc1cc(O)c(C)c(O)c1C=O
CC(C)c1cn(COCc2ccccc2)c(=O)[nH]c1=O
C=C[C@@H]1C[C@]1(NC(=O)[C@@H]1C[C@@H](Oc2nccc3ccccc23)CN1C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)NS(=O)(=O)C1CC1
C=C[C@@H]1C[C@]1(NC(=O)[C@@H]1C[C@@H](Oc2ncc(OC)c3ccccc23)CN1C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)NS(=O)(=O)C1CC1
C=C[C@@H]1C[C@]1(NC(=O)[C@@H]1C[C@@H](Oc2nccc3ccc(Cl)cc23)CN1C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)NS(=O)(=O)C1CC1
CC(C)(C)[C@@H](C(=O)N1C[C@@H](C[C@H]1C(=O)N[C@@]2(C[C@H]2C=C)C(=O)NS(=O)(=O)C3CC3)Oc4c5cc(ccc5c(cn4)OC)Cl)NC(=O)OC(C)(C)C
Cc1ccc2c(c1C(OC(C)(C)C)C(=O)O)[C@]1(CC2)CC[C@@H](C)CC1
Cc1ccc2c(c1C(OC(C)(C)C)C(=O)O)[C@]1(CCC2)CC[C@@H](C)CC1
Cc1ccc2c(c1C(OC(C)(C)C)C(=O)O)[C@]1(CC[C@H](C)CC1)CC2O
COC1C[C@]2(CC[C@@H](C)CC2)c2c1ccc(C)c2C(OC(C)(C)C)C(=O)O
Cc1ccc2c(c1C(OC(C)(C)C)C(=O)O)[C@]1(CC[C@H](C)CC1)CC2=O
Cc1ccc(-c2c([C@H](OC(C)(C)C)C(=O)O)c(C)nc3ccccc23)cc1C
CNC(=O)c1cc(C)c(C(OC(C)(C)C)C(=O)O)c2c1CC[C@]21CC[C@@H](C)CC1
Cc1cc(C(=O)N(C)C)c2c(c1C(OC(C)(C)C)C(=O)O)[C@]1(CC2)CC[C@@H](C)CC1
Cc1cc(C(=O)NC(C)C)c2c(c1C(OC(C)(C)C)C(=O)O)[C@]1(CC2)CC[C@@H](C)CC1
Cc1cc(C(=O)NCC(C)C)c2c(c1C(OC(C)(C)C)C(=O)O)[C@]1(CC2)CC[C@@H](C)CC1
Cc1cc(C(=O)NC2CCCCC2)c2c(c1C(OC(C)(C)C)C(=O)O)[C@]1(CC2)CC[C@@H](C)CC1
Cc1cc(C(=O)NC2CCCCCC2)c2c(c1C(OC(C)(C)C)C(=O)O)[C@]1(CC2)CC[C@@H](C)CC1
Cc1cc(NC(=O)CC(C)C)c2c(c1C(OC(C)(C)C)C(=O)O)[C@]1(CC2)CC[C@@H](C)CC1
Cc1cc(C(=O)NC2CCCCC2)c2c(c1[C@H](OC(C)(C)C)C(=O)O)[C@]1(CC2)CC[C@@H](C)CC1
Cc1cc(C(=O)NC2CCCCC2)c2c(c1[C@@H](OC(C)(C)C)C(=O)O)[C@]1(CC2)CC[C@@H](C)CC1
CN(C)c1cc2c(cc1C(=O)/C=C(O)C(=O)O)c(=O)c(C(=O)/C=C(O)C(=O)O)cn2Cc1ccc(F)cc1
CCOC(=O)/C(O)=C/C(=O)c1ccc2c(c1)c(=O)c(C(=O)/C=C(O)C(=O)OCC)cn2Cc1ccc(F)cc1
CCOC(=O)/C(O)=C/C(=O)c1cc2c(=O)c(C(=O)/C=C(O)C(=O)OCC)cn(Cc3ccc(F)cc3)c2cc1N(C)C
CCOC(=O)/C(O)=C/C(=O)c1cc2c(=O)c(C(=O)/C=C(O)C(=O)OCC)cn(Cc3ccc(F)cc3)c2cc1N1CCN(C)CC1
O=C(O)/C(O)=C/C(=O)c1cn(Cc2ccc(F)cc2)c2ccc(C(=O)c3ccc(C(=O)O)cc3)cc2c1=O
CCOC(=O)/C(O)=C/C(=O)c1cn(Cc2ccc(F)cc2)c2ccc(C(=O)c3ccc(C(=O)OCC)cc3)cc2c1=O
OC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(Oc3ccccc3)cc2c1=O
O=C(O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3ccc(F)cc3)cc2c1=O
O=C(O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3ccc(OCc4ccccc4)cc3)cc2c1=O
CCOC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3cccc4ccccc34)cc2c1=O
CCOC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3ccc(OCc4ccccc4)cc3)cc2c1=O
O=C(O)/C(O)=C/C(=O)c1cccn1Cc1ccc(F)cc1
CO[C@H]1O[C@H](COC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1
CO[C@@H]1O[C@H](COC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](O)[C@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1O
CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1
CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1
CO[C@@H]1O[C@H](COC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1
CO[C@H]1O[C@H](COC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](O)[C@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1O
COC1O[C@H](CO)[C@@H](O)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H]1OC(=O)c1cc(O)c(O)c(O)c1
CO[C@@H]1O[C@H](COC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](O)[C@H](O)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1
CO[C@H]1O[C@H](COC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](O)[C@H](O)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1
C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](OCCc3ccc(O)c(O)c3)O[C@H](CO)[C@H]2OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O |r|
Nc1ccn([C@H]2C[C@@H](O)[C@@H](COP(O)(=O)O[C@@H]3[C@H](COP(O)(O)=O)OC[C@@H]3n3cnc4c(N)ncnc34)O2)c(=O)n1 |r|
Nc1ccn([C@H]2C[C@H](OP([O-])(=O)OC[C@H]3OC[C@H]([C@@H]3O)n3ccc(=O)[nH]c3=O)[C@@H](COP([O-])([O-])=O)O2)c(=O)n1
CC(Cc1ccc(O)c(O)c1)(C(O)=O)C(C)(Cc1ccc(O)c(O)c1)C([O-])=O
[O-]C(=O)C(=O)CC(=O)c1cccc(CCC#N)c1
Clc1ccc2[nH]cc(C(=O)CC(=O)c3nnn[nH]3)c2c1
OC(=O)c1ccc(C(O)=O)c2c(ccc(C(O)=O)c12)C(O)=O
OC(=O)c1cc(ccc1O)N=Nc1ccccc1C(O)=O |w:11.12|
OC(=O)c1cc(O)c(O)c(OC(=O)c2cc(O)c(O)c(O)c2)c1
[O-]C(=O)C(=O)CC(=O)c1ccc2C(CCC(N=[N+]=[N-])c2c1)N=[N+]=[N-]
OC(=O)c1cnc2c(ccc3ncc(C(O)=O)c(O)c23)c1O
CCCCCc1cc(O)cc2OC(=O)c3c(Oc12)c(C=O)c(O)c(Cl)c3C(=O)CCCC
Oc1ccc(\C=C\C(=O)NCC(OC(=O)\C=C\c2ccc(O)c(O)c2)C([O-])=O)cc1O
CC1C=C(NC(=O)C2=CC(NC(=O)C3=CC(=CC3C)N(C)C(=O)c3ccc(cc3)C(=O)N(C)C3=CC(C)C(=C3)C(=O)NC3=CC(C)C(=C3)C(=O)NC3=CC(C)C(=C3)C(=O)NCCCN(C)C)=CC2C)C=C1C(=O)NCCCN(C)C |c:15,39,49,59,70,75,t:2,7,13,35,45,55|
[O-]C(=O)C(=O)CC(=O)c1ccc2C(CC(N=[N+]=[N-])c2c1)N=[N+]=[N-]
COC(=O)c1ccc(CC(=O)c2c(C)cc(O)c(C=O)c2O)c(C)c1O
Oc1c(O)c2ccccc2c(O)c1C(=C1C(=O)C(=O)c2ccccc2C1=O)c1ccc(Cl)cc1 |w:13.14|
CC1C=C(NC(=O)C2=CC(NC(=O)C3=CC(NC(=O)c4ccc(cc4)C(=O)NC4=CC(C)C(=C4)C(=O)NC4=CC(C)C(=C4)C(=O)NC4=CC(C)C(=C4)C(=O)NCCC(N)=N)=CC3C)=CC2C)C=C1C(=O)NCCC(N)=N |c:33,43,53,63,67,72,t:2,7,13,29,39,49|
COc1cc(C)c2Oc3c(C=O)c(O)c(Cl)c(C)c3C(=O)Oc2c1C
COc1cc(cc(Br)c1O)C(C1C(=O)C(=O)c2ccccc2C1=O)c1c(O)c(O)c2ccccc2c1O
[H][C@@]12CCC(C(C)CCC(O)=O)[C@@]1(C)C(C[C@@]1([H])[C@@]2([H])C(CC2CC(CC[C@]12C)OC(=O)\C=C\c1ccc(O)c(O)c1)OC(=O)\C=C\c1ccc(O)c(O)c1)OC(=O)\C=C\c1ccc(O)c(O)c1 |r|
[O-]C(=O)C(=O)CC(=O)c1ccc(CN=[N+]=[N-])c(CN=[N+]=[N-])c1
CC1C=C(NC(=O)C2=CC(NC(=O)C3=CC(NC(=O)c4ccc(nc4)C(=O)NC4=CC(C)C(=C4)C(=O)NC4=CC(C)C(=C4)C(=O)NC4=CC(C)C(=C4)C(=O)NCCC(N)=N)=CC3C)=CC2C)C=C1C(=O)NCCC(N)=N |c:33,43,53,63,67,72,t:2,7,13,29,39,49|
COc1cc(c2c(c1)OC(=C(C2=O)O)c3ccc(c(c3)O)O)O
O[C@@H]1O[C@@H](Oc2c(O)cc(O)c3c2oc(-c2ccc(O)c(O)c2)c(O)c3=O)[C@H](O)[C@@H](O)[C@@H]1O |r|
c1cc2c(cc1O)OC(=C(C2=O)O)c3cc(c(c(c3)O)O)O
COc1c(O)cc2oc(cc(=O)c2c1O)-c1ccc(O)c(O)c1
CC1OC(O)C(O)C(O)C1Oc1c(O)c2c(cc(O)cc2=O)oc1-c1ccc(O)c(O)c1
c1cc(c(cc1C2=C(C(=O)c3c(cc(c(c3O)O)O)O2)O)O)O
OC1OCC(Oc2c(O)c3c(cc(O)cc3=O)oc2-c2ccc(O)c(O)c2)C(O)C1O
C[C@@H]1O[C@@H](O)[C@H](O)[C@H](O)[C@H]1Oc1c(O)c2c(cc(O)cc2=O)oc1-c1cc(O)c(O)c(O)c1 |r|
c1cc(c(cc1O)O)C2=C(C(=O)c3c(cc(cc3O2)O)O)O
c1cc(c(cc1C2=CC(=O)c3c(cc(cc3O2)O)O)O)O
c1cc(ccc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O
c1cc(c(cc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O)O
c1ccc(cc1)C2=CC(=O)c3c(cc(c(c3O)O)O)O2
c1cc(c(cc1C2=C(C(=O)c3ccc(cc3O2)O)O)O)O
c1c(cc(c(c1O)O)O)C2=C(C(=O)c3c(cc(cc3O2)O)O)O
CCOC(=O)C(c1c(O)c2ccccc2oc1=O)c1c(O)c2ccccc2oc1=O
Oc1c(O)c2ccccc2c(O)c1C(=C1C(=O)C(=O)c2ccccc2C1=O)c1ccc(Cl)c(Cl)c1 |w:13.14|
CC(=O)Nc1ccc(cc1)C(=C1C(=O)C(=O)c2ccccc2C1=O)c1c(O)c(O)c2ccccc2c1O |w:10.26|
CCOC(=O)C(=C1C(=O)C(=O)c2ccccc2C1=O)c1c(O)c(O)c2ccccc2c1O |w:5.20|
Oc1c(-c2ccccc2)c(=O)oc2c(cccc12)-c1ccccc1
Oc1c(-c2ccccc2)c(=O)oc2ccccc12
CCCCCCc1cc2C(O)C(C(c3ccccc3)c3c(O)c4cc(CCCCCC)c(O)cc4oc3=O)C(=O)Oc2cc1O
O=C1C(CCCC2CCC3CCCCC3C2)C(=O)c2ccccc2C1=O
Oc1c(C(c2ccc3OCOc3c2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12
Oc1c(O)c2ccccc2c(O)c1C(=C1C(=O)C(=O)c2ccccc2C1=O)c1ccc(Cl)cc1Cl |w:13.14|
Oc1c(CSC(=O)c2ccccc2)c(=O)oc2ccccc12
COc1ccc2c(O)c(c(=O)oc2c1)S(=O)(=O)c1ccc(Cl)cc1
Oc1c(O)c2ccccc2c(O)c1C(C#Cc1ccccc1)=C1C(=O)C(=O)c2ccccc2C1=O |w:22.25|
COc1cc(cc(Br)c1O)C(=C1C(=O)C(=O)c2ccccc2C1=O)c1c(O)c(O)c2ccccc2c1O |w:11.12|
CN(C)c1ccc(cc1)C(=C1C(=O)C(=O)c2ccccc2C1=O)c1c(O)c(O)c2ccccc2c1O |w:9.25|
Oc1c(O)c2ccccc2c(O)c1C(=C1C(=O)C(=O)c2ccccc2C1=O)c1ccccc1 |w:13.14|
Oc1cccc2oc(=O)c(Cc3ccccc3)c(O)c12
CC(=C1C(=O)C(=O)c2ccccc2C1=O)c1c(O)c(O)c2ccccc2c1O |w:1.0|
COc1cc(cc(OC)c1OC)C(=C1C(=O)C(=O)c2ccccc2C1=O)c1c(O)c(O)c2ccccc2c1O |w:13.14|
O=C1C(Sc2ccccc2)C(=O)c2ccccc2C1=O
Oc1c(C(=O)c2cccc(c2)[N+]([O-])=O)c(=O)oc2ccccc12
OC1C(Sc2c(O)c3ccccc3oc2=O)C(=O)Oc2ccccc12
Cc1ccc(cc1)S(=O)(=O)NN=C(CCN1CCCC1)CC(c1ccccc1)c1c(O)c2ccccc2oc1=O |w:11.11|
Oc1c(O)c2ccccc2c(O)c1C(CCc1ccccc1)=C1C(=O)C(=O)c2ccccc2C1=O |w:22.25|
O=C1CC(=O)c2ccccc2C1=O
Oc1c(C(=O)C(=O)NC2=C(Cl)C(=O)c3ccccc3C2=O)c(=O)oc2ccccc12 |c:8|
OC1C(Cc2c(O)c3ccccc3oc2=O)C(=O)Oc2ccccc12
CC(C)c1cccc(C(C)C)c1NC(=O)C(=O)CC(=O)CC(c1ccccc1)c1c(O)c2ccccc2oc1=O
CCCCCCC=Nc1c(O)c(O)c2ccccc2c1O |w:6.5|
CCOc1ccc(cc1OC)C(=C1C(=O)C(=O)c2ccccc2C1=O)c1c(O)c(O)c2ccccc2c1O |w:11.27|
COc1ccc2c(O)c(c(=O)oc2c1)S(=O)(=O)c1ccc(C)cc1
CC(=O)c1cccc(NC(=O)C(=O)c2c(O)c3ccccc3oc2=O)c1
Clc1ccc(CC2C(=O)C(=O)c3ccccc3C2=O)cc1
Oc1c(O)c2ccccc2c(O)c1C(=C1C(=O)C(=O)c2ccccc2C1=O)c1ccc(cc1)C(C1C(=O)C(=O)c2ccccc2C1=O)C1C(=O)C(=O)c2ccccc2C1=O |w:13.14|
Oc1c(C(=O)c2ccc(Cl)cc2)c(=O)oc2ccccc12
Clc1ccc(SCC2C(=O)C(=O)c3ccccc3C2=O)cc1
O=C(CC(=O)C=Cc1ccccc1)C=Cc1ccccc1 |w:14.15,6.6|
COc1ccc(C=CC(=O)CC(=O)C=Cc2ccc(OC)cc2)cc1 |w:6.5,14.14|
COc1cc(CCC(=O)CC(=O)CCc2ccc(O)c(OC)c2)ccc1O
Oc1ccc(C=CC(=O)CC(=O)C=Cc2ccc(O)cc2)cc1 |w:12.11,5.4|
COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)cc2)ccc1O |w:6.6,13.13|
COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(O)c2)ccc1O |w:12.11,5.4|
Oc1ccc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(O)c2)cc1O |w:12.11,5.4|
CC1C(=O)C(C)=C(N)C(=NNc2ccc(cc2)S(=O)(=O)Nc2cc(C)nc(C)n2)C1=O |w:9.9,t:5|
CC(=O)C1(CCOC1=O)N=Nc1ccc(cc1)S(=O)(=O)Nc1nccc(C)n1 |w:9.9|
NS(=O)(=O)c1ccc(NN=C2Sc3nc4ccccc4n3C2=O)cc1 |w:9.8|
Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(C2)S(=O)(=O)c1ccc(Cl)c(c1)S(N)(=O)=O |c:18,t:10|
Cc1csc(NS(=O)(=O)c2ccc(cc2)N=Nc2c(C)[nH]n(-c3ccccc3)c2=O)c1C |w:16.17|
O=C(Nc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)\N=N\c1ccc(cc1)S(=O)(=O)Nc1nccs1)C(N1CC1)(N1CC1)N1CC1
Oc1nc(S)sc1-c1ccc(cc1)S(=O)(=O)Nc1ncccn1
CCOC(=O)C(C=Nc1ccc(cc1)S(N)(=O)=O)C(=O)OCC |w:6.5|
CC(=O)Nc1cc(cc2c1c(cc(c2)S(=O)(=O)O)O)S(=O)(=O)O
CC(=O)C1(CCOC1=O)N=Nc1ccc(cc1)S(=O)(=O)Nc1onc(C)c1C |w:9.9|
CC(=O)Nc1ccc(cc1)S(=O)(=O)NN=NCC(O)=O |w:15.16|
CC1C(=O)C(C)=C(N)C(=NNc2ccc(cc2)S(=O)(=O)Nc2nccs2)C1=O |w:9.9,t:5|
CCC(=O)C(C)C(=O)C(=O)NCCNC(=O)C(=O)C(C)C(=O)CC
Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)c3cccn4c3nc3ccccc3c4=O)cc2)n1
CC1C(=O)C(C)=C(N)C(=NNc2ccc(cc2)S(=O)(=O)Nc2nnc(C)s2)C1=O |w:9.9,t:5|
CC(=O)Nc1cccc2cc(ccc12)S(O)(=O)=O
CC1C(=O)C(C)=C(N)C(=NNc2ccc(cc2)S(=O)(=O)Nc2nccc(C)n2)C1=O |w:9.9,t:5|
O=C(Nc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)N=Nc1ccccc1)C(Sc1ncnc2nc[nH]c12)Sc1ncnc2nc[nH]c12 |w:20.22|
CC(=O)C1(CCOC1=O)N=Nc1ccc(cc1)S(=O)(=O)Nc1ccccn1 |w:9.9|
CS(=O)(=O)c1nc2ccc(cc2s1)N1C(=O)c2ccccc2C1=O
CC(=O)NCCSS(=O)(=O)CCCCCS(=O)(=O)SCCNC(C)=O
CC1C(=O)C(C)=C(N)C(=NNc2ccc(cc2)S(=O)(=O)Nc2scc(C)c2C)C1=O |w:9.9,t:5|
NS(=O)(=O)c1ccc(NC(=O)\C=C/C(O)=O)cc1
Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)c3cccc4c(N)c5ccccc5nc34)cc2)n1
C=C1CC(OC1=O)c1ccc(cc1)S(=O)(=O)N1CCOCC1
O[C@H]1[C@@H](O)C(O[C@@H]1C(O)=O)n1cc([N+]([O-])=O)c(=O)[nH]c1=O |r|
Cc1cc(C)nc(NS(=O)(=O)c2ccc(CN3C(=O)c4ccccc4C3=O)cc2)n1
NS(=O)(=O)c1ccc(NC(=O)\C=C\C(O)=O)cc1
Cc1[nH]n(-c2ccccc2)c(=O)c1N=Nc1ccc(cc1)S(=O)(=O)Nc1nccc(C)n1 |w:14.16|
CCOC(=O)N(CCCCCCNC(c1ccccc1)S(O)(=O)=O)c1ccccc1
Cc1[nH]n(-c2ccccc2)c(=O)c1N=Nc1ccc(cc1)S(=O)(=O)Nc1cc(C)nc(C)n1 |w:14.16|
O=C(CNC(=O)c1cnc2ccccc2n1)NCCCNC(=O)CNC(=O)c1cnc2ccccc2n1
Cc1nnc(NS(=O)(=O)c2ccc(cc2)-c2sc(S)nc2O)s1
CCOC(=O)C(CCCCn1cnc2ncnc(Cl)c12)(NC(C)=O)C(=O)OCC
CC(=O)N(C(C)=O)c1nc2n(C)c(=O)n(C)c(=O)c2n1C
NNS(=O)(=O)c1ccc(OCC(O)=O)cc1
Nc1[nH][nH]c(=O)c1N=Nc1ccc(cc1)S(=O)(=O)Nc1nccs1 |w:7.7|
CC(=O)Nc1cc2cc(NS(=O)(=O)c3cc(cc(c3)C(F)(F)F)C(F)(F)F)ccc2oc1=O
Nc1nc(N)c(N=Nc2ccc(cc2)S(=O)(=O)NC(=O)c2ccccc2)c(=O)[nH]1 |w:6.5|
N[C@@H](CO)C(=O)[C@]1(O)[C@H](OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@@H](O)[C@H](OS(O)(=O)=O)[C@H](O)[C@H]1O[C@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1N |r|
CC1C(=O)C(C)=C(N)C(=NNc2ccc(cc2)S(=O)(=O)Nc2ncccn2)C1=O |w:9.9,t:5|
CCOC(=O)C(Cc1cn(c2ccccc12)S(=O)(=O)c1ccccc1)(NC(C)=O)C(=O)OCC
CC1C(=O)C(C)=C(N)C(=NNc2ccc(cc2)S(=O)(=O)Nc2ccccn2)C1=O |w:9.9,t:5|
Cc1ccnc(NS(=O)(=O)c2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)cc2)n1
CC(=O)OCC1OC(CC1N=[N+]=[N-])n1ccc(nc1=O)-n1cncn1
NS(=O)(=O)c1ccc(cc1)N=Cc1c(O)n(-c2ccccc2)n(-c2ccccc2)c1=O |w:10.10|
OC(=O)c1ccccc1C=NNC1=CS(=O)(=O)C=C1 |w:9.9,c:18,t:13|
Cc1[nH]n(-c2ccccc2)c(=O)c1N=Nc1ccc(cc1)S(N)(=O)=O |w:14.16|
COC(=O)c1noc2c1CSC1=C2CS(=O)(=O)c2ccccc12 |c:12|
Cc1nnc(NS(=O)(=O)c2ccc(cc2)N=Nc2c(C)[nH]n(-c3ccccc3)c2=O)s1 |w:15.15|
CC(=O)Nc1ccc(N)c2cc(ccc12)S(O)(=O)=O
CCC(=O)CC=c1[nH]c2nnc(CCCCc3nnc4[nH]c(=CCC(=O)CC)c(=O)n34)n2c1=O |w:5.4,22.22|
CCOC(=S)SC1OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O
Cc1[nH]n(-c2ccccc2)c(=O)c1N=Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1 |w:14.16|
CS(=O)(=O)Nc1ccc2oc(=O)c3ccccc3c2c1
Cc1[nH]n(-c2ccccc2)c(=O)c1N=Nc1ccc(cc1)S(=O)(=O)Nc1ccccn1 |w:14.16|
CCOC(=O)COc1ccc(cc1)S(=O)(=O)c1ccc(OCC(=O)OCC)cc1
COc1cc(NS(=O)(=O)c2ccc(cc2)C(C)=O)nc(OC)n1
NS(=O)(=O)c1ccc(cc1)N=Nc1c(O)n(-c2ccccc2)n(-c2ccccc2)c1=O |w:10.10|
OCCN(CCO)S(=O)(=O)c1ccc(Nc2ccc(O)c3C(=O)c4ccccc4C(=O)c23)cc1
Oc1c(\C=N\CCN2CCN(CC\N=C\c3cccc(c3O)[N+]([O-])=O)C2c2cccc(c2O)[N+]([O-])=O)cccc1[N+]([O-])=O
Cc1c2cc(O)c(O)cc2oc2cc(=O)c(O)cc12
ONC(=O)c1cc(O)c(O)c(O)c1
c1cc(c(cc1Cc2ccc(c(c2)C(=O)O)O)C(=O)O)O
COC(=O)c1c(C)cc(OC(=O)c2c(C)cc(O)c(C=O)c2O)c(C)c1O
CC(O)(\C=C\C1CC=CC(=O)O1)C(CC(O)\C=C\C=C\C=C\CO)OP(O)(O)=O |c:7|
CC(=O)C1=C(NNC(=O)c2ccccn2)[C@@]2(C)C(Oc3c2c(O)c(C)c(O)c3C(C)=O)=CC1=O |c:3,33|
CCCCCc1cc(O)cc2OC(=O)c3c(Oc12)cc(O)cc3C(=O)CCCC
OC(=O)c1c(cc(c(-c2c(cc(c(C(O)=O)c2[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O)c1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O |(9.4,-8.15,;10.73,-7.38,;12.05,-8.15,;10.71,-5.83,;12.05,-5.06,;12.05,-3.5,;10.71,-2.73,;9.4,-3.52,;2.12,-3.69,;.8,-2.93,;-.53,-3.72,;-.53,-5.25,;.8,-6.02,;.81,-7.57,;-.53,-8.34,;2.12,-8.34,;2.12,-5.25,;3.47,-6,;3.47,-7.54,;4.8,-5.23,;-1.86,-6.02,;-3.19,-5.25,;-1.86,-7.56,;.78,-1.39,;2.12,-.62,;-.54,-.62,;9.4,-5.06,;8.05,-5.83,;6.73,-5.06,;8.05,-7.37,;10.71,-1.2,;12.04,-.43,;9.36,-.43,;13.4,-5.81,;13.4,-7.35,;14.71,-5.04,)|
c1cc(c(cc1/C=C/C(=O)O[C@@H]2C[C@@](C[C@H]([C@H]2O)O)(C(=O)O)O)O)O
Oc1ccc(C(=O)c2c(cc(cc2[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O)c(O)c1
Oc1ccc(CC(NC(=O)c2ccc(cc2)[N+]([O-])=O)C(=O)OCc2ccccc2)cc1O
OC(=O)c1ccc(NC(=O)c2ccc(cc2)C(=O)Nc2ccc(O)c(c2)C(O)=O)cc1O
Oc1c(Cl)c(c(Nc2c(c(Cl)c(O)c(Cl)c2[N+]([O-])=O)[N+]([O-])=O)c(c1Cl)[N+]([O-])=O)[N+]([O-])=O
Cc1cc(cc(C(O)=O)c1O)C(O)(c1cc(C)c(O)c(c1)C(O)=O)c1cc(C)c(O)c(c1)C(O)=O
COc1cc(C)c2c(Oc3c4C(O)OC(=O)c4c(O)c(C)c3OC2=O)c1C=O
CCCCCC(=O)Cc1cc(O)cc2Oc3c(OC(=O)c12)cc(O)c(C(O)=O)c3CCCCC
Cc1cc(Cc2cc(C)c(O)c(c2)C(O)=O)cc(C(O)=O)c1O
O=C1C(c2ccccc2)C2(CSC3(CS2)C(C(=O)C3=O)c2ccccc2)C1=O
Cc1cc(cc(C(O)=O)c1O)C(c1cc(C)c(O)c(c1)C(O)=O)c1cc(C)c(O)c(c1)C(O)=O
Oc1ccc(cc1)C1OC(C(C1C(=O)c1ccc(O)cc1O)C(=O)c1ccc(O)cc1O)c1ccc(O)cc1
OC(=O)c1ccccc1C(c1cc(Br)c(O)c(Br)c1)c1ccc(Br)c(O)c1Br
Oc1c(cc(cc1[N+]([O-])=O)-c1cc(c(O)c(c1)[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O
Cc1ncc(COP(O)(O)=O)c(C2NC(CS2)C(O)=O)c1O
Cc1cc(O)c(C=O)c2Oc3c4C(O)OC(=O)c4c(O)c(CO)c3OC(=O)c12
OC(=O)C(CSSCC(Nc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)C(O)=O)Nc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O
CCCCCc1cc2cc(O)cc(Oc3c(O)cc(O)c(C(O)=O)c3CCCCC)c2c(=O)o1
OC1COC2(O)C1OC(=O)C2(O)Cc1cc(O)c(O)c(Br)c1Br
Cc1cc(c(c2c1C(=O)Oc3c(c(cc(c3O2)C(=O)O)OC)C)C=O)O
CCOC(=O)c1cnc(NCCCNc2ncc(C(=O)OCC)c(=O)[nH]2)[nH]c1=O
Oc1c(cc(Cc2cc(c(O)c(c2)[N+]([O-])=O)[N+]([O-])=O)cc1[N+]([O-])=O)[N+]([O-])=O
c1ccc2c(c1)cc(c(c2Cc3c4ccccc4cc(c3O)C(=O)O)O)C(=O)O
Nc1cc(C(O)=O)c(cc1O)-c1cc(O)c(N)cc1C(O)=O
CC(=O)C1C(=O)C=C2Oc3c(c(O)c(C)c(O)c3C(C)=O)[C@@]2(C)C1=O |r,t:6|
COC(=O)c1c(C)c2Oc3c(C=O)c(O)cc(C)c3C(=O)Oc2c(C)c1O
Cc1cc(O)c(C=O)c2Oc3c(C)c(C(O)=O)c(O)c(C)c3OC(=O)c12
[#8]-c1ccc(\[#6]=[#6]-2\[#6](=O)-c3ccccc3-[#6]-2=O)cc1-[#8]
Oc1ccc(\C=C2/COC\C(=C/c3ccc(O)c(O)c3)C2=O)cc1O
Oc1ccc(\C=C\C(=O)c2ccccc2)cc1O
c1cc(ccc1C=CC(=O)c2ccc(cc2O)O)O
C[C@@H]1OC[C@@H]2[C@@H](O1)[C@@H]([C@H]([C@@H](O2)O[C@@H]3c4cc5c(cc4[C@H]([C@@H]6[C@@H]3COC6=O)c7cc(c(c(c7)OC)O)OC)OCO5)O)O
Oc1ccc(\C=C2/CCC\C(=C/c3ccc(O)c(O)c3)C2=O)cc1O
O=C(CC(=O)C=Cc1ccccc1)C=Cc1ccccc1 |w:5.4,14.15|
CC[C@@]1(O)C(=O)OCc2c1cc1-c3nc4ccccc4cc3Cn1c2=O |r|
COc1cc(\C=C\C(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O
Oc1ccc(\C=C2/Cc3ccccc3C2=O)cc1O
Oc1ccc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(O)c2)cc1O |w:5.4,13.13|
Oc1ccc(\C=C\C(=O)c2cccc(c2)C(=O)\C=C\c2ccc(O)cc2)cc1
COc1cc(\C=C2/CCC\C(=C/c3ccc(O)c(OC)c3)C2=O)ccc1O
Oc1ccc(\C=C\C(=O)c2cccc(c2)C(=O)\C=C\c2ccc(O)c(O)c2)cc1O
COc1ccc(\C=C\C(=O)\C=C\c2ccc(OC)c(OC)c2)cc1OC
Oc1ccc(\C=C2/CC\C(=C/c3ccc(O)c(O)c3)C2=O)cc1O
Nc1nnc[nH]1
COc1ccc(C=CC(=O)CC(=O)C=Cc2ccc(OC)c(OC)c2)cc1OC |w:6.5,13.12|
Oc1ccc(\C=C\C(=O)\C=C\c2ccc(O)c(O)c2)cc1O
Oc1ccc(\C=C2/C[NH2+]C\C(=C/c3ccc(O)c(O)c3)C2=O)cc1O
Oc1ccc(\C=C2/CSC\C(=C/c3ccc(O)c(O)c3)C2=O)cc1O
c1cc(c(cc1/C=C/C(=O)c2ccc(cc2O)O)O)O
Oc1ccc(C=CC(=O)CCc2ccccc2)cc1O |w:6.6|
Oc1ccc(\C=C\C(=O)\C=C\c2ccc(O)cc2)cc1
Oc1ccc(cc1)C(=O)\C=C\c1ccc(O)c(O)c1
Oc1ccc(\C=C\C(=O)OC2CCC(CC2)OC(=O)\C=C\c2ccc(O)c(O)c2)cc1O |(-2.66,-3.51,;-1.31,-4.26,;.02,-3.48,;1.36,-4.24,;1.36,-5.78,;2.7,-6.55,;4.03,-5.78,;5.38,-6.53,;5.39,-8.07,;6.71,-5.76,;8.26,-5.71,;9.06,-7.01,;10.6,-6.97,;11.34,-5.62,;10.53,-4.31,;8.99,-4.35,;12.88,-5.57,;14.22,-4.8,;14.22,-3.26,;15.56,-5.57,;16.89,-4.8,;18.22,-5.57,;18.22,-7.12,;19.56,-7.89,;20.9,-7.12,;22.24,-7.89,;20.89,-5.56,;22.22,-4.79,;19.56,-4.8,;.05,-6.57,;-1.3,-5.81,;-2.63,-6.6,)|
Oc1ccc(\C=C/C(=O)OC2CCCCC2OC(=O)\C=C/c2ccc(O)c(O)c2)cc1O
OC(=O)C(OC(=O)c1ccc(O)c(O)c1)C(OC(=O)c1ccc(O)c(O)c1)C(O)=O
O[C@@H]1C[C@](O)(CC(OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
OC(=O)C(OC(=O)c1cccc(O)c1O)C(OC(=O)c1cccc(O)c1O)C(O)=O
OC(=O)C(OC(=O)\C=C\c1ccc(O)c(O)c1)C(OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
Oc1ccc(\C=C/C(=O)OC2CCCC(C2)OC(=O)\C=C/c2ccc(O)c(O)c2)cc1O
Oc1ccc(\C=C\C(=O)OC2CCCCC2OC(=O)\C=C\c2ccc(O)c(O)c2)cc1O
OC(=O)C(OC(=O)c1cc(O)c(O)c(O)c1)C(OC(=O)c1cc(O)c(O)c(O)c1)C(O)=O
OC1C[C@@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
OC(=O)c1cc(OC(=O)\C=C\c2ccc(O)c(O)c2)cc(OC(=O)\C=C\c2ccc(O)c(O)c2)c1
OC(=O)C(OC(=O)Cc1ccc(O)c(O)c1)C(OC(=O)Cc1ccc(O)c(O)c1)C(O)=O
OC(=O)C(OC(=O)CCc1ccc(O)c(O)c1)C(OC(=O)CCc1ccc(O)c(O)c1)C(O)=O
Oc1ccc(\C=C\C(=O)OC2CCCC(C2)OC(=O)\C=C\c2ccc(O)c(O)c2)cc1O
Oc1ccc(\C=C\C(=O)OCCCCOC(=O)\C=C\c2ccc(O)c(O)c2)cc1O
Oc1ccc(\C=C/C(=O)OC2CCC(CC2)OC(=O)\C=C/c2ccc(O)c(O)c2)cc1O |(2.82,-12.69,;2.78,-11.15,;4.09,-10.34,;4.04,-8.83,;2.71,-8.06,;2.69,-6.54,;4.02,-5.76,;5.37,-6.52,;5.37,-8.06,;6.7,-5.75,;8.24,-5.69,;9.04,-7,;10.58,-6.95,;11.32,-5.61,;10.51,-4.3,;8.97,-4.34,;12.86,-5.56,;14.19,-4.79,;14.19,-3.25,;15.52,-5.56,;16.85,-4.79,;16.85,-3.25,;18.2,-2.48,;18.2,-.94,;16.85,-.17,;16.85,1.37,;15.52,-.96,;14.19,-.17,;15.52,-2.48,;1.38,-8.87,;1.42,-10.41,;.1,-11.21,)|
COC(=O)O[C@@]1(CC(OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H](O)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
O[C@@H]1C[C@](C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1O)(OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O |r|
c1cc(c(c2c1C(=O)c3c(ccc(c3C2=O)O)O)O)O
OC1CC(CC(O)C1OC(=O)\C=C/c1ccc(O)c(O)c1)(OC(=O)\C=C/c1ccc(O)c(O)c1)C(O)=O |(15.05,-16.52,;15.01,-17.81,;17.21,-17.81,;18.36,-19.35,;17.21,-20.79,;15.01,-20.79,;15.01,-22.3,;13.89,-19.35,;13.89,-20.72,;12.55,-21.55,;11.17,-20.79,;12.55,-23.21,;11.29,-23.94,;10.01,-23.12,;10.01,-21.68,;8.68,-20.98,;7.43,-21.74,;6.08,-21.04,;7.43,-23.21,;6.12,-23.98,;8.73,-23.91,;18.36,-20.91,;19.71,-21.65,;21.08,-20.95,;19.71,-23.22,;20.99,-23.87,;22.27,-22.99,;22.27,-21.34,;23.45,-20.5,;24.9,-21.25,;26.26,-20.6,;24.9,-23.05,;26.28,-23.65,;23.64,-23.68,;18.36,-17.81,;19.77,-16.98,;17.63,-16.39,)|
Oc1cccc(\C=N\N=C\c2cccc(O)c2O)c1O
Oc1ccc(CCC(=O)c2ccc(O)c(O)c2O)cc1O
CN(C)[C@H]1[C@@H]2C[C@H]3C(C(=O)C2C(=O)C(C(=O)NNC2(CCCC2)C([O-])=O)C1=O)C(=O)c1c(C)cccc1C3(C)O
CN(C)[C@H]1[C@@H]2C[C@H]3C(C(=O)C2C(=O)C(C(=O)NCN2CCN(CC2)C(N)=NC(N)=N)C1=O)C(=O)c1c(C)cccc1C3(C)O |w:26.28|
COC1\C=C\OC2(C)Oc3c(C2=O)c2c(O)c(C=NN4C(C)CN(Cc5ccc(cc5)[N+]([O-])=O)CC4C)c(NC(=O)\C(C)=C/C=C/C(C)C(O)C(C)C(O)C(C)C(OC(C)=O)C1C)c(O)c2c(O)c3C |c:45,t:3,47|
OC(CCc1ccc(O)c(O)c1)CC(=O)O[C@H]1Cc2cc(O)c(O)cc2O[C@H]1c1ccc(O)c(O)c1
COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)CO |r|
C[C@@H]1O[C@H](C[C@H](N)[C@@H]1O)OC1C[C@@](O)(Cc2c(O)c3C(=O)c4cccc(O)c4C(=O)c3c(O)c12)C(=O)CO
OC1CC(CC(OC(=O)\C=C/c2ccc(O)c(O)c2)C1O)(OC(=O)\C=C/c1ccc(O)c(O)c1)C(O)=O
Oc1ccc(\C=C(/C#N)C(=O)NCCCNC(=O)C(=C\c2ccc(O)c(O)c2)\C#N)cc1O
C[Si](C)(C)C
CN(C)[C@H]1[C@@H]2C[C@H]3C(C(=O)C2C(=O)C(C(=O)NCNC(CO)(CO)CO)C1=O)C(=O)c1c(C)cccc1C3(C)O
c1cc(c2c(c1NCCNCCO)C(=O)c3c(ccc(c3C2=O)O)O)NCCNCCO
Cc1cc(O)c2c3c1c1c(C)cc(O)c4c1c1c3c3c(c(O)cc(O)c3c2=O)c2c(O)cc(O)c(c12)c4=O
OC1C(CC(O)(CC1OC(=O)\C=C/c1ccc(O)c(O)c1)C(O)=O)OC(=O)\C=C/c1ccc(O)c(O)c1 |(5.46,-3.6,;5.46,-2.24,;6.59,-.7,;8.81,-.7,;9.95,-2.24,;9.95,-3.8,;8.81,-3.69,;6.59,-3.69,;6.59,-5.2,;7.98,-5.83,;9.35,-5.13,;7.98,-7.41,;9.28,-8.06,;10.55,-7.19,;10.55,-5.53,;11.74,-4.69,;13.18,-5.43,;14.54,-4.77,;13.18,-7.23,;14.57,-7.85,;11.91,-7.88,;9.95,-.68,;11.38,.16,;8.79,.5,;6.63,.6,;4.99,1.65,;3.59,.89,;4.99,3.31,;3.7,4.06,;2.43,3.26,;2.43,1.78,;1.1,1.09,;-.16,1.85,;-1.52,1.15,;-.16,3.31,;-1.48,4.11,;1.14,4.04,)|
c1c2c(c(c(c1O)O)O)C(=O)C(=CC=C2)O
Fc1ccc2[nH]cc(C(=O)CC(=O)c3nnn[nH]3)c2c1
COc1cc(Cn2nnnc2C(=O)CC(=O)c2c[nH]c3ccccc23)cc(OC)c1
COc1ccc(Cn2nnnc2C(=O)CC(=O)c2c[nH]c3ccc(Cl)cc23)cc1
COc1ccc(Cn2nnnc2C(=O)CC(=O)c2cc(OCc3ccccc3)cc(OCc3ccccc3)c2)cc1
COc1ccc(Cn2nnnc2C(=O)CC(=O)c2c[nH]c3ccccc23)cc1
CCOC(=O)C(=O)CC(=O)c1c[nH]c2ccc(Cl)cc12
OC(=O)c1ccc2[nH]cc(C(=O)CC(=O)c3nnn[nH]3)c2c1
OC(=O)C(=O)CC(=O)c1cc(C(=O)CC(=O)C(O)=O)c2ccccc2n1
OC(=O)C(=O)CC(=O)C1=CC=CC1 |c:10,t:8|
OC(=O)C(=O)CC(=O)CC(=O)c1cccnc1
OC(=O)C(=O)CC(=O)CCc1ccccc1Cl
OC(=O)C(=O)CC(=O)CC(=O)c1ccccc1C(F)(F)F
COc1ccccc1C(=O)CC(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)CCc1ccccc1Br
Clc1ccccc1C(=O)CC(=O)CC(=O)c1nnn[nH]1
OC(=O)C(=O)CC(=O)CCc1ccccc1
OC(=O)C(=O)CC(=O)CC(=O)c1ccccc1Cl
OC(=O)C(=O)CC(=O)CC(=O)c1ccc(cc1)-c1ccccc1
OC(=O)C(=O)CC(=O)CC(=O)c1ccccc1OCc1ccccc1
OC(=O)C(=O)CC(=O)CCc1ccc(Cl)c(Cl)c1
OC(=O)C(=O)CC(=O)CC(=O)c1cccc2ccccc12
OC(=O)C(=O)CC(=O)CC(=O)c1ccccn1
OC(=O)C(=O)CC(=O)CC(=O)c1cccc(Cl)c1
OC(=O)C(=O)CC(=O)CC(=O)c1ccccc1
OC(=O)C(=O)CC(=O)CC(=O)c1ccccc1F
OC(=O)C(=O)CC(=O)CC(=O)c1ccc2ccccc2c1
Fc1ccc(Cn2cccc2C(=O)CC(=O)c2nnn[nH]2)cc1
COOC(=O)c1cc2cc(O)c(O)cc2cn1
COOC(=O)c1ccc2c(O)c(O)ccc2c1
COOC(=O)c1cc2ccc(O)c(O)c2cn1
Oc1ccc(\C=C2/CNC\C(=C/c3ccc(O)c(O)c3)C2=O)cc1O
CCCn1cnnc1NS(=O)(=O)c1cc(C(=O)Nc2ccc(C)cc2)c(Cl)cc1S
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nnc2c(Cl)cc(cn12)C(F)(F)F
CCC(C)n1cnnc1NS(=O)(=O)c1cc(C(=O)Nc2ccc(C)cc2)c(Cl)cc1S
OC(=O)c1cc2ccccc2c(N=Nc2ccc(cc2)S(=O)(=O)Nc2nccs2)c1O |w:12.12|
Cc1cc2c(SC(NS2(=O)=O)C(C#N)C#N)cc1Cl
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc(N)nc2nc3ccccc3n12
O=C(CC(Sc1ncnc2nc[nH]c12)Sc1ncnc2nc[nH]c12)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)N=Nc1ccccc1 |w:42.48|
Fc1ccc(NC(=O)c2cc(c(S)cc2Cl)S(=O)(=O)Nc2nncn2-c2ccc(F)cc2)cc1
Cc1ccnc(NS(=O)(=O)c2ccc(cc2)N=Nc2cc3ccccc3c(C(O)=O)c2O)n1 |w:17.18|
Cc1cc(cc(n1)-n1nc(NS(=O)(=O)c2cc(C)c(Cl)cc2S)nc1N)C(F)(F)F
Cc1cc(c(S)cc1Cl)S(=O)(=O)NC(NNc1cccc(n1)C(F)(F)F)=NN |w:26.28|
Sc1cc(Cl)ccc1S(=O)(=O)Nc1nnc2CCc3ccccc3-n12
Sc1cc(Cl)c(cc1S(=O)(=O)Nc1nncn1-c1ccc(Cl)cc1)C(=O)Nc1ccccc1
Cc1ccc(Nc2nc(NS(=O)(=O)c3cc(C)c(Cl)cc3S)n(C)n2)cc1
Sc1cc(Cl)ccc1S(=O)(=O)Nc1nnc2c3ccccc3cnn12
CCCCn1cnnc1NS(=O)(=O)c1cc(C(=O)Nc2ccc(C)cc2)c(Cl)cc1S
Cc1csc2ncn3c(NS(=O)(=O)c4cc(C)c(Cl)cc4S)nnc3c12
Cc1cnc(NS(=O)(=O)c2ccc(cc2)N=Nc2cc3ccccc3cc2O)s1 |w:16.17|
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc(N)n(n1)-c1ccccn1
CN(C)c1nc(N)nc(NS(=O)(=O)c2cc(C)c(Cl)cc2S)n1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc(N)n(n1)-c1ccccc1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nnc2c(cc(Cl)cn12)C(F)(F)F
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nnc2cc(cc(C)n12)C(F)(F)F
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nnc2ccccn12
Cc1ccc(cc1)-n1cnnc1NS(=O)(=O)c1cc(C(=O)Nc2ccccc2)c(Cl)cc1S
Cc1cc2c(SC(NS2(=O)=O)c2c(O)[nH]c(=S)[nH]c2=O)cc1Cl
COc1cccc(Nc2nnc(NS(=O)(=O)c3cc(C)c(Cl)cc3S)[nH]2)c1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc(Nc2ccc(Cl)cc2)nn1C
Oc1cc(c[nH]c1=O)N=Nc1ccc(cc1)S(=O)(=O)Nc1ccccn1 |w:8.8|
CCCCn1cnnc1NS(=O)(=O)c1cc(C(=O)Nc2ccc(Cl)cc2)c(Cl)cc1S
CC1NN=C(S1)c1ccc(cc1)S(=O)(=O)Nc1sc(S)nc1O |c:3|
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2ccccc2nc1-c1ccc(Cl)cc1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nnc2c3ccccc3ccn12
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2ccccc2nc1-c1ccc(Br)cc1
Fc1ccc(cc1)-n1cnnc1NS(=O)(=O)c1cc(C(=O)Nc2ccc(Cl)cc2)c(Cl)cc1S
CC(=O)C(=NNc1ccc(cc1)S(=O)(=O)Nc1ccccn1)C(=O)Nc1ccccc1C |w:4.4|
Oc1nc(S)sc1NS(=O)(=O)c1ccc(cc1)-c1ncccn1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc(Nc2ccccc2)nn1C
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nnc(Nc2ccccc2)[nH]1
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nnc([nH]1)-c1ccc(Cl)cn1
Cc1[nH][nH]c(=O)c1N=Nc1ccc(cc1)S(=O)(=O)Nc1nccs1 |w:7.7|
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nnc2ccc3ccccc3n12
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2ccccc2nc1-c1cccc(c1)[N+]([O-])=O
Cc1cc(c(S)cc1Cl)S(=O)(=O)NC(Nc1ccc(Cl)cc1)=NN |w:22.24|
CC(=O)Oc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nnc(Nc2ccc(C)cc2)[nH]1
Cc1cc2c(SC(NS2(=O)=O)c2c(O)[nH]c(=O)[nH]c2=O)cc1Cl
CCCCn1cnnc1NS(=O)(=O)c1cc(C(=O)NCc2ccccc2)c(Cl)cc1S
CCOC(=O)C(C#N)C1NS(=O)(=O)c2cc(C)c(Cl)cc2S1
Cc1ccc(Nc2nnc(NS(=O)(=O)c3cc(C)c(Cl)cc3S)[nH]2)cc1
COc1cc(Nc2nnc(NS(=O)(=O)c3cc(C)c(Cl)cc3S)[nH]2)cc(OC)c1OC
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nnc2cnc3ccccc3n12
Cc1cc(c(S)cc1Cl)S(=O)(=O)Nc1nc2ccccc2[nH]1
Cc1ccc(cc1)-n1cnnc1NS(=O)(=O)c1cc(C(=O)Nc2ccc(Cl)cc2)c(Cl)cc1S
Oc1cc(c[nH]c1=O)N=Nc1ccc(cc1)S(=O)(=O)Nc1nccs1 |w:8.8|
CC(C)Cn1cnnc1NS(=O)(=O)c1cc(C(=O)Nc2ccc(C)cc2)c(Cl)cc1S
CCCn1cnnc1NS(=O)(=O)c1cc(C(=O)Nc2ccc(C)cc2)c(Cl)cc1SCC(O)=O
Fc1ccc(cc1)-n1cnnc1NS(=O)(=O)c1cc(C(=O)Nc2ccccc2)c(Cl)cc1S
COc1ccc(Nc2nnc(NS(=O)(=O)c3cc(C)c(Cl)cc3S)[nH]2)cc1
Fc1ccc(c(S)c1)S(=O)(=O)Nc1nnc2c3ccccc3ccn12
CCN(c1ccccc1)c1nc(N)nc(NS(=O)(=O)c2cc(C)c(Cl)cc2S)n1
COC(=O)CSc1cc(Cl)c(C)cc1S(=O)(=O)Nc1nnc(N)[nH]1
Cc1cc2c(SC(NS2(=O)=O)C(C#N)C(=O)c2ccccc2)cc1Cl
Cc1ccc(NC(=O)c2cc(c(S)cc2Cl)S(=O)(=O)Nc2nncn2Cc2ccccc2)cc1
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(ccc2c1=O)N1CCN(CC1)C(C)=O
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(ccc2c1=O)N1CCOCC1
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(ccc2c1=O)N(C)C
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(ccc2c1=O)N1CCN(CCCCl)CC1
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(ccc2c1=O)N1CCNCC1
CN1CCN(CC1)c1ccc2c(c1)n(Cc1ccc(F)cc1)cc(C(=O)\C=C(/O)C(O)=O)c2=O
CCN1CCN(CC1)c1ccc2c(c1)n(Cc1ccc(F)cc1)cc(C(=O)\C=C(/O)C(O)=O)c2=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(ccc2c1=O)N1CCSCC1
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(ccc2c1=O)N1CCOCC1
CN(C)c1ccc2c(c1)n(Cc1ccc(F)cc1)cc(C(=O)\C=C(/O)C(O)=O)c2=O
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(ccc2c1=O)N1CCN(CCCCl)CC1
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(ccc2c1=O)N1CCNCC1
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(ccc2c1=O)N1CCN(C)CC1
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2cc(ccc2c1=O)N1CCN(CC)CC1
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(cc2)C(F)(F)F)c2ccc(Cl)cc12
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(cc2)C(F)(F)F)c2ccc(F)cc12
Cc1cc(C)c(Cn2cc(C(=O)\C=C(/O)C(O)=O)c3cc(F)ccc23)c(C)c1
COc1ccc2n(Cc3cc(C)cc(C)c3)cc(C(=O)\C=C(/O)C(O)=O)c2c1
COc1ccc2n(Cc3c(C)cc(C)cc3C)cc(C(=O)\C=C(/O)C(O)=O)c2c1
Cc1c(c(c2cc(ccc2n1)Br)c3ccc(cc3)Cl)[C@@H](C(=O)O)OC
CC(C)O[C@H](C(O)=O)c1c(C)nc2ccc(Br)cc2c1-c1ccc(Cl)cc1 |r|
Cc1nc2ccc(F)cc2c(-c2ccc(Cl)cc2)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc2nc(C)c([C@H](OC(C)(C)C)C(O)=O)c(-c3ccc(Cl)cc3)c2c1 |r|
Cc1c(c(c2ccccc2n1)c3ccc(cc3)Cl)[C@@H](C(=O)O)OC(C)(C)C
Cc1nc2cc(F)ccc2c(-c2ccc(Cl)cc2)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1nc2cc(Cl)ccc2c(-c2ccc(Cl)cc2)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1ccc2c(-c3ccc(Cl)cc3)c([C@H](OC(C)(C)C)C(O)=O)c(C)nc2c1 |r|
Cc1nc2ccc(Cl)cc2c(-c2ccccc2)c1CC(O)=O
Cc1nc2ccc(Br)cc2c(-c2ccccc2)c1CC(O)=O
Cc1nc2ccccc2c(-c2ccccc2)c1CC(O)=O
Cc1ccc(cc1)-c1c(CC(O)=O)c(C)nc2ccc(Br)cc12
Cc1nc2ccc(Br)cc2c(-c2ccc(Cl)cc2)c1CC(O)=O
Cc1nc2ccccc2c(-c2ccc(Cl)cc2)c1CC(O)=O
CC(C(O)=O)c1c(C)nc2ccc(Br)cc2c1-c1ccc(Cl)cc1
CCCC(C(O)=O)c1c(C)nc2ccc(Br)cc2c1-c1ccc(Cl)cc1
CO[C@@H](C(O)=O)c1c(C)nc2ccc(Br)cc2c1-c1ccc(Cl)cc1 |r|
ON1C(=O)C(C(=O)NCc2ccc(F)cc2)c2ccc(Cl)cc2C1=O
ON1C(=O)C(C(=O)NCc2ccc(F)cc2)c2ccc(Br)cc2C1=O
ON1C(=O)C(C(=O)NCc2ccc(F)cc2)c2ccc(cc2C1=O)C(F)(F)F
Oc1c(C(=O)NCc2ccc(F)cc2)c2ccc(cc2c(=O)n1O)C#N
CC(=O)Nc1ccc2C(C(=O)NCc3ccc(F)cc3)C(=O)N(O)C(=O)c2c1
ON1C(=O)C(C(=O)NCc2ccc(F)cc2)c2ccc(NC(=O)c3ccccc3)cc2C1=O
ON1C(=O)C(C(=O)NCc2ccc(F)cc2)c2ccc(NC(=O)c3ccccn3)cc2C1=O
ON1C(=O)C(C(=O)NCc2ccc(F)cc2)c2ccc(NC(=O)Cc3ccccc3)cc2C1=O
ON1C(=O)C(C(=O)NCc2ccc(F)cc2)c2ccc(NC(=O)Cc3cccs3)cc2C1=O
CCCCCCNC(=O)c1c(O)n(O)c(=O)c2cc(ccc12)[N+]([O-])=O
Oc1c(C(=O)Nc2ccccc2)c2ccc(cc2c(=O)n1O)[N+]([O-])=O
Oc1c(C(=O)NCc2ccccc2)c2ccc(cc2c(=O)n1O)[N+]([O-])=O
Oc1c(C(=O)Nc2ccc(F)cc2)c2ccc(cc2c(=O)n1O)[N+]([O-])=O
Oc1c(C(=O)NCCc2ccc(F)cc2)c2ccc(cc2c(=O)n1O)[N+]([O-])=O
COc1ccc(CNC(=O)c2c(O)n(O)c(=O)c3cc(ccc23)[N+]([O-])=O)cc1
COc1ccc2C(C(=O)NCc3ccc(F)cc3)C(=O)N(O)C(=O)c2c1
COc1ccc2c(C(=O)NCc3ccc(F)cc3)c(O)n(O)c(=O)c2c1
Oc1c(C(=O)NCc2ccc(F)cc2)c2cc(ccc2c(=O)n1O)[N+]([O-])=O
Nc1ccc2C(C(=O)NCc3ccc(F)cc3)C(=O)N(O)C(=O)c2c1
ON1C(=O)C(C(=O)NCc2ccc(F)cc2)c2ccc(F)cc2C1=O
ON1C(=O)C(C(=O)NCc2ccc(F)cc2)c2cc(F)ccc2C1=O
ON1C(=O)C(C(=O)NCc2ccc(F)cc2)c2cccc(F)c2C1=O
c1cc(ccc1C2=CC(=O)c3c(cc(cc3O2)O)O)O
Oc1ccc(cc1)-c1cc(=O)c2c(O)cc(OCc3ccc(F)cc3)cc2o1
CC(C)(C)Oc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)cc1
Oc1ccc(cc1)-c1cc(=O)c2c(O)cc(cc2o1)N1CCOCC1
c1ccc(cc1)C2=CC(=O)c3c(cc(cc3O2)O)O
Oc1cc(OCc2ccc(F)cc2)cc2oc(cc(=O)c12)-c1ccccc1
CC(C)(C)Oc1cc(O)c2c(c1)oc(cc2=O)-c1ccccc1
Oc1cc(cc2oc(cc(=O)c12)-c1ccccc1)N1CCOCC1
Oc1ccc(cc1)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 |r|
CC(C)(C)Oc1cc(O)c2C(=O)C[C@H](Oc2c1)c1ccc(O)cc1 |r|
c1cc(ccc1C2=COc3cc(cc(c3C2=O)O)O)O
Oc1ccc(cc1)-c1coc2cc(OCc3ccc(F)cc3)cc(O)c2c1=O
CC(C)(C)Oc1cc(O)c2c(c1)occ(-c1ccc(O)cc1)c2=O
Oc1ccc(cc1)-c1coc2cc(cc(O)c2c1=O)N1CCOCC1
Oc1cc(O)c2c(c1)oc(-c1ccc3OC(Oc3c1)(c1ccccc1)c1ccccc1)c(O)c2=O
Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(OCc1ccc(F)cc1)c2=O
Oc1cc(OCc2ccc(F)cc2)c2c(c1)oc(c(O)c2=O)-c1ccc(O)c(O)c1
Oc1cc(O)c2c(c1)oc(c(O)c2=O)-c1ccc(O)c(OCc2ccc(F)cc2)c1
Oc1cc(O)c2c(c1)oc(c(O)c2=O)-c1ccc(OCc2ccc(F)cc2)c(O)c1
CC(C)(C)Oc1cc2oc(cc(=O)c2c(O)c1O)-c1ccccc1
Oc1ccc(cc1O)-c1cc(=O)c2c(O)cc(cc2o1)N1CCOCC1
Oc1ccc(cc1)[C@@H]1CC(=O)c2c(O)cc(OCc3ccc(F)cc3)cc2O1 |r|
Oc1ccc(cc1O)-c1oc2cc(OCc3ccc(F)cc3)cc(O)c2c(=O)c1O
Oc1ccc(cc1O)-c1oc2cc(cc(O)c2c(=O)c1O)N1CCOCC1
Oc1c(O)c2c(cc1OCc1ccc(F)cc1)oc(cc2=O)-c1ccccc1
Oc1ccc(cc1O)-c1cc(=O)c2c(O)cc(OCc3ccc(F)cc3)cc2o1
On1c2ncccc2c(Nc2ccc(cc2)-c2ccccc2)c(C(=O)NCc2ccc(F)cc2F)c1=O
On1c2ncccc2c(Nc2ccc-3c(Cc4ccccc-34)c2)c(C(=O)NCc2ccc(F)cc2F)c1=O
On1c2ncccc2c(Nc2ccc(cc2)-c2ccc(cc2)C#N)c(C(=O)NCc2ccc(F)cc2F)c1=O
Nc1ccc(cc1)-c1ccc(Nc2c(C(=O)NCc3ccc(F)cc3F)c(=O)n(O)c3ncccc23)cc1
On1c2ncccc2c(Nc2ccccc2)c(C(=O)NCc2ccc(F)cc2F)c1=O
CNc1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12
CN(C)c1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12
On1c2ncccc2c(N2CCOCC2)c(C(=O)NCc2ccc(F)cc2F)c1=O
On1c2ncccc2c(NC2CCCCCC2)c(C(=O)NCc2ccc(F)cc2F)c1=O
On1c2ncccc2c(NCCc2ccccc2)c(C(=O)NCc2ccc(F)cc2F)c1=O
On1c2ncccc2c(NCCCCc2ccccc2)c(C(=O)NCc2ccc(F)cc2F)c1=O
CCCCCNc1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12
CC(C)Nc1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12
NCCNc1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12
OCCNc1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12
CC(=O)OCCNc1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12
COC(=O)CNC1=C(C(=O)N(c2c1cccn2)O)C(=O)NCc3ccc(cc3F)F
COC(=O)[C@H](C)Nc1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12 |r|
COC(=O)[C@@H](C)Nc1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12 |r|
COC(=O)[C@@H](Nc1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12)c1ccccc1 |r|
COC(=O)[C@H](Nc1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12)c1ccccc1 |r|
COC(=O)[C@H](CO)Nc1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12 |r|
COC(=O)[C@@H](CO)Nc1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12 |r|
CCOC(=O)[C@@H]1CCCN1c1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12 |r|
Nc1c(C(=O)NCc2ccc(F)cc2F)c(=O)n(O)c2ncccc12
Cc1nc2ccccc2c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1nc2c(ccc3ccccc23)c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1nc-2c(Cc3ccccc-23)c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1nc-2c(CCCc3ccccc-23)c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O |r|
Cc1nc(c(C)c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O)-c1ccccc1 |r|
Cc1ccc(cc1)-c1nc(C)c([C@H](OC(C)(C)C)C(O)=O)c(c1C)-c1ccc2OCCCc2c1 |r|
Cc1ccc(cc1C)-c1nc(C)c([C@H](OC(C)(C)C)C(O)=O)c(c1C)-c1ccc2OCCCc2c1 |r|
Cc1cc(ccc1Cl)-c1nc(C)c([C@H](OC(C)(C)C)C(O)=O)c(c1C)-c1ccc2OCCCc2c1 |r|
Cc1nc(c(C)c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O)-c1cccc(c1)-c1cnn(C)c1 |r|
Cc1nc(c(C)c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O)-c1cccc(c1)-c1ccnn1C |r|
Cc1nc(c(C)c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O)-c1ccc(cc1)-c1ccncc1 |r|
Cc1noc(C)c1-c1ccc(c(F)c1)-c1nc(C)c([C@H](OC(C)(C)C)C(O)=O)c(c1C)-c1ccc2OCCCc2c1 |r|
Cc1ccc(cc1C)-c1nc(C)c([C@H](OC(C)(C)C)C(O)=O)c(c1C)-c1ccc2OCCCc2c1C |r,wD:13.14,(7.91,-29.19,;9.24,-28.42,;10.59,-29.18,;11.91,-28.41,;11.9,-26.87,;10.57,-26.1,;9.24,-26.87,;7.91,-26.11,;13.23,-26.1,;14.57,-26.87,;15.9,-26.09,;17.24,-26.86,;15.9,-24.55,;17.22,-23.77,;17.22,-22.23,;18.54,-21.45,;18.54,-19.91,;19.88,-22.21,;19.87,-20.67,;18.56,-24.53,;19.89,-23.75,;18.57,-26.07,;14.56,-23.79,;13.23,-24.56,;11.9,-23.79,;14.55,-22.24,;13.22,-21.5,;13.2,-19.96,;14.55,-19.18,;14.54,-17.65,;15.87,-16.89,;17.2,-17.66,;17.19,-19.19,;15.87,-19.94,;15.88,-21.48,;15.87,-23.02,)|
Cc1ccc(cc1C)-c1nc(C)c([C@H](OC(C)(C)C)C(O)=O)c(c1C)-c1ccc2OCCNc2c1Cl |r,wD:13.14,(7.91,-29.19,;9.24,-28.41,;10.59,-29.18,;11.91,-28.41,;11.9,-26.87,;10.57,-26.1,;9.24,-26.87,;7.91,-26.1,;13.23,-26.1,;14.57,-26.87,;15.9,-26.09,;17.24,-26.86,;15.89,-24.54,;17.22,-23.77,;17.21,-22.22,;18.54,-21.45,;18.53,-19.91,;19.88,-22.21,;19.87,-20.67,;18.56,-24.53,;19.89,-23.75,;18.57,-26.07,;14.56,-23.78,;13.23,-24.56,;11.9,-23.79,;14.55,-22.24,;13.22,-21.49,;13.2,-19.96,;14.55,-19.18,;14.54,-17.65,;15.87,-16.89,;17.19,-17.66,;17.19,-19.19,;15.87,-19.94,;15.88,-21.48,;15.87,-23.02,)|
Cc1ccc(cc1C)-c1nc(C)c([C@H](OC(C)(C)C)C(O)=O)c(c1C)-c1ccc(Cl)cc1 |r|
Cc1noc(C)c1-c1ccc(cc1)-c1nc(C)c([C@H](OC(C)(C)C)C(O)=O)c(-c2ccc(Cl)cc2)c1C |r|
Oc1c(ncc2cccnc12)C(=O)NCc1ccc(Cl)cc1
OC(=O)c1ncc2cccnc2c1O
On1c2ncccc2c(NCc2ccc(F)cc2)nc1=O
On1c2ncccc2c(nc1=O)N1CCC(F)(F)CC1
On1c2ncccc2c(NCC2CC2)nc1=O
On1c2ncccc2c(Nc2ccc(cc2)-c2ccccc2)nc1=O
On1c2ncccc2c(NCc2ccc(cc2)-c2ccccc2)nc1=O
On1c2ncccc2c(Nc2ccc(cc2)-c2ccncc2)nc1=O
On1c2ncccc2c(NCc2ccc(cc2)-c2ccncc2)nc1=O
On1c2ncccc2c(Nc2ccc(cc2)N2CCOCC2)nc1=O
On1c2ncccc2c(NCc2ccc(cc2)N2CCOCC2)nc1=O
On1c2ncccc2c(Nc2ccc(CN3CCOCC3)cc2)nc1=O
On1c2ncccc2c(NCc2cccc(c2)N2CCOCC2)nc1=O
On1c2ncccc2c(NCc2cccc(CN3CCOCC3)c2)nc1=O
Cc1ccc(CNC(=O)c2nc([nH]c(=O)c2O)-c2ccc(F)cc2)cc1C
Oc1c(nc([nH]c1=O)-c1ccc(F)cc1)C(=O)NCc1ccc(F)c(F)c1
Oc1c(nc([nH]c1=O)-c1ccc(F)cc1)C(=O)NCc1ccc(Br)cc1
Oc1c(nc([nH]c1=O)-c1ccc(F)cc1)C(=O)NCc1ccc(Cl)cc1
Oc1c(nc([nH]c1=O)-c1ccc(F)cc1)C(=O)NCc1ccc(F)cc1
Oc1c(nc([nH]c1=O)-c1cccc(F)c1)C(=O)NCc1ccc(F)cc1
Oc1c(nc([nH]c1=O)-c1ccc(Br)cc1)C(=O)NCc1ccc(F)cc1
Oc1c(nc([nH]c1=O)-c1ccccc1F)C(=O)NCc1ccc(F)cc1
Oc1c(nc([nH]c1=O)-c1ccc(Cl)cc1)C(=O)NCc1ccc(F)cc1
Oc1c(nc(Cc2ccc(F)cc2)[nH]c1=O)C(=O)NCc1ccc(F)cc1
Oc1c(nc([nH]c1=O)-c1ccccc1)C(=O)NCc1ccc(F)cc1
Oc1nc(nc(C(=O)NCc2ccccc2)c1O)-c1ccccc1
Oc1c(nc([nH]c1=O)-c1ccc(F)cc1)C(=O)NCc1cc(F)c(F)c(F)c1
Oc1c(nc([nH]c1=O)-c1ccc(F)cc1)C(=O)NCc1ccc(F)c(Cl)c1
Oc1c(nc([nH]c1=O)-c1ccc(F)cc1)C(=O)NCc1cccc(Cl)c1F
Oc1c(nc([nH]c1=O)-c1ccc(F)cc1)C(=O)NCc1ccccc1F
Oc1c(nc([nH]c1=O)-c1ccc(F)cc1)C(=O)NCc1cccc(F)c1
Oc1ccc(CNC(=O)c2nc([nH]c(=O)c2O)-c2ccc(F)cc2)cc1
Oc1c(nc([nH]c1=O)-c1ccc(F)cc1)C(=O)NCc1cccc(Cl)c1
Oc1c(nc([nH]c1=O)-c1ccc(F)cc1)C(=O)NCCc1ccc(F)cc1
COc1ccc(CNC(=O)c2nc([nH]c(=O)c2O)-c2ccc(F)cc2)cc1
COc1cccc2n(Cc3cc(C)cc(C)c3)cc(C(=O)\C=C(/O)C(O)=O)c12
Cc1cc(C)cc(Cn2cc(C(=O)\C=C(/O)C(O)=O)c3c(O)cccc23)c1
Cn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C1(C)CCCS1
Cn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C1(C)CCCO1
CSC1COCC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Cn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C1COCC1O
Cn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C1CCOC1
Cn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C1=CCOC1 |t:22|
Cn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)-c1ccco1
Cn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C1CCCCO1
Cn1c(nc(C(=O)NCc2ccc(F)cc2S(C)(=O)=O)c(O)c1=O)C1CCOC1
CN(C)S(=O)(=O)c1cc(F)ccc1CNC(=O)c1nc(C2CCOC2)n(C)c(=O)c1O
Cn1c(nc(C(=O)NCc2ccc(F)cc2N2CCCCS2(=O)=O)c(O)c1=O)C1CCOC1
Cn1c(nc(C(=O)NCc2ccc(F)cc2-n2cncn2)c(O)c1=O)C1CCOC1
Cc1ncnn1-c1cc(F)ccc1CNC(=O)c1nc(C2CCOC2)n(C)c(=O)c1O
Cc1cnnn1-c1cc(F)ccc1CNC(=O)c1nc(C2CCOC2)n(C)c(=O)c1O
Cn1ncnc1-c1cc(F)ccc1CNC(=O)c1nc(C2CCOC2)n(C)c(=O)c1O
Cn1cnnc1-c1cc(F)ccc1CNC(=O)c1nc(C2CCOC2)n(C)c(=O)c1O
Cn1c(nc(C(=O)NCc2ccc(F)cc2N2CCN(C(C)(C)C)S2(=O)=O)c(O)c1=O)C1CCOC1
CN1C(C)(C)CN(c2cc(F)ccc2CNC(=O)c2nc(C3CCOC3)n(C)c(=O)c2O)S1(=O)=O
CN1CCN(C1=O)c1cc(F)ccc1CNC(=O)c1nc(C2CCOC2)n(C)c(=O)c1O
COCCN1CCN(C1=O)c1cc(F)ccc1CNC(=O)c1nc(C2CCOC2)n(C)c(=O)c1O
Cn1c(nc(C(=O)NCc2ccc(F)cc2S(C)(=O)=O)c(O)c1=O)C1CCOCC1
CN(C)S(=O)(=O)c1cc(F)ccc1CNC(=O)c1nc(C2CCOCC2)n(C)c(=O)c1O
Cn1c(nc(C(=O)NCc2ccc(F)cc2N2CCCCS2(=O)=O)c(O)c1=O)C1CCOCC1
Cn1c(nc(C(=O)NCc2ccc(F)cc2-n2cncn2)c(O)c1=O)C1CCOCC1
Cc1ncnn1-c1cc(F)ccc1CNC(=O)c1nc(C2CCOCC2)n(C)c(=O)c1O
Cc1cnnn1-c1cc(F)ccc1CNC(=O)c1nc(C2CCOCC2)n(C)c(=O)c1O
Cn1ncnc1-c1cc(F)ccc1CNC(=O)c1nc(C2CCOCC2)n(C)c(=O)c1O
Cn1c(nc(C(=O)NCc2ccc(F)cc2N2CCN(C(C)(C)C)S2(=O)=O)c(O)c1=O)C1CCOCC1
CN1C(C)(C)CN(c2cc(F)ccc2CNC(=O)c2nc(C3CCOCC3)n(C)c(=O)c2O)S1(=O)=O
Cn1c(nc(C(=O)NCc2ccc(F)cc2)c(O)c1=O)C1CCOCC1
COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)N2CCN(C)CC2)c1=O
COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)N2CCOCC2)c1=O
COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)N2CCCCC2)c1=O
COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)N2CCCC2)c1=O
COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)NCCN(C)C)c1=O
COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)NCC(F)(F)F)c1=O
COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)NC(C)C)c1=O
COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)NC2CCC2)c1=O
COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)NC2CC2)c1=O
CN(C)C(=O)Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NC2(CO)CCCC2)c1=O
C[C@@H](O)CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)N(C)C)c1=O |r|
C[C@H](O)CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)N(C)C)c1=O |r|
CN(C)C(=O)Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NCCN2CCOCC2)c1=O
COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(N)=O)c1=O
CNC(=O)Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NCCOC)c1=O
CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)NCCOC)c1=O
CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)NCCN(C)C)c1=O
CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)NOC)c1=O
CN(C)C(=O)Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NC2CC2)c1=O
CN(C)C(=O)Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NCCO)c1=O
COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)N(C)C)c1=O
C[C@H](CO)NC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)N(C)C)c1=O |r|
C[C@@H](CO)NC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)N(C)C)c1=O |r|
CN(C)C(=O)Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NC(C)(C)CO)c1=O
CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)NCC2CC2)c1=O
CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)NCC(F)(F)F)c1=O
CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)NC(C)(C)C)c1=O
CCN(CC)C(=O)Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NC)c1=O
CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)N2CCCC2)c1=O
CCCNC(=O)Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NC)c1=O
CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)NC(C)C)c1=O
CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)NC2CC2)c1=O
CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(=O)N(C)C)c1=O
CCNC(=O)Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NC)c1=O
CNC(=O)Cn1c2cc(Cc3ccc(F)cc3)cnc2c(O)c(C(=O)NC)c1=O
CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CC(N)=O)c1=O
OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(cc3=O)-c2ccc(O)c(O)c2)[C@H](OS(O)(=O)=O)[C@@H](O)[C@@H]1O |r|
COc1c(nc(Cc2ccc(O)cc2)n(C)c1=O)C(=O)N1CCN(CCCNC(=O)c2ccc(O)c(O)c2)CC1
COc1c(nc(Cc2ccc(F)cc2)n(C)c1=O)C(=O)N1CCN(CCCNC(=O)c2ccc(O)c(O)c2)CC1
COc1c(nc(Cc2ccccc2)n(C)c1=O)C(=O)N1CCN(CCCNC(=O)c2ccc(O)c(O)c2)CC1
COc1c(nc(Cc2ccc(O)cc2)n(C)c1=O)C(=O)N1CCN(CCNC(=O)c2cc(O)c(O)c(O)c2)CC1
COc1c(nc(Cc2ccc(F)cc2)n(C)c1=O)C(=O)N1CCN(CCNC(=O)c2cc(O)c(O)c(O)c2)CC1
COc1c(nc(Cc2ccccc2)n(C)c1=O)C(=O)N1CCN(CCNC(=O)c2cc(O)c(O)c(O)c2)CC1
COc1c(nc(Cc2ccc(Cl)c(Cl)c2)n(C)c1=O)C(=O)N1CCN(CCCNC(=O)c2cc(O)c(O)c(O)c2)CC1
COc1c(nc(Cc2ccc(C)cc2)n(C)c1=O)C(=O)N1CCN(CCCNC(=O)c2cc(O)c(O)c(O)c2)CC1
COc1c(nc(Cc2ccc(F)cc2)n(C)c1=O)C(=O)N1CCN(CCCNC(=O)c2cc(O)c(O)c(O)c2)CC1
COc1c(nc(Cc2ccc(Cl)cc2)n(C)c1=O)C(=O)N1CCN(CCCNC(=O)c2cc(O)c(O)c(O)c2)CC1
COc1c(nc(Cc2ccccc2)n(C)c1=O)C(=O)N1CCN(CCCNC(=O)c2cc(O)c(O)c(O)c2)CC1
ON1C(=O)Cc2cc(Cc3ccccc3)ccc2C1=O
Cc1ccc(Cc2ccc3C(=O)N(O)C(=O)Cc3c2)cc1
ON1C(=O)Cc2cc(Cc3ccc(F)cc3)ccc2C1=O
ON1C(=O)Cc2cc(Cc3ccc(Cl)cc3)ccc2C1=O
ON1C(=O)Cc2cc(Cc3ccc(Br)cc3)ccc2C1=O
ON1C(=O)Cc2cc(Cc3ccc(cc3)C(F)(F)F)ccc2C1=O
ON1C(=O)Cc2cc(Cc3ccc(F)cc3F)ccc2C1=O
ON1C(=O)Cc2cc(Cc3ccc(cc3)C3CC3)ccc2C1=O
ON1C(=O)Cc2cc(Cc3ccc(cc3)-c3ccccc3)ccc2C1=O
ON1C(=O)Cc2cc(Cc3ccc(cc3)-c3cccs3)ccc2C1=O
ON1C(=O)Cc2cc(Cc3ccc(cc3)-c3ccc(F)cc3)ccc2C1=O
ON1C(=O)Cc2cc(Cc3ccc(cc3)-c3ccc(cc3)C#N)ccc2C1=O
COc1ccc(cc1)-c1ccc(Cc2ccc3C(=O)N(O)C(=O)Cc3c2)cc1
CS(=O)(=O)c1ccc(cc1)-c1ccc(Cc2ccc3C(=O)N(O)C(=O)Cc3c2)cc1
NS(=O)(=O)c1ccc(cc1)-c1ccc(Cc2ccc3C(=O)N(O)C(=O)Cc3c2)cc1
NC(=O)c1ccc(cc1)-c1ccc(Cc2ccc3C(=O)N(O)C(=O)Cc3c2)cc1
ON1C(=O)Cc2cc(Cc3ccc(cc3)-c3ccc(F)cc3F)ccc2C1=O
ON1C(=O)Cc2cc(Cc3ccc(cc3)-c3ccc(cc3C(F)(F)F)C(F)(F)F)ccc2C1=O
COc1ccc(cc1F)-c1ccc(Cc2ccc3C(=O)N(O)C(=O)Cc3c2)cc1
Cc1ccc(cc1)S([O-])(=O)=O.ON1C(=O)Cc2cc(Cc3ccc(cc3)-c3cc[nH+]cc3)ccc2C1=O
CCOC(=O)C(\O)=C\C(=O)\C=C\c1cccn1Cc1ccc(F)cc1
CCOC(=O)C(\O)=C\C(=O)\C=C\c1cccn1Cc1ccc(F)c(F)c1
CCOC(=O)C(\O)=C\C(=O)\C=C\c1ccn(Cc2ccc(F)cc2)c1
CCOC(=O)C(\O)=C\C(=O)\C=C\c1cc(cn1Cc1ccc(F)cc1)-c1ccccc1
CCOC(=O)C(\O)=C\C(=O)\C=C\c1cc(cn1C)C(=O)c1ccc(F)cc1
CCOC(=O)C(\O)=C\C(=O)\C=C\c1cc(cn1-c1ccccc1)C(=O)c1ccc(F)cc1
CCOC(=O)C(\O)=C\C(=O)\C=C\c1cc(cn1Cc1ccccc1)C(=O)c1ccc(F)cc1
CCOC(=O)C(\O)=C\C(=O)c1ccn(Cc2ccc(F)cc2)c1
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)cc1-c1ccccc1
CCOC(=O)C(\O)=C\C(=O)\C=C\c1cn(Cc2ccc(F)cc2)cc1-c1ccccc1
CCOC(=O)C(\O)=C\C(=O)c1cccn1Cc1ccc(F)cc1
CCOC(=O)C(\O)=C\C(=O)c1cc(cn1Cc1ccc(F)cc1)-c1ccccc1
OC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)cc1-c1ccccc1
C\C(=C(\O)C(O)=O)C(=O)c1cn(Cc2ccc(F)cc2)cc1-c1ccccc1
OC(=O)C(\O)=C\C(=O)c1ccn(Cc2ccc(F)cc2)c1
N\C(=C/C(=O)c1cn(Cc2ccc(F)cc2)cc1-c1ccccc1)C(O)=O
OC(=O)C(\O)=C\C(=O)\C=C\c1cc(cn1Cc1ccccc1)C(=O)c1ccc(F)cc1
OC(=O)C(\O)=C\C(=O)\C=C\c1cc(cn1-c1ccccc1)C(=O)c1ccc(F)cc1
OC(=O)C(\O)=C\C(=O)\C=C\c1cc(cn1Cc1ccc(F)cc1)-c1ccccc1
OC(=O)C(\O)=C\C(=O)\C=C\c1ccn(Cc2ccc(F)cc2)c1
OC(=O)C(\O)=C\C(=O)\C=C\c1cn(Cc2ccc(F)cc2)cc1-c1ccccc1
OC(=O)C(\O)=C\C(=O)c1cc(cn1Cc1ccc(F)cc1)-c1ccccc1
O\C(=C/C(=O)c1cccn1Cc1ccc(F)cc1)c1nc[nH]n1
c1ccc2c(c1)CC(=O)N2Cc3ccc4c(c3C(=O)O)OCO4
OC(=O)\C=C\c1ccc2N(Cc3ccc4OCOc4c3C(O)=O)C(=O)Cc2c1
Cn1nc(cc1N)-c1cccs1
c1cc2c(cc1O)OCO2
Cn1nc(cc1N)-c1cc2OCOc2c(Br)c1
[H][C@]12Cn3cc(C(=O)NCc4ccc(F)cc4)c(=O)c(O)c3C(=O)N1CCCO2 |r|
Oc1c2C(=O)N3CCCN3Cc2cc2cc(Cc3cccc(Cl)c3F)cnc12
Oc1c2C(=O)N3CCCN3Cc2c(C#N)c2cc(Cc3cccc(Cl)c3F)cnc12
[H][C@]12CCCN1C(=O)c1c(O)c3ncc(Cc4cccc(Cl)c4F)cc3c(C#N)c1C2 |r|
[H][C@@]12CCCN1C(=O)c1c(O)c3ncc(Cc4cccc(Cl)c4F)cc3c(C#N)c1C2 |r|
[H][C@]12CCCCN1C(=O)c1c2c(C#N)c2cc(Cc3cccc(Cl)c3F)cnc2c1O |r|
[H][C@@]12CCCCN1C(=O)c1c2c(C#N)c2cc(Cc3cccc(Cl)c3F)cnc2c1O |r|
[H][C@]12CCCN1C(=O)c1c2c(C#N)c2cc(Cc3cccc(Cl)c3F)cnc2c1O |r|
[H][C@@]12CCCN1C(=O)c1c2c(C#N)c2cc(Cc3cccc(Cl)c3F)cnc2c1O |r|
[H][C@]12CCCN1C(=O)c1c(O)c3ncc(Cc4cccc(Cl)c4F)cc3c(C(N)=O)c1C2 |r|
[H][C@@]12CCCN1C(=O)c1c(O)c3ncc(Cc4cccc(Cl)c4F)cc3c(C(N)=O)c1C2 |r|
[H][C@]12CCCCN1C(=O)c1c2c(C(N)=O)c2cc(Cc3cccc(Cl)c3F)cnc2c1O |r|
[H][C@@]12CCCCN1C(=O)c1c2c(C(N)=O)c2cc(Cc3cccc(Cl)c3F)cnc2c1O |r|
CCCCCCNC(=O)C1C(=O)N(O)C(=O)c2ccccc12
CCCCCCCNC(=O)C1C(=O)N(O)C(=O)c2ccccc12
CCCNC(=O)C1C(=O)N(O)C(=O)c2ccccc12
CC(C)NC(=O)C1C(=O)N(O)C(=O)c2ccccc12
CCCCNC(=O)C1C(=O)N(O)C(=O)c2ccccc12
CC(C)(C)NC(=O)C1C(=O)N(O)C(=O)c2ccccc12
CCCCN(C)C(=O)C1C(=O)N(O)C(=O)c2ccccc12
CCN(CC)C(=O)C1C(=O)N(O)C(=O)c2ccccc12
ON1C(=O)C(C(=O)NC2CCCCC2)c2ccccc2C1=O
ON1C(=O)C(C(=O)N2CCCCC2)c2ccccc2C1=O
CCCCCCCCNC(=O)C1C(=O)N(O)C(=O)c2ccccc12
ON1C(=O)C(C(=O)NC2CC2)c2ccccc2C1=O
CCCCCNC(=O)C1C(=O)N(O)C(=O)c2ccccc12
ON1C(=O)C(C(=O)NC2CCCC2)c2ccccc2C1=O
CCCCCCCCCNC(=O)C1C(=O)N(O)C(=O)c2ccccc12