SMILES for N-glycosylase/DNA lyase

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(OCCOC4CCCCC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-11.69,3.17,;-12.15,1.68,;-11.1,.53,;-9.58,.81,;-8.58,-.3,;-7.09,.04,;-6.09,-1.07,;-6.53,-2.61,;-4.55,-.81,;-4.06,.65,;-2.55,.94,;-1.52,-.14,;-2.01,-1.63,;-3.52,-1.94,;-.06,.17,;1.12,-.89,;1.12,-2.43,;2.48,-3.17,;3.77,-2.43,;3.77,-.89,;5.1,-.09,;6.49,-.86,;7.74,-.12,;9.1,-.89,;10.44,-.09,;11.79,-.82,;13.1,-.02,;13.1,1.52,;11.79,2.25,;10.44,1.45,;2.43,-.12,;2.1,1.42,;.61,1.53,;-.16,2.91,;-9.07,-1.76,;-10.56,-2.07,;-11.61,-.94,;-13.1,-1.3,)|

BDBM670057

Clc1ccc(NC(=O)N2CCC(CC2)n2c3ccc(Cl)cc3[nH]c2=O)cc1

BDBM670058

Clc1ccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c2c1

BDBM670059

Clc1ccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c2c1

BDBM670060

Cc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670061

COc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670062

Oc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670063

Cc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)cc3)c(=O)[nH]c12

BDBM670064

COc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)cc3)c(=O)[nH]c12

BDBM670065

Oc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670066

Ic1ccc(NC(=O)N2CCC(CC2)n2c3ccc(cc3[nH]c2=O)C#N)cc1

BDBM670067

Cc1ccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c2c1

BDBM670068

Fc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670069

c1cc2c(c(c1)Br)NC(=O)N2C3CCN(CC3)C(=O)Nc4ccc(cc4)I

BDBM670070

COc1ccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c2c1

BDBM670071

Fc1ccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c2c1

BDBM670072

COC(=O)Cc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670073

Clc1ccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)c(Cl)c3)c(=O)[nH]c2c1

BDBM670074

CCOc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670075

CNc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670076

c1cc(c2c(c1)N(C(=O)N2)C3CCN(CC3)C(=O)Nc4ccc(cc4)I)N

BDBM670077

CN(C)c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670078

Ic1ccc(NC(=O)N2CCC(CC2)n2c3cccc(-n4cccn4)c3[nH]c2=O)cc1

BDBM670079

Ic1ccc(NC(=O)N2CCC(CC2)n2c3cccc(-n4cncn4)c3[nH]c2=O)cc1

BDBM670080

CSc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670081

Ic1ccc(NC(=O)N2CCC(CC2)n2c3cccc(-c4ccc[nH]4)c3[nH]c2=O)cc1

BDBM670082

Ic1ccc(NC(=O)N2CCC(CC2)n2c3cccc(-c4cccnc4)c3[nH]c2=O)cc1

BDBM670083

Clc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)cc1Cl

BDBM670084

OCc1ccc(cn1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670085

Nc1cccc(c1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670086

OCCc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670087

Ic1ccc(NC(=O)N2CCC(CC2)n2c3cccc(C4CC4)c3[nH]c2=O)cc1

BDBM670088

Clc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(-c4ccncc4)c3[nH]c2=O)cc1Cl

BDBM670089

NCc1ccc(cc1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670090

Brc1cccc2n(C3CCCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670091

OC(=O)c1ccc(cc1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670092

CN(C)CCOc1ccc(cc1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670093

Clc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(-c4cncnc4)c3[nH]c2=O)cc1Cl

BDBM670094

FC(F)(F)c1cc(cc(c1)C(F)(F)F)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670095

Nc1ccc(cn1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670096

FC(F)(F)C(=O)c1ccc(cc1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670097

Brc1cnn(c1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670098

CCc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)cc1

BDBM670099

Cc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)cc1

BDBM670100

COc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)cc1

BDBM670101

COc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)cc1OC

BDBM670102

COc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)cc1Cl

BDBM670103

Brc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc4OCOc4c3)c(=O)[nH]c12

BDBM670104

Cc1cc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1Br

BDBM670105

Clc1cc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1Br

BDBM670106

Cc1cc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1I

BDBM670107

O[C@H]1CN(CC[C@@H]1n1c2cccc(Br)c2[nH]c1=O)C(=O)Nc1ccc(Cl)c(Cl)c1 |r|

BDBM670108

Oc1ccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c2c1

BDBM670109

FC(F)(F)c1cc(ccn1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670110

Nc1cncc(c1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670111

CCOc1ncccc1-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670112

COc1ccc(cn1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670113

NC(=O)Cc1cccc(c1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670114

OC(=O)c1cccc(c1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670115

COC(=O)c1cccc(c1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670116

CN(C)CCOc1cccc(c1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670117

Clc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(-c4cccc(c4)C(=O)N4CCOCC4)c3[nH]c2=O)cc1Cl

BDBM670118

COCCNC(=O)c1cccc(c1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670119

NS(=O)(=O)c1ccc(cc1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670120

Fc1cccc(c1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670121

NCc1cccc(c1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670122

Nc1ccccc1-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670123

CN(C)Cc1ccccc1-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c(=O)[nH]c12

BDBM670124

Clc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=S)cc1Cl

BDBM670125

Fc1cccc2[nH]c(=O)n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c12

BDBM670126

Clc1ccc(NC(=O)N2CCC(CC2)n2c3c(Cl)cccc3[nH]c2=O)cc1Cl

BDBM670127

Clc1ccc(NC(=O)N2CCC(CC2)n2c3c(Br)cccc3[nH]c2=O)cc1Cl

BDBM670128

Clc1ccc(NC(=O)N2C3CCC2CC(C3)n2c3cccc(Br)c3[nH]c2=O)cc1Cl

BDBM670129

Brc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc4cc[nH]c4c3)c(=O)[nH]c12

BDBM670130

Cc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)cc1C(F)(F)F

BDBM670131

Cc1ccc(cc1OC)NC(=O)N2CCC(CC2)N3c4cccc(c4NC3=O)Br

BDBM670132

COc1cc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1F

BDBM670133

COc1cc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1Cl

BDBM670134

Fc1cc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1Cl

BDBM670135

Cc1cc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1F

BDBM670136

FC(F)(F)Oc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)cc1Cl

BDBM670137

Cc1cc(NC(=O)N2CCC(CC2)n2c3cccc(-c4ccc(CO)nc4)c3[nH]c2=O)ccc1I

BDBM670138

COc1cc(NC(=O)N2CCC(CC2)n2c3cccc(-c4ccc(CO)nc4)c3[nH]c2=O)ccc1C

BDBM670139

COc1cc(NC(=O)N2CCC(CC2)n2c3cccc(-c4ccc(CO)nc4)c3[nH]c2=O)ccc1Cl

BDBM670140

Cc1cc(NC(=O)N2C3CCC2CC(C3)n2c3cccc(Br)c3[nH]c2=O)ccc1I

BDBM670141

COc1cc(NC(=O)N2C3CCC2CC(C3)n2c3cccc(Br)c3[nH]c2=O)ccc1C

BDBM670142

Fc1cc(NC(=O)N2C3CCC2CC(C3)n2c3cccc(Br)c3[nH]c2=O)ccc1Cl

BDBM670143

CCNC(=O)c1cnn(c1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670144

CCN(CC)C(=O)c1cnn(c1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670145

CN(C)CCNC(=O)c1cnn(c1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670146

OCC(O)CNC(=O)c1cnn(c1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(I)cc3)c(=O)[nH]c12

BDBM670147

Cc1cc(NC(=O)N2C3CCC2CC(C3)n2c3cccc(-c4ccc(CO)nc4)c3[nH]c2=O)ccc1I

BDBM670148

COc1cc(NC(=O)N2C3CCC2CC(C3)n2c3cccc(-c4ccc(CO)nc4)c3[nH]c2=O)ccc1C

BDBM670149

COc1cc(NC(=O)N2C3CCC2CC(C3)n2c3cccc(-c4ccc(CO)nc4)c3[nH]c2=O)ccc1Cl

BDBM670150

OCc1ccc(cn1)-c1cccc2n(C3CC4CCC(C3)N4C(=O)Nc3ccc(Cl)c(F)c3)c(=O)[nH]c12

BDBM670151

COc1cc(NC(=O)N2CCC(CC2)n2c3cccc(-c4cccnc4)c3[nH]c2=O)ccc1C

BDBM670152

COc1cc(NC(=O)N2CCC(CC2)n2c3cccc(-c4ccc(N)nc4)c3[nH]c2=O)ccc1C

BDBM670153

COc1cc(NC(=O)N2CCC(CC2)n2c3cccc(-c4cncc(N)c4)c3[nH]c2=O)ccc1C

BDBM670154

COc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(-c4cccnc4)c3[nH]c2=O)cc1Cl

BDBM670155

COc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(-c4ccc(N)nc4)c3[nH]c2=O)cc1Cl

BDBM670156

COc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(-c4cncc(N)c4)c3[nH]c2=O)cc1Cl

BDBM670157

COc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(-c4cnc5[nH]ncc5c4)c3[nH]c2=O)cc1Cl

BDBM670158

COc1cc(NC(=O)N2CCC(CC2)n2c3cccc(-c4cccnc4)c3[nH]c2=O)ccc1Cl

BDBM670159

COc1cc(NC(=O)N2CCC(CC2)n2c3cccc(-c4ccc(N)nc4)c3[nH]c2=O)ccc1Cl

BDBM670160

COc1cc(NC(=O)N2CCC(CC2)n2c3cccc(-c4cncc(N)c4)c3[nH]c2=O)ccc1Cl

BDBM670161

COc1ccc(cn1)-c1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(Cl)c(OC)c3)c(=O)[nH]c12

BDBM670162

COc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(N(C)CCN(C)C)c3[nH]c2=O)cc1Cl

BDBM670163

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-7.76,3.16,;-8.23,1.69,;-7.17,.52,;-5.64,.81,;-4.61,-.28,;-3.1,.03,;-2.09,-1.08,;-2.53,-2.61,;-.54,-.8,;-.02,.65,;1.48,.96,;2.54,-.15,;2.05,-1.63,;.52,-1.94,;4.04,.16,;5.24,-.88,;5.24,-2.4,;6.56,-3.16,;7.88,-2.4,;7.88,-.88,;9.22,-.1,;6.56,-.13,;6.22,1.4,;4.72,1.53,;3.91,2.9,;-5.1,-1.76,;-6.63,-2.07,;-7.66,-.95,;-9.22,-1.29,)|

BDBM670164

COc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(N4Cc5cn[nH]c5C4)c3[nH]c2=O)cc1Cl

BDBM670165

Clc1cc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)cnc1Cl

BDBM670166

COc1ncc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)cc1C

BDBM670167

Cc1nc(NC(=O)N2CCC(CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1Cl

BDBM670168

CC1CC(CCN1C(=O)Nc1ccc(Cl)c(Cl)c1)n1c2cccc(Br)c2[nH]c1=O

BDBM670169

CC1CN(CCC1n1c2cccc(Br)c2[nH]c1=O)C(=O)Nc1ccc(Cl)c(Cl)c1

BDBM670170

COc1cc(NC(=O)N2CCC(CC2)n2c3cccc(Cl)c3[nH]c2=O)ccc1C

BDBM670171

COc1cc(NC(=O)N2CCC(CC2)n2c3cccc(C)c3[nH]c2=O)ccc1C

BDBM670172

Cc1ccc(cc1OC)NC(=O)N2CCC(CC2)N3c4cccc(c4NC3=O)OC

BDBM670173

COc1cc(NC(=O)N2CCC(CC2)n2c3cccc(-n4cccn4)c3[nH]c2=O)ccc1C

BDBM670174

Clc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1Cl |r,wU:11.14,8.7,(-9.2,-1.14,;-7.71,-.8,;-6.65,-1.95,;-5.11,-1.64,;-4.62,-.15,;-3.13,.16,;-2.12,-.96,;-2.56,-2.47,;-.55,-.67,;-.06,.79,;1.45,1.1,;2.49,-.02,;2,-1.51,;.51,-1.82,;4,.29,;5.2,-.75,;5.2,-2.29,;6.52,-3.05,;7.85,-2.29,;7.85,-.75,;9.2,.02,;6.52,.03,;6.19,1.57,;4.68,1.67,;3.87,3.05,;-5.66,.94,;-7.17,.66,;-8.23,1.83,)|

BDBM670175

Clc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1 |r,wU:11.14,8.7,(-9.2,-1.14,;-7.71,-.8,;-7.17,.66,;-5.66,.94,;-4.62,-.15,;-3.13,.16,;-2.12,-.96,;-2.56,-2.47,;-.55,-.67,;-.06,.79,;1.45,1.1,;2.49,-.02,;2,-1.51,;.51,-1.82,;4,.29,;5.2,-.75,;5.2,-2.29,;6.52,-3.05,;7.85,-2.29,;7.85,-.75,;9.2,.02,;6.52,.03,;6.19,1.57,;4.68,1.67,;3.87,3.05,;-5.11,-1.64,;-6.65,-1.95,)|

BDBM670176

FC(F)(F)c1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1Cl |r,wU:13.16,10.9,(-7.49,3.18,;-7.96,1.7,;-9.47,1.37,;-9,2.84,;-6.89,.53,;-5.38,.82,;-4.34,-.28,;-2.86,.03,;-1.84,-1.08,;-2.28,-2.59,;-.28,-.8,;.21,.66,;1.72,.97,;2.77,-.15,;2.27,-1.63,;.79,-1.94,;4.27,.16,;5.47,-.88,;5.47,-2.42,;6.8,-3.18,;8.13,-2.42,;8.13,-.88,;9.47,-.11,;6.8,-.1,;6.46,1.44,;4.95,1.54,;4.14,2.92,;-4.84,-1.76,;-6.37,-2.07,;-7.44,-.93,;-8.92,-1.27,)|

BDBM670177

Fc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1Cl |r,wU:10.13,7.6,(-8.12,1.82,;-7.07,.67,;-5.56,.95,;-4.56,-.13,;-3.07,.18,;-2.07,-.95,;-2.51,-2.46,;-.56,-.69,;-.05,.79,;1.43,1.08,;2.43,0,;1.97,-1.48,;.46,-1.79,;3.92,.31,;5.07,-.74,;5.07,-2.29,;6.4,-3.05,;7.73,-2.29,;7.73,-.74,;9.06,.01,;6.4,.05,;6.07,1.56,;4.58,1.67,;3.79,3.05,;-5.04,-1.61,;-6.53,-1.92,;-7.58,-.79,;-9.06,-1.13,)|

BDBM670178

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1Cl |r,wU:11.14,8.7,(-7.76,3.18,;-8.23,1.7,;-7.17,.53,;-5.66,.82,;-4.62,-.28,;-3.13,.03,;-2.12,-1.08,;-2.56,-2.59,;-.55,-.8,;-.06,.66,;1.45,.97,;2.49,-.15,;2,-1.63,;.51,-1.94,;4,.16,;5.2,-.88,;5.2,-2.42,;6.52,-3.18,;7.85,-2.42,;7.85,-.88,;9.2,-.11,;6.52,-.1,;6.19,1.44,;4.68,1.54,;3.87,2.92,;-5.11,-1.76,;-6.65,-2.07,;-7.71,-.93,;-9.2,-1.27,)|

BDBM670179

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1Cl |r,wU:12.15,9.8,(-9.72,-.01,;-8.67,-1.14,;-7.19,-.8,;-6.12,-1.95,;-4.58,-1.64,;-4.09,-.15,;-2.61,.16,;-1.59,-.96,;-2.03,-2.47,;-.03,-.67,;.47,.79,;1.98,1.1,;3.02,-.02,;2.52,-1.51,;1.04,-1.82,;4.53,.29,;5.72,-.75,;5.72,-2.29,;7.05,-3.05,;8.38,-2.29,;8.38,-.75,;9.72,.02,;7.05,.03,;6.71,1.57,;5.2,1.67,;4.4,3.05,;-5.13,.94,;-6.64,.66,;-7.71,1.83,)|

BDBM670180

Cc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1C |r,wU:11.14,8.7,(-9.16,-1.09,;-7.65,-.78,;-6.59,-1.91,;-5.08,-1.6,;-4.59,-.14,;-3.1,.17,;-2.08,-.94,;-2.54,-2.42,;-.56,-.65,;-.05,.78,;1.44,1.09,;2.49,-.01,;2,-1.48,;.51,-1.78,;3.98,.3,;5.16,-.73,;5.16,-2.25,;6.49,-3.01,;7.83,-2.25,;7.83,-.73,;9.16,.04,;6.47,.01,;6.16,1.55,;4.64,1.65,;3.85,3.01,;-5.64,.94,;-7.13,.65,;-8.19,1.81,)|

BDBM670181

Clc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1C#N |r,wU:10.13,7.6,(-7.36,1.81,;-6.33,.66,;-4.82,.94,;-3.79,-.17,;-2.33,.17,;-1.33,-.96,;-1.77,-2.47,;.18,-.68,;.7,.78,;2.18,1.09,;3.21,-.01,;2.72,-1.5,;1.23,-1.81,;4.67,.3,;5.83,-.73,;5.83,-2.27,;7.16,-3.04,;8.49,-2.27,;8.49,-.73,;9.82,.04,;7.16,.04,;6.83,1.55,;5.34,1.66,;4.57,3.04,;-4.31,-1.63,;-5.79,-1.94,;-6.85,-.81,;-8.28,-1.11,;-9.82,-1.45,)|

BDBM670182

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1C |r,wU:12.15,9.8,(-9.72,-.01,;-8.67,-1.14,;-7.19,-.8,;-6.12,-1.95,;-4.58,-1.64,;-4.09,-.15,;-2.61,.16,;-1.59,-.96,;-2.03,-2.47,;-.03,-.67,;.47,.79,;1.98,1.1,;3.02,-.02,;2.52,-1.51,;1.04,-1.82,;4.53,.29,;5.72,-.75,;5.72,-2.29,;7.05,-3.05,;8.38,-2.29,;8.38,-.75,;9.72,.02,;7.05,.03,;6.71,1.57,;5.2,1.67,;4.4,3.05,;-5.13,.94,;-6.64,.66,;-7.71,1.83,)|

BDBM670183

Brc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccccc3)c(=O)[nH]c12 |r,wU:7.6,10.13,(8.48,.04,;7.12,-.74,;7.12,-2.27,;5.77,-3.05,;4.42,-2.27,;4.42,-.74,;3.22,.3,;1.72,-.01,;.68,1.1,;-.83,.79,;-1.35,-.69,;-.26,-1.81,;1.22,-1.49,;-2.91,-.95,;-3.35,-2.46,;-3.93,.17,;-5.43,-.14,;-5.93,-1.62,;-7.46,-1.94,;-8.48,-.79,;-8.01,.66,;-6.5,.95,;3.9,1.68,;3.12,3.05,;5.43,1.57,;5.75,.01,)|

BDBM670184

Fc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1F |r,wU:11.14,8.7,(-9.15,-1.09,;-7.66,-.78,;-6.61,-1.92,;-5.09,-1.61,;-4.6,-.11,;-3.11,.17,;-2.08,-.94,;-2.54,-2.43,;-.56,-.66,;-.04,.79,;1.47,1.09,;2.5,.01,;2.01,-1.45,;.5,-1.76,;4,.3,;5.15,-.71,;5.15,-2.24,;6.49,-3.02,;7.83,-2.24,;7.83,-.71,;9.15,.07,;6.49,.04,;6.16,1.56,;4.66,1.66,;3.87,3.02,;-5.65,.97,;-7.15,.68,;-8.2,1.81,)|

BDBM670185

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1C(F)(F)F |r,wU:12.15,9.8,(-9.72,-.13,;-8.67,-1.26,;-7.19,-.93,;-6.12,-2.07,;-4.58,-1.76,;-4.09,-.27,;-2.61,.04,;-1.59,-1.08,;-2.03,-2.59,;-.03,-.8,;.47,.66,;1.98,.97,;3.02,-.14,;2.52,-1.63,;1.04,-1.94,;4.53,.17,;5.72,-.87,;5.72,-2.41,;7.05,-3.17,;8.38,-2.41,;8.38,-.87,;9.72,-.1,;7.05,-.09,;6.71,1.44,;5.2,1.55,;4.4,2.93,;-5.13,.82,;-6.64,.53,;-7.64,1.72,;-7.11,3.17,;-9.16,1.45,;-8.63,2.9,)|

BDBM670186

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1F |r,wU:11.14,8.7,(-7.71,3.14,;-8.2,1.68,;-7.14,.55,;-5.63,.81,;-4.58,-.27,;-3.12,.04,;-2.09,-1.06,;-2.53,-2.55,;-.55,-.78,;-.06,.65,;1.45,.96,;2.48,-.14,;1.99,-1.6,;.5,-1.91,;3.96,.17,;5.14,-.86,;5.14,-2.37,;6.48,-3.14,;7.81,-2.37,;7.81,-.86,;9.14,-.09,;6.45,-.12,;6.14,1.42,;4.63,1.53,;3.83,2.89,;-5.09,-1.73,;-6.6,-2.04,;-7.66,-.91,;-9.14,-1.24,)|

BDBM670187

Clc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c(Cl)c1 |r,wU:11.14,8.7,(-9.14,-1.14,;-7.67,-.8,;-7.13,.67,;-5.65,.96,;-4.59,-.16,;-3.12,.16,;-2.11,-.93,;-2.55,-2.46,;-.58,-.67,;-.06,.78,;1.46,1.09,;2.47,,;1.98,-1.47,;.48,-1.78,;3.97,.28,;5.13,-.72,;5.13,-2.28,;6.5,-3.03,;7.8,-2.28,;7.8,-.72,;9.14,.03,;6.45,.03,;6.14,1.55,;4.62,1.68,;3.84,3.03,;-5.08,-1.63,;-4.07,-2.77,;-6.58,-1.94,)|

BDBM670188

Brc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc(cc3)C#N)c(=O)[nH]c12 |r,wU:7.6,10.13,(9.83,.01,;8.49,-.74,;8.49,-2.3,;7.16,-3.05,;5.83,-2.3,;5.83,-.74,;4.67,.31,;3.21,0,;2.18,1.1,;.69,.8,;.18,-.67,;1.23,-1.8,;2.72,-1.49,;-1.33,-.95,;-1.77,-2.46,;-2.33,.18,;-3.8,-.15,;-4.82,.95,;-6.34,.67,;-6.85,-.79,;-5.8,-1.92,;-4.31,-1.62,;-8.29,-1.1,;-9.83,-1.44,;5.34,1.67,;4.57,3.05,;6.83,1.57,;7.16,.05,)|

BDBM670189

FC(F)(F)c1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1 |r,wU:14.17,11.10,(-9.49,-.01,;-8.44,-1.14,;-8.9,-2.62,;-9.95,-1.48,;-6.96,-.8,;-6.41,.66,;-4.9,.94,;-3.86,-.15,;-2.38,.16,;-1.36,-.96,;-1.8,-2.47,;.2,-.67,;.69,.79,;2.2,1.1,;3.25,-.02,;2.75,-1.51,;1.27,-1.82,;4.75,.29,;5.95,-.75,;5.95,-2.29,;7.28,-3.05,;8.61,-2.29,;8.61,-.75,;9.95,.02,;7.28,.03,;6.94,1.57,;5.43,1.67,;4.62,3.05,;-4.36,-1.64,;-5.89,-1.95,)|

BDBM670190

FC(F)(F)Oc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1Cl |r,wU:15.18,12.11,(-9.97,1.17,;-8.98,.03,;-10.46,-.31,;-8.46,1.51,;-7.89,-1.17,;-6.41,-.83,;-5.34,-1.97,;-3.83,-1.66,;-3.31,-.18,;-1.83,.16,;-.82,-.98,;-1.26,-2.52,;.72,-.7,;1.24,.78,;2.74,1.1,;3.78,-.02,;3.29,-1.53,;1.78,-1.84,;5.29,.29,;6.46,-.78,;6.46,-2.31,;7.79,-3.07,;9.11,-2.31,;9.11,-.78,;10.46,-0,;7.79,0,;7.48,1.56,;5.94,1.69,;5.16,3.07,;-4.35,.94,;-5.89,.65,;-6.95,1.82,)|

BDBM670191

Brc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc4cc[nH]c4c3)c(=O)[nH]c12 |r,wU:7.6,10.13,(9.46,.03,;8.11,-.75,;8.11,-2.28,;6.79,-3.05,;5.46,-2.28,;5.46,-.75,;4.29,.29,;2.78,0,;1.73,1.1,;.22,.81,;-.3,-.67,;.77,-1.82,;2.28,-1.51,;-1.86,-.96,;-2.3,-2.47,;-2.88,.16,;-4.39,-.15,;-4.88,-1.64,;-6.42,-1.95,;-7.46,-.8,;-9,-.8,;-9.46,.66,;-8.2,1.58,;-6.96,.66,;-5.43,.94,;4.96,1.67,;4.16,3.05,;6.47,1.57,;6.79,0,)|

BDBM670192

Fc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1 |r,wU:11.14,8.7,(-9.23,-1.14,;-7.73,-.8,;-7.21,.65,;-5.71,.96,;-4.65,-.13,;-3.15,.16,;-2.11,-.96,;-2.55,-2.46,;-.58,-.67,;-.06,.78,;1.46,1.09,;2.5,,;2.01,-1.48,;.5,-1.81,;4,.28,;5.19,-.75,;5.19,-2.28,;6.56,-3.03,;7.89,-2.28,;7.89,-.75,;9.23,.03,;6.51,,;6.2,1.55,;4.67,1.66,;3.87,3.03,;-5.14,-1.63,;-6.67,-1.94,)|

BDBM670193

Fc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1C(F)(F)F |r,wU:10.13,7.6,(-7.47,1.82,;-6.4,.65,;-4.87,.94,;-3.85,-.15,;-2.35,.16,;-1.33,-.96,;-1.77,-2.47,;.2,-.67,;.72,.78,;2.23,1.1,;3.27,-.02,;2.78,-1.5,;1.29,-1.82,;4.78,.29,;5.95,-.75,;5.95,-2.28,;7.27,-3.05,;8.6,-2.28,;8.6,-.75,;9.94,.03,;7.27,0,;6.96,1.54,;5.43,1.69,;4.65,3.05,;-4.35,-1.63,;-5.86,-1.95,;-6.92,-.8,;-8.43,-1.14,;-8.9,-2.6,;-9.47,.03,;-9.94,-1.45,)|

BDBM670194

Clc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c1 |r,wU:12.15,9.8,(-8.79,1.83,;-7.69,.68,;-8.19,-.83,;-7.15,-1.95,;-5.61,-1.63,;-5.12,-.13,;-3.61,.16,;-2.57,-.96,;-3.01,-2.47,;-1.04,-.67,;-.49,.78,;1.04,1.1,;2.08,0,;1.59,-1.48,;.08,-1.82,;3.59,.29,;4.79,-.75,;4.79,-2.28,;6.12,-3.05,;7.44,-2.28,;7.44,-.75,;8.79,.03,;6.12,0,;5.8,1.56,;4.27,1.69,;3.46,3.05,;-6.19,.97,)|

BDBM670195

Cc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1 |r,wU:11.14,8.7,(-9.15,-1.14,;-7.66,-.78,;-6.61,-1.91,;-5.09,-1.6,;-4.58,-.14,;-3.12,.17,;-2.09,-.94,;-2.53,-2.42,;-.55,-.65,;-.06,.78,;1.45,1.09,;2.48,-.01,;1.99,-1.48,;.5,-1.78,;3.96,.3,;5.14,-.73,;5.14,-2.24,;6.48,-3.01,;7.81,-2.24,;7.81,-.73,;9.15,.04,;6.45,.01,;6.14,1.55,;4.63,1.65,;3.84,3.01,;-5.63,.94,;-7.15,.65,)|

BDBM670196

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1 |r,wU:12.15,9.8,(-9.7,.01,;-8.63,-1.16,;-7.1,-.85,;-6.63,.63,;-5.09,.92,;-4.05,-.17,;-2.57,.14,;-1.56,-.98,;-2,-2.52,;.01,-.69,;.5,.76,;2.01,1.07,;3.05,-.04,;2.56,-1.53,;1.05,-1.84,;4.56,.27,;5.76,-.77,;5.76,-2.28,;7.06,-3.03,;8.36,-2.28,;8.36,-.77,;9.7,0,;7.06,-.02,;6.75,1.52,;5.24,1.65,;4.43,3.03,;-4.57,-1.66,;-6.08,-1.97,)|

BDBM670197

FC(F)(F)c1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c1 |r,wU:15.18,12.11,(-9.4,1.37,;-7.94,1.7,;-8.91,2.83,;-7.43,3.16,;-6.84,.52,;-7.3,-.99,;-6.3,-2.06,;-4.81,-1.75,;-4.3,-.29,;-2.82,.04,;-1.82,-1.09,;-2.25,-2.6,;-.31,-.81,;.23,.65,;1.74,.96,;2.74,-.14,;2.25,-1.63,;.74,-1.93,;4.23,.17,;5.4,-.86,;5.4,-2.42,;6.76,-3.16,;8.07,-2.42,;8.07,-.86,;9.4,-.09,;6.73,-.09,;6.4,1.42,;4.89,1.55,;4.1,2.91,;-5.33,.81,)|

BDBM670198

Cc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1F |r,wU:10.13,7.6,(-8.25,1.82,;-7.18,.65,;-5.65,.94,;-4.62,-.15,;-3.12,.16,;-2.11,-.95,;-2.55,-2.46,;-.55,-.67,;-.03,.78,;1.44,1.09,;2.53,0,;2.04,-1.47,;.51,-1.78,;4.03,.29,;5.23,-.75,;5.23,-2.27,;6.55,-3.04,;7.87,-2.27,;7.87,-.75,;9.2,.03,;6.55,0,;6.21,1.53,;4.71,1.66,;3.91,3.04,;-5.11,-1.63,;-6.64,-1.94,;-7.7,-.8,;-9.2,-1.14,)|

BDBM670199

Cc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c1 |r,wU:12.15,9.8,(-8.71,1.83,;-7.65,.66,;-8.19,-.8,;-7.13,-1.95,;-5.59,-1.64,;-5.1,-.15,;-3.61,.16,;-2.6,-.96,;-3.04,-2.47,;-1.04,-.67,;-.54,.79,;.97,1.1,;2.01,-.02,;1.51,-1.51,;.03,-1.82,;3.52,.29,;4.72,-.75,;4.72,-2.29,;6.04,-3.05,;7.37,-2.29,;7.37,-.75,;8.71,.02,;6.04,.03,;5.7,1.57,;4.2,1.67,;3.39,3.05,;-6.14,.94,)|

BDBM670200

Cc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1C(F)(F)F |r,wU:11.14,8.7,(-8.79,-1.28,;-7.3,-.92,;-6.25,-2.05,;-4.77,-1.74,;-4.28,-.25,;-2.8,.05,;-1.83,-1.07,;-2.24,-2.58,;-.29,-.82,;.22,.67,;1.68,.97,;2.7,-.13,;2.24,-1.61,;.73,-1.92,;4.18,.18,;5.33,-.87,;5.33,-2.42,;6.66,-3.17,;7.99,-2.42,;7.99,-.87,;9.32,-.11,;6.66,-.08,;6.33,1.43,;4.85,1.54,;4.05,2.92,;-5.28,.82,;-6.79,.54,;-7.89,1.71,;-9.32,1.38,;-8.86,2.84,;-7.35,3.17,)|

BDBM670201

Brc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3cccc4[nH]ccc34)c(=O)[nH]c12 |r,wU:7.6,10.13,(8.54,-.01,;7.21,-.78,;7.21,-2.3,;5.87,-3.07,;4.54,-2.3,;4.54,-.78,;3.36,.24,;1.87,-.06,;.85,1.04,;-.67,.73,;-1.15,-.71,;-.13,-1.83,;1.39,-1.53,;-2.69,-.99,;-3.13,-2.48,;-3.72,.12,;-5.18,-.19,;-5.69,-1.65,;-7.21,-1.96,;-8.21,-.86,;-7.75,.63,;-8.54,1.94,;-7.49,3.07,;-6.08,2.45,;-6.26,.94,;4.03,1.6,;3.23,2.96,;5.54,1.48,;5.85,-.04,)|

BDBM670202

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Cl)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-7.7,3.16,;-8.14,1.68,;-7.11,.54,;-5.63,.83,;-4.57,-.28,;-3.09,.03,;-2.08,-1.09,;-2.53,-2.59,;-.56,-.8,;-.04,.65,;1.46,.96,;2.47,-.13,;2.01,-1.61,;.5,-1.92,;3.98,.16,;5.14,-.85,;5.14,-2.41,;6.51,-3.16,;7.81,-2.41,;7.81,-.85,;9.13,-.1,;6.44,-.1,;6.15,1.42,;4.65,1.53,;3.85,2.9,;-5.06,-1.76,;-6.59,-2.07,;-7.63,-.93,;-9.13,-1.29,)|

BDBM670203

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Cl)c3[nH]c2=O)cc1 |r,wU:12.15,9.8,(-9.67,.01,;-8.62,-1.14,;-7.13,-.81,;-6.06,-1.94,;-4.57,-1.63,;-4.05,-.17,;-2.59,.14,;-1.57,-.96,;-2,-2.45,;-.03,-.68,;.46,.76,;2,1.06,;3,-.01,;2.51,-1.48,;1,-1.78,;4.49,.27,;5.67,-.73,;5.67,-2.27,;7.06,-3.02,;8.34,-2.27,;8.34,-.73,;9.67,.01,;7.01,.04,;6.67,1.53,;5.16,1.65,;4.36,3.02,;-5.11,.94,;-6.62,.63,)|

BDBM670204

Clc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc4cc[nH]c4c3)c(=O)[nH]c12 |r,wU:7.6,10.13,(9.47,.04,;8.13,-.74,;8.13,-2.27,;6.78,-3.04,;5.44,-2.27,;5.44,-.74,;4.25,.3,;2.74,.01,;1.68,1.1,;.18,.79,;-.34,-.66,;.75,-1.8,;2.25,-1.49,;-1.89,-.95,;-2.33,-2.45,;-2.9,.17,;-4.4,-.14,;-4.92,-1.62,;-6.45,-1.93,;-7.48,-.79,;-9.01,-.79,;-9.47,.71,;-8.28,1.59,;-6.96,.66,;-5.44,.95,;4.92,1.67,;4.12,3.04,;6.45,1.54,;6.76,.01,)|

BDBM670205

Cc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Cl)c3[nH]c2=O)cc1 |r,wU:11.14,8.7,(-9.15,-1.17,;-7.67,-.8,;-6.61,-1.95,;-5.1,-1.64,;-4.61,-.16,;-3.13,.16,;-2.12,-.96,;-2.53,-2.47,;-.58,-.67,;-.06,.78,;1.44,1.09,;2.45,-.03,;1.99,-1.51,;.48,-1.79,;3.96,.29,;5.13,-.75,;5.13,-2.28,;6.5,-3.04,;7.8,-2.28,;7.8,-.73,;9.15,.03,;6.45,,;6.14,1.53,;4.63,1.66,;3.83,3.04,;-5.62,.93,;-7.15,.65,)|

BDBM670206

Clc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Cl)c3[nH]c2=O)cc1 |r,wU:11.14,8.7,(-9.07,-1.1,;-7.59,-.77,;-7.07,.67,;-5.59,.95,;-4.56,-.13,;-3.1,.18,;-2.1,-.92,;-2.51,-2.41,;-.56,-.64,;-.04,.82,;1.42,1.1,;2.44,0,;1.98,-1.46,;.49,-1.77,;3.93,.31,;5.09,-.72,;5.09,-2.26,;6.42,-3.03,;7.76,-2.26,;7.76,-.72,;9.07,.04,;6.42,.05,;6.09,1.54,;4.6,1.67,;3.8,3.03,;-5.05,-1.59,;-6.56,-1.9,)|

BDBM670207

COC(=O)c1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1OC |r,wU:13.16,10.9,(-8.2,3.72,;-7.16,2.58,;-7.6,1.11,;-9.15,.77,;-6.59,-.06,;-5.07,.23,;-4.03,-.88,;-2.56,-.6,;-1.55,-1.71,;-1.99,-3.26,;-.03,-1.43,;.49,.07,;2.02,.36,;3.03,-.76,;2.53,-2.26,;1.03,-2.57,;4.53,-.44,;5.72,-1.48,;5.72,-2.97,;7.01,-3.72,;8.3,-2.97,;8.3,-1.48,;9.65,-.7,;7.01,-.73,;6.7,.82,;5.2,.95,;4.4,2.35,;-4.55,-2.38,;-6.03,-2.72,;-7.11,-1.56,;-8.59,-1.89,;-9.65,-.73,)|

BDBM670208

Cc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1Cl |r,wU:10.13,7.6,(-8.15,1.8,;-7.07,.69,;-5.61,.98,;-4.56,-.13,;-3.1,.18,;-2.1,-.92,;-2.53,-2.41,;-.56,-.64,;-.07,.8,;1.44,1.1,;2.44,0,;1.96,-1.46,;.49,-1.77,;3.93,.31,;5.08,-.72,;5.08,-2.26,;6.42,-3.03,;7.75,-2.26,;7.75,-.72,;9.07,.05,;6.42,.05,;6.09,1.57,;4.6,1.67,;3.8,3.03,;-5.05,-1.59,;-6.56,-1.9,;-7.61,-.77,;-9.07,-1.1,)|

BDBM670209

Cc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c(F)c1 |r,wU:11.14,8.7,(-9.15,-1.14,;-7.66,-.78,;-7.15,.65,;-5.63,.94,;-4.58,-.14,;-3.12,.17,;-2.09,-.94,;-2.53,-2.42,;-.55,-.65,;-.06,.78,;1.45,1.09,;2.48,-.01,;1.99,-1.48,;.47,-1.78,;3.96,.29,;5.14,-.73,;5.14,-2.25,;6.48,-3.02,;7.81,-2.25,;7.81,-.73,;9.15,.04,;6.45,.01,;6.15,1.55,;4.63,1.65,;3.84,3.02,;-5.12,-1.6,;-4.04,-2.76,;-6.61,-1.91,)|

BDBM670210

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c(F)c1F |r,wU:12.15,9.8,(-9.76,.16,;-8.69,-.94,;-7.21,-.63,;-6.66,.86,;-5.15,1.15,;-4.1,.05,;-2.59,.37,;-1.57,-.76,;-2.02,-2.3,;-.01,-.5,;.51,.99,;2.05,1.28,;3.07,.18,;2.58,-1.3,;1.04,-1.62,;4.58,.5,;5.76,-.55,;5.76,-2.08,;7.09,-2.85,;8.42,-2.08,;8.42,-.55,;9.76,.23,;7.09,.21,;6.78,1.75,;5.26,1.88,;4.45,3.26,;-4.6,-1.46,;-3.53,-2.61,;-6.11,-1.75,;-6.61,-3.26,)|

BDBM670211

COc1cc(F)cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c1 |r,wU:14.17,11.10,(-8.2,3.35,;-8.66,1.88,;-7.61,.72,;-8.1,-.77,;-7.07,-1.85,;-7.56,-3.35,;-5.57,-1.54,;-5.09,-.08,;-3.59,.23,;-2.59,-.88,;-3.03,-2.39,;-1.07,-.59,;-.53,.85,;.94,1.16,;2,.08,;1.51,-1.42,;-.01,-1.72,;3.49,.36,;4.67,-.67,;4.67,-2.21,;6.01,-2.94,;7.33,-2.21,;7.33,-.67,;8.66,.1,;5.99,.1,;5.65,1.6,;4.16,1.72,;3.36,3.09,;-6.12,1,)|

BDBM670212

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c(F)c1 |r,wU:12.15,9.8,(-9.71,.01,;-8.64,-1.16,;-7.1,-.85,;-6.64,.63,;-5.1,.92,;-4.06,-.17,;-2.57,.14,;-1.56,-.98,;-2,-2.52,;.01,-.7,;.5,.76,;2.01,1.08,;3.05,-.04,;2.56,-1.53,;1.05,-1.84,;4.56,.27,;5.76,-.77,;5.76,-2.28,;7.06,-3.03,;8.36,-2.28,;8.36,-.77,;9.71,0,;7.06,-.02,;6.75,1.52,;5.24,1.65,;4.43,3.03,;-4.6,-1.66,;-3.51,-2.83,;-6.09,-1.97,)|

BDBM670213

Clc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1C#N |r,wU:8.7,11.14,(-9.14,-1.18,;-7.66,-.84,;-6.59,-1.98,;-5.06,-1.67,;-4.56,-.19,;-3.08,.15,;-2.07,-1,;-2.48,-2.53,;-.51,-.71,;-.01,.77,;1.5,1.08,;2.54,-.03,;2.04,-1.54,;.53,-1.85,;4.04,.28,;5.24,-.76,;5.24,-2.3,;6.57,-3.06,;7.89,-2.3,;7.89,-.76,;9.24,.01,;6.57,.02,;6.23,1.55,;4.72,1.66,;3.91,3.06,;-5.6,.93,;-7.11,.64,;-8.15,1.79,;-9.24,2.98,)|

BDBM670214

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc(c1)C(F)(F)F |r,wU:11.14,8.7,(-5.72,-3.91,;-6.8,-2.73,;-6.29,-1.27,;-4.82,-.96,;-4.31,.5,;-2.82,.81,;-1.82,-.3,;-2.26,-1.78,;-.31,-.01,;.23,1.45,;1.74,1.73,;2.75,.65,;2.26,-.81,;.77,-1.12,;4.23,.96,;5.41,-.06,;5.41,-1.6,;6.77,-2.35,;8.08,-1.6,;8.08,-.06,;9.42,.71,;6.75,.71,;6.41,2.19,;4.9,2.32,;4.11,3.68,;-5.34,1.6,;-6.85,1.32,;-7.31,-.19,;-7.93,2.48,;-9.42,2.14,;-8.93,3.61,;-7.44,3.91,)|

BDBM670215

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1C#N |r,wU:11.14,8.7,(-6.88,3.17,;-7.34,1.68,;-6.31,.53,;-4.8,.81,;-3.8,-.27,;-2.31,.04,;-1.33,-1.09,;-1.75,-2.6,;.21,-.81,;.69,.65,;2.18,.96,;3.21,-.14,;2.72,-1.63,;1.23,-1.94,;4.7,.17,;5.85,-.89,;5.85,-2.43,;7.21,-3.17,;8.5,-2.43,;8.5,-.89,;9.8,-.09,;7.14,-.12,;6.83,1.42,;5.34,1.53,;4.57,2.91,;-4.29,-1.76,;-5.77,-2.07,;-6.83,-.94,;-8.26,-1.24,;-9.8,-1.58,)|

BDBM670216

COc1c(F)cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1F |r,wU:13.16,10.9,(-9.72,.16,;-8.66,-.94,;-7.12,-.62,;-6.66,.86,;-7.7,2.03,;-5.12,1.14,;-4.08,.05,;-2.6,.36,;-1.59,-.75,;-2.03,-2.29,;-.05,-.47,;.47,.99,;1.98,1.3,;3.02,.18,;2.52,-1.3,;1.01,-1.61,;4.52,.49,;5.69,-.55,;5.69,-2.08,;7.05,-2.86,;8.37,-2.08,;8.37,-.55,;9.72,.23,;7.02,.21,;6.71,1.74,;5.17,1.87,;4.39,3.25,;-4.6,-1.43,;-6.11,-1.74,;-6.58,-3.25,)|

BDBM670217

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1C#N |r,wU:12.15,9.8,(-9.71,0,;-8.64,-1.17,;-7.16,-.83,;-6.1,-1.97,;-4.59,-1.66,;-4.07,-.18,;-2.59,.16,;-1.57,-.96,;-2.01,-2.52,;-.01,-.7,;.48,.78,;1.99,1.1,;3.03,-.02,;2.54,-1.53,;1.03,-1.84,;4.54,.29,;5.71,-.78,;5.71,-2.31,;7.03,-3.07,;8.36,-2.31,;8.36,-.78,;9.71,-0,;7.03,0,;6.72,1.56,;5.21,1.67,;4.41,3.07,;-5.11,.94,;-6.64,.65,;-7.66,1.82,;-8.75,2.99,)|

BDBM670218

Fc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1Cl |r,wU:11.14,8.7,(-9.21,-1.14,;-7.7,-.8,;-6.64,-1.94,;-5.11,-1.63,;-4.62,-.13,;-3.12,.16,;-2.11,-.95,;-2.55,-2.46,;-.55,-.67,;-.03,.78,;1.49,1.09,;2.53,0,;2.04,-1.5,;.54,-1.81,;4.03,.29,;5.23,-.75,;5.23,-2.27,;6.55,-3.04,;7.87,-2.27,;7.87,-.75,;9.21,.03,;6.55,0,;6.21,1.56,;4.71,1.66,;3.9,3.04,;-5.66,.94,;-7.18,.65,;-8.25,1.82,)|

BDBM670219

COc1cc(Cl)cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c1 |r,wU:14.17,11.10,(-8.21,3.38,;-8.68,1.89,;-7.63,.74,;-8.1,-.77,;-7.09,-1.89,;-7.58,-3.38,;-5.57,-1.58,;-5.08,-.09,;-3.59,.22,;-2.57,-.9,;-3.02,-2.41,;-1.03,-.64,;-.51,.85,;1,1.16,;2.02,.07,;1.52,-1.45,;.04,-1.76,;3.53,.35,;4.68,-.69,;4.68,-2.22,;6.01,-3,;7.34,-2.22,;7.34,-.69,;8.68,.09,;6.01,.07,;5.7,1.63,;4.18,1.73,;3.4,3.14,;-6.12,1.03,)|

BDBM670220

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1F |r,wU:12.15,9.8,(-9.7,.03,;-8.64,-1.14,;-7.16,-.8,;-6.09,-1.95,;-4.58,-1.63,;-4.06,-.15,;-2.58,.16,;-1.57,-.96,;-2.01,-2.47,;-.03,-.67,;.49,.78,;2,1.1,;3.04,-.02,;2.54,-1.5,;1.03,-1.82,;4.54,.29,;5.71,-.75,;5.71,-2.28,;7.04,-3.05,;8.37,-2.28,;8.37,-.75,;9.7,.03,;7.04,0,;6.73,1.54,;5.19,1.69,;4.41,3.05,;-5.1,.94,;-6.64,.65,;-7.68,1.82,)|

BDBM670221

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c1 |r,wU:13.16,10.9,(-8.24,3.15,;-8.71,1.65,;-7.65,.49,;-8.12,-.99,;-7.11,-2.12,;-5.58,-1.81,;-5.07,-.34,;-3.59,-.01,;-2.56,-1.12,;-3,-2.67,;-1.01,-.86,;-.49,.62,;1.01,.93,;2.07,-.19,;1.58,-1.68,;.05,-1.99,;3.56,.12,;4.78,-.91,;4.78,-2.4,;6.07,-3.15,;7.36,-2.4,;7.36,-.91,;8.71,-.13,;6.07,-.16,;5.76,1.39,;4.24,1.52,;3.44,2.89,;-6.13,.77,)|

BDBM670222

Brc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc4OCOc4c3)c(=O)[nH]c12 |r,wU:7.6,10.13,(9.42,.23,;8.12,-.57,;8.19,-2.16,;6.95,-2.97,;5.57,-2.29,;5.46,-.73,;4.24,.23,;2.76,-.16,;1.66,.88,;.18,.52,;-.26,-.96,;.83,-2.03,;2.34,-1.66,;-1.79,-1.33,;-2.13,-2.86,;-2.86,-.29,;-4.34,-.68,;-4.76,-2.16,;-6.27,-2.55,;-7.31,-1.48,;-8.87,-1.56,;-9.42,-.1,;-8.22,.86,;-6.92,.03,;-5.44,.39,;4.81,1.64,;3.95,2.97,;6.35,1.59,;6.74,.13,)|

BDBM670223

Cc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c1C |r,wU:12.15,9.8,(-7.89,-3.24,;-7.42,-1.73,;-8.46,-.64,;-7.99,.85,;-6.46,1.16,;-5.42,.04,;-3.91,.35,;-2.9,-.74,;-3.34,-2.25,;-1.34,-.46,;-.82,1,;.69,1.29,;1.76,.2,;1.24,-1.29,;-.27,-1.6,;3.27,.51,;4.46,-.53,;4.46,-2.07,;5.79,-2.83,;7.12,-2.07,;7.12,-.53,;8.46,.24,;5.79,.25,;5.45,1.76,;3.92,1.89,;3.14,3.24,;-5.94,-1.42,;-4.82,-2.59,)|

BDBM670224

COc1ncc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1C |r,wU:12.15,9.8,(-9.7,.03,;-8.64,-1.14,;-7.16,-.8,;-6.09,-1.97,;-4.58,-1.66,;-4.06,-.15,;-2.58,.16,;-1.57,-.96,;-2.01,-2.47,;-.03,-.67,;.49,.78,;2,1.1,;3.04,-.02,;2.54,-1.5,;1.06,-1.82,;4.54,.29,;5.71,-.75,;5.71,-2.27,;7.04,-3.05,;8.37,-2.27,;8.37,-.75,;9.7,.03,;7.04,0,;6.73,1.56,;5.19,1.67,;4.41,3.05,;-5.13,.97,;-6.64,.68,;-7.7,1.82,)|

BDBM670225

Cc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)no1 |r,wU:10.13,7.6,(-8.9,.71,;-7.47,.11,;-6.14,.86,;-4.94,-.15,;-3.43,.16,;-2.42,-.96,;-2.86,-2.47,;-.85,-.67,;-.36,.79,;1.15,1.1,;2.19,-.02,;1.72,-1.51,;.21,-1.82,;3.7,.29,;4.9,-.75,;4.9,-2.28,;6.23,-3.05,;7.56,-2.28,;7.56,-.75,;8.9,.03,;6.23,0,;5.89,1.57,;4.38,1.67,;3.6,3.05,;-5.59,-1.58,;-7.13,-1.43,)|

BDBM670226

Cn1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cn1 |r,wU:10.13,7.6,(-8.76,.7,;-7.38,.09,;-6.02,.86,;-4.87,-.17,;-3.39,.17,;-2.39,-.96,;-2.83,-2.47,;-.88,-.68,;-.37,.78,;1.11,1.09,;2.14,-.01,;1.65,-1.5,;.17,-1.8,;3.62,.29,;4.8,-.73,;4.8,-2.29,;6.15,-3.03,;7.43,-2.29,;7.43,-.73,;8.76,.04,;6.07,.01,;5.77,1.55,;4.28,1.65,;3.49,3.03,;-5.51,-1.57,;-7.05,-1.42,)|

BDBM670227

Cn1ncc2cc(NC(=O)[C@H]3CC[C@H](CC3)n3c4cccc(Br)c4[nH]c3=O)ccc12 |r,wU:13.16,10.9,(-9.71,-2.54,;-8.8,-1.27,;-9.29,.22,;-8.03,1.13,;-6.76,.22,;-5.27,.56,;-4.17,-.49,;-2.68,-.15,;-1.61,-1.22,;-2,-2.76,;-.07,-.88,;.4,.61,;1.92,.95,;2.99,-.12,;2.55,-1.64,;1.06,-2.01,;4.51,.24,;5.74,-.75,;5.74,-2.28,;7.04,-3.02,;8.35,-2.28,;8.35,-.75,;9.71,.02,;7.04,.03,;6.65,1.58,;5.14,1.66,;4.27,3.02,;-4.62,-2.01,;-6.08,-2.4,;-7.23,-1.27,)|

BDBM670228

COc1ccc2n(C3CCN(CC3)C(=O)Nc3ccc(OC)c(Cl)c3)c(=O)[nH]c2c1

BDBM670229

COc1ccc(NC(=O)N2CCC(CC2)n2c3ccc(F)cc3[nH]c2=O)cc1Cl

BDBM670230

COc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(N)c3[nH]c2=O)cc1Cl

BDBM670231

CCCNc1cccc2n(C3CCN(CC3)C(=O)Nc3ccc(OC)c(Cl)c3)c(=O)[nH]c12

BDBM670232

COc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(SC)c3[nH]c2=O)cc1Cl

BDBM670233

COc1ccc(NC(=O)N2CCC(C(O)C2)n2c3cccc(Br)c3[nH]c2=O)cc1Cl

BDBM670234

COc1ccc(NC(=O)N2CCC(CC2)n2c3ccc(cc3[nH]c2=O)C#N)cc1Cl

BDBM670235

COc1ccc(NC(=O)N2CCC(CC2)n2c3ccc(C)cc3[nH]c2=O)cc1Cl

BDBM670236

COc1ccc(NC(=O)N2CCC(CC2)n2c3nccc(C)c3[nH]c2=O)cc1Cl

BDBM670237

COc1ccc(NC(=O)N2CCC(CC2)n2c3ncc(C)cc3[nH]c2=O)cc1Cl

BDBM670238

COc1ccc(NC(=O)N2CCC(CC2)n2c3cccc(F)c3[nH]c2=O)cc1Cl

BDBM670239

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cn1 |r,wU:12.15,9.8,(-9.69,.01,;-8.63,-1.16,;-7.12,-.85,;-6.05,-1.97,;-4.57,-1.68,;-4.05,-.17,;-2.57,.14,;-1.55,-.98,;-2,-2.51,;.01,-.69,;.5,.76,;2.01,1.07,;3.05,-.04,;2.55,-1.53,;1.05,-1.84,;4.56,.27,;5.75,-.77,;5.75,-2.28,;7.05,-3.02,;8.35,-2.28,;8.35,-.77,;9.69,0,;7.05,-.02,;6.74,1.52,;5.23,1.65,;4.43,3.02,;-5.12,.94,;-6.65,.63,)|

BDBM670240

Clc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cn1 |r,wU:11.14,8.7,(-9.17,-1.16,;-7.69,-.83,;-6.57,-1.97,;-5.08,-1.68,;-4.59,-.17,;-3.11,.14,;-2.09,-.98,;-2.51,-2.49,;-.53,-.7,;-.03,.76,;1.48,1.08,;2.52,-.04,;2.02,-1.53,;.51,-1.84,;4.03,.27,;5.23,-.77,;5.23,-2.28,;6.53,-3.03,;7.83,-2.28,;7.83,-.77,;9.17,0,;6.53,-.02,;6.22,1.54,;4.71,1.65,;3.9,3.03,;-5.66,.95,;-7.19,.63,)|

BDBM670241

Clc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cnc1Cl |r,wU:10.13,7.6,(-8.23,1.83,;-7.17,.68,;-5.68,.97,;-4.62,-.15,;-3.13,.16,;-2.12,-.96,;-2.56,-2.47,;-.56,-.67,;-.06,.79,;1.45,1.1,;2.49,-.02,;1.99,-1.51,;.51,-1.82,;4,.29,;5.2,-.75,;5.2,-2.29,;6.52,-3.05,;7.85,-2.29,;7.85,-.75,;9.2,.02,;6.52,.03,;6.19,1.57,;4.68,1.67,;3.87,3.05,;-5.11,-1.66,;-6.65,-1.97,;-7.71,-.8,;-9.2,-1.14,)|

BDBM670242

Brc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3cccc4cn[nH]c34)c(=O)[nH]c12 |r,wU:7.6,10.13,(7.46,-.95,;6.12,-1.7,;6.12,-3.24,;4.8,-3.98,;3.49,-3.24,;3.49,-1.7,;2.3,-.69,;.8,-1.03,;-.26,.06,;-1.76,-.28,;-2.25,-1.75,;-1.16,-2.84,;.34,-2.5,;-3.77,-2.06,;-4.18,-3.56,;-4.8,-.95,;-4.34,.55,;-2.84,.88,;-2.4,2.38,;-3.43,3.44,;-4.93,3.13,;-6.22,3.98,;-7.46,3.08,;-6.97,1.63,;-5.4,1.63,;2.92,.7,;2.12,2.04,;4.44,.6,;4.8,-.9,)|

BDBM670243

Cc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cnc1Cl |r,wU:10.13,7.6,(-8.14,1.8,;-7.07,.69,;-5.61,.98,;-4.55,-.13,;-3.09,.18,;-2.09,-.92,;-2.53,-2.41,;-.55,-.64,;-.06,.8,;1.45,1.1,;2.45,0,;1.96,-1.46,;.5,-1.77,;3.94,.31,;5.09,-.72,;5.09,-2.26,;6.43,-3.03,;7.76,-2.26,;7.76,-.72,;9.07,.05,;6.43,.05,;6.09,1.57,;4.6,1.67,;3.81,3.03,;-5.04,-1.59,;-6.55,-1.92,;-7.61,-.77,;-9.07,-1.1,)|

BDBM670244

Clc1cncc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c1 |r,wU:9.8,12.15,(-8.64,1.81,;-7.61,.67,;-8.07,-.83,;-7.06,-1.94,;-5.56,-1.63,;-5.07,-.13,;-3.56,.16,;-2.58,-.96,;-2.99,-2.46,;-1.05,-.67,;-.53,.78,;.97,1.09,;2.01,-.03,;1.52,-1.5,;.04,-1.81,;3.49,.29,;4.65,-.75,;4.65,-2.28,;6.03,-3.03,;7.32,-2.28,;7.32,-.73,;8.64,.03,;5.97,,;5.66,1.56,;4.16,1.66,;3.36,3.03,;-6.13,.98,)|

BDBM670245

Cc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)nc1 |r,wU:11.14,8.7,(-9.18,-1.14,;-7.68,-.83,;-6.57,-1.97,;-5.09,-1.65,;-4.57,-.18,;-3.09,.21,;-2.08,-.98,;-2.52,-2.48,;-.55,-.7,;-.03,.78,;1.5,1.07,;2.53,-.02,;2.04,-1.5,;.51,-1.81,;4.01,.29,;5.2,-.75,;5.2,-2.27,;6.52,-3.04,;7.85,-2.27,;7.85,-.75,;9.18,.03,;6.52,0,;6.19,1.53,;4.68,1.66,;3.91,3.04,;-5.66,.99,;-7.14,.65,)|

BDBM670246

Cc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cn1 |r,wU:11.14,8.7,(-9.21,-1.14,;-7.71,-.77,;-6.57,-1.91,;-5.1,-1.63,;-4.61,-.13,;-3.11,.18,;-2.1,-.93,;-2.54,-2.43,;-.55,-.65,;-.03,.8,;1.47,1.11,;2.53,.03,;2.03,-1.47,;.51,-1.78,;4.02,.31,;5.19,-.72,;5.19,-2.26,;6.53,-3.05,;7.87,-2.26,;7.87,-.72,;9.21,.06,;6.53,.03,;6.19,1.55,;4.7,1.68,;3.89,3.05,;-5.67,.98,;-7.19,.67,)|

BDBM670247

Oc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1 |r,wU:11.14,8.7,(-9.12,-1.12,;-7.61,-.81,;-6.61,-1.91,;-5.09,-1.6,;-4.58,-.14,;-3.12,.17,;-2.12,-.94,;-2.55,-2.45,;-.58,-.65,;-.06,.78,;1.42,1.09,;2.45,-.01,;1.96,-1.48,;.47,-1.78,;3.96,.3,;5.12,-.73,;5.12,-2.24,;6.45,-3.01,;7.79,-2.24,;7.79,-.73,;9.12,.04,;6.45,.04,;6.12,1.53,;4.6,1.68,;3.84,3.01,;-5.63,.94,;-7.12,.65,)|

BDBM670248

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1OC |r,wU:12.15,9.8,(-9.61,-.14,;-8.57,-1.27,;-7.11,-.93,;-6.06,-2.06,;-4.54,-1.75,;-4.06,-.27,;-2.57,.04,;-1.57,-1.06,;-2.01,-2.57,;-.06,-.81,;.47,.65,;1.96,.96,;2.98,-.14,;2.5,-1.63,;.99,-1.93,;4.47,.17,;5.65,-.86,;5.65,-2.42,;7,-3.16,;8.28,-2.42,;8.28,-.86,;9.61,-.09,;6.95,-.09,;6.62,1.42,;5.13,1.52,;4.34,2.91,;-5.08,.81,;-6.59,.55,;-7.62,1.68,;-7.16,3.16,)|

BDBM670249

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc(OC)c1OC |r,wU:11.14,8.7,(-5.48,-3.96,;-6.53,-2.78,;-6.07,-1.27,;-4.55,-.96,;-4.07,.5,;-2.58,.81,;-1.58,-.3,;-2.01,-1.81,;-.04,-.01,;.47,1.45,;1.96,1.73,;2.99,.65,;2.5,-.83,;.99,-1.14,;4.48,.96,;5.66,-.09,;5.66,-1.63,;6.99,-2.37,;8.3,-1.63,;8.3,-.09,;9.64,.71,;6.97,.68,;6.63,2.22,;5.14,2.32,;4.35,3.71,;-5.09,1.6,;-6.61,1.32,;-7.63,2.48,;-7.17,3.96,;-7.07,-.17,;-8.58,-.47,;-9.64,.68,)|

BDBM670250

Cc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)ccc1O |r,wU:10.13,7.6,(-8.27,1.79,;-7.18,.65,;-5.65,.94,;-4.61,-.15,;-3.13,.16,;-2.1,-.95,;-2.54,-2.46,;-.57,-.67,;-.05,.78,;1.45,1.09,;2.52,-.02,;2.02,-1.5,;.52,-1.81,;4.02,.29,;5.21,-.75,;5.21,-2.28,;6.53,-3.04,;7.86,-2.28,;7.86,-.75,;9.2,.02,;6.53,.03,;6.2,1.56,;4.67,1.66,;3.89,3.04,;-5.13,-1.63,;-6.63,-1.94,;-7.7,-.8,;-9.2,-1.14,)|

BDBM670251

Nc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c1 |r,wU:12.15,9.8,(-8.73,1.83,;-7.64,.66,;-8.13,-.83,;-7.11,-1.95,;-5.58,-1.64,;-5.08,-.15,;-3.59,.16,;-2.58,-.96,;-3.02,-2.47,;-1.01,-.67,;-.51,.79,;1,1.1,;2.04,-.02,;1.55,-1.51,;.06,-1.82,;3.56,.29,;4.73,-.75,;4.73,-2.28,;6.06,-3.06,;7.39,-2.28,;7.39,-.75,;8.73,.03,;6.06,0,;5.75,1.57,;4.23,1.67,;3.43,3.06,;-6.12,.94,)|

BDBM670252

Oc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c1 |r,wU:12.15,9.8,(-8.73,1.81,;-7.69,.67,;-8.16,-.83,;-7.15,-1.94,;-5.62,-1.63,;-5.13,-.13,;-3.63,.16,;-2.62,-.96,;-3.06,-2.46,;-1.06,-.67,;-.54,.78,;.98,1.09,;1.99,-.03,;1.5,-1.5,;.03,-1.81,;3.5,.28,;4.69,-.75,;4.69,-2.28,;6.06,-3.03,;7.38,-2.28,;7.38,-.75,;8.73,.03,;6.01,,;5.7,1.55,;4.17,1.68,;3.39,3.03,;-6.22,.96,)|

BDBM670253

Brc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc4OCCOc4c3)c(=O)[nH]c12 |r,wU:7.6,10.13,(9.63,.23,;8.32,-.57,;8.39,-2.13,;7.16,-2.93,;5.77,-2.26,;5.67,-.72,;4.46,.23,;2.97,-.15,;1.92,.87,;.4,.51,;-.01,-.95,;1.07,-2.03,;2.56,-1.65,;-1.56,-1.31,;-1.89,-2.83,;-2.61,-.28,;-4.07,-.67,;-4.49,-2.13,;-5.98,-2.52,;-7.08,-1.47,;-8.55,-1.85,;-9.63,-.8,;-9.24,.69,;-7.75,1.11,;-6.65,.03,;-5.18,.39,;5.03,1.62,;4.18,2.93,;6.54,1.57,;6.95,.13,)|

BDBM670254

CN(C)c1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c1 |r,wU:14.17,11.10,(-7.42,3.17,;-7.91,1.72,;-9.44,1.36,;-6.85,.56,;-7.32,-.94,;-6.31,-2.06,;-4.81,-1.75,;-4.32,-.25,;-2.82,.06,;-1.81,-1.07,;-2.25,-2.6,;-.28,-.79,;.23,.69,;1.73,1,;2.77,-.12,;2.28,-1.62,;.78,-1.93,;4.27,.19,;5.43,-.84,;5.43,-2.42,;6.8,-3.17,;8.1,-2.42,;8.1,-.84,;9.44,-.06,;6.75,-.09,;6.44,1.46,;4.91,1.56,;4.14,2.96,;-5.35,.84,)|

BDBM670255

Cc1n[nH]c2ccc(NC(=O)[C@H]3CC[C@H](CC3)n3c4cccc(Br)c4[nH]c3=O)cc12 |r,wU:14.17,11.10,(-8.31,2.41,;-8.26,.86,;-9.45,-.1,;-8.88,-1.56,;-7.3,-1.48,;-6.24,-2.54,;-4.73,-2.15,;-4.32,-.67,;-2.84,-.29,;-1.75,-1.32,;-2.11,-2.85,;-.22,-.96,;.19,.52,;1.72,.88,;2.76,-.16,;2.35,-1.66,;.87,-2.05,;4.27,.23,;5.48,-.73,;5.59,-2.28,;6.96,-2.96,;8.23,-2.13,;8.16,-.6,;9.45,.23,;6.78,.1,;6.37,1.58,;4.84,1.63,;3.98,2.96,;-5.43,.39,;-6.91,.03,)|

BDBM670256

CN(C)c1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1 |r,wU:13.16,10.9,(-9.76,.03,;-8.72,-1.14,;-9.16,-2.64,;-7.2,-.8,;-6.14,-1.94,;-4.61,-1.63,;-4.12,-.13,;-2.61,.16,;-1.61,-.96,;-2.05,-2.46,;-.05,-.67,;.47,.78,;1.99,1.09,;3.03,,;2.54,-1.48,;1.01,-1.79,;4.53,.28,;5.72,-.75,;5.72,-2.28,;7.09,-3.03,;8.41,-2.28,;8.41,-.75,;9.76,.03,;7.04,,;6.73,1.55,;5.2,1.66,;4.4,3.03,;-5.18,.96,;-6.68,.65,)|

BDBM670257

Oc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1Cl |r,wU:11.14,8.7,(-9.14,-1.14,;-7.66,-.81,;-6.61,-1.93,;-5.1,-1.63,;-4.58,-.17,;-3.1,.17,;-2.1,-.96,;-2.54,-2.47,;-.56,-.68,;-.05,.78,;1.43,1.09,;2.48,-.01,;2,-1.5,;.49,-1.8,;3.97,.3,;5.15,-.73,;5.15,-2.27,;6.48,-3.04,;7.81,-2.27,;7.81,-.73,;9.14,.04,;6.48,.04,;6.14,1.55,;4.63,1.65,;3.84,3.04,;-5.61,.94,;-7.15,.65,;-8.2,1.81,)|

BDBM670258

COc1ncc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1Cl |r,wU:12.15,9.8,(-9.7,.03,;-8.64,-1.14,;-7.13,-.83,;-6.09,-1.97,;-4.58,-1.66,;-4.06,-.15,;-2.58,.16,;-1.57,-.96,;-2.01,-2.47,;-.03,-.67,;.49,.78,;2,1.1,;3.04,-.02,;2.54,-1.5,;1.03,-1.82,;4.54,.29,;5.71,-.75,;5.71,-2.27,;7.04,-3.05,;8.37,-2.27,;8.37,-.75,;9.7,.03,;7.04,0,;6.73,1.54,;5.19,1.69,;4.41,3.05,;-5.13,.97,;-6.64,.68,;-7.7,1.82,)|

BDBM670259

Cc1nc2ccc(NC(=O)[C@H]3CC[C@H](CC3)n3c4cccc(Br)c4[nH]c3=O)cc2o1 |r,wU:13.16,10.9,(-10.17,.26,;-8.68,-.1,;-8.14,-1.54,;-6.54,-1.47,;-5.49,-2.52,;-4,-2.13,;-3.59,-.67,;-2.09,-.28,;-1.04,-1.31,;-1.37,-2.83,;.5,-.95,;.91,.51,;2.43,.87,;3.51,-.15,;3.1,-1.65,;1.61,-2.03,;4.97,.23,;6.21,-.72,;6.28,-2.26,;7.7,-2.93,;8.93,-2.11,;8.86,-.57,;10.17,.23,;7.49,.13,;7.08,1.59,;5.57,1.65,;4.72,2.93,;-4.64,.39,;-6.16,.03,;-7.47,.85,)|

BDBM670260

Brc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc4ncccc4c3)c(=O)[nH]c12 |r,wU:7.6,10.13,(9.69,.23,;8.4,-.59,;8.45,-2.14,;7.19,-2.94,;5.8,-2.27,;5.72,-.72,;4.48,.23,;2.99,-.15,;1.91,.88,;.41,.52,;,-.95,;1.08,-2.03,;2.58,-1.65,;-1.55,-1.34,;-1.91,-2.86,;-2.63,-.28,;-4.1,-.67,;-4.51,-2.14,;-6.03,-2.52,;-7.14,-1.47,;-8.63,-1.85,;-9.69,-.8,;-9.3,.7,;-7.8,1.08,;-6.7,.03,;-5.2,.39,;5.07,1.62,;4.2,2.94,;6.57,1.57,;6.98,.08,)|

BDBM670261

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(OC)c3[nH]c2=O)cc1 |r,wU:12.15,9.8,(-10.41,.03,;-9.35,-1.14,;-7.84,-.8,;-6.78,-1.94,;-5.25,-1.63,;-4.76,-.15,;-3.26,.16,;-2.25,-.95,;-2.69,-2.46,;-.69,-.67,;-.17,.78,;1.33,1.09,;2.37,-.02,;1.87,-1.5,;.4,-1.81,;3.89,.29,;5.09,-.75,;5.09,-2.28,;6.41,-3.04,;7.73,-2.28,;7.73,-.75,;9.07,.03,;10.41,-.75,;6.41,.03,;6.07,1.56,;4.57,1.66,;3.76,3.04,;-5.8,.94,;-7.32,.65,)|

BDBM670262

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(OC)c3[nH]c2=O)cc1C |r,wU:12.15,9.8,(-10.35,0,;-9.3,-1.13,;-7.8,-.79,;-6.74,-1.93,;-5.22,-1.62,;-4.73,-.15,;-3.24,.16,;-2.21,-.95,;-2.65,-2.44,;-.69,-.67,;-.17,.78,;1.35,1.09,;2.38,0,;1.89,-1.46,;.39,-1.8,;3.87,.29,;5.06,-.74,;5.06,-2.25,;6.37,-3.02,;7.68,-2.25,;7.68,-.74,;9.02,.03,;10.35,-.74,;6.37,0,;6.04,1.55,;4.54,1.65,;3.74,3.02,;-5.77,.96,;-7.29,.67,;-8.34,1.81,)|

BDBM670263

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(OC)c3[nH]c2=O)cc1F |r,wU:12.15,9.8,(-10.41,0,;-9.34,-1.14,;-7.84,-.8,;-6.78,-1.94,;-5.25,-1.63,;-4.76,-.15,;-3.26,.16,;-2.22,-.95,;-2.66,-2.46,;-.69,-.67,;-.18,.78,;1.35,1.09,;2.39,0,;1.9,-1.47,;.39,-1.81,;3.89,.29,;5.08,-.75,;5.08,-2.27,;6.4,-3.03,;7.73,-2.27,;7.73,-.75,;9.07,.03,;10.41,-.75,;6.4,0,;6.07,1.56,;4.57,1.66,;3.76,3.03,;-5.8,.96,;-7.32,.68,;-8.39,1.82,)|

BDBM670264

COc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3cnc(OC)c(C)c3)c(=O)[nH]c12 |r,wU:8.7,11.14,(10.41,-.75,;9.07,.03,;7.73,-.75,;7.73,-2.27,;6.4,-3.03,;5.08,-2.27,;5.08,-.75,;3.89,.29,;2.39,0,;1.35,1.09,;-.18,.78,;-.69,-.67,;.39,-1.81,;1.9,-1.47,;-2.22,-.95,;-2.66,-2.46,;-3.26,.16,;-4.76,-.15,;-5.25,-1.63,;-6.78,-1.94,;-7.84,-.8,;-9.34,-1.14,;-10.41,0,;-7.32,.68,;-8.39,1.82,;-5.8,.96,;4.57,1.66,;3.76,3.03,;6.07,1.56,;6.4,0,)|

BDBM670265

COc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc4cc[nH]c4c3)c(=O)[nH]c12 |r,wU:8.7,11.14,(10.05,-.78,;8.69,.04,;7.35,-.76,;7.35,-2.3,;6.04,-3.04,;4.68,-2.3,;4.68,-.76,;3.53,.3,;2.04,-.01,;1.02,1.06,;-.5,.78,;-1.01,-.68,;.04,-1.81,;1.55,-1.5,;-2.52,-.96,;-2.96,-2.48,;-3.55,.17,;-5.01,-.17,;-5.53,-1.63,;-7.01,-1.94,;-8.04,-.81,;-9.58,-.81,;-10.05,.65,;-8.79,1.57,;-7.55,.65,;-6.04,.94,;4.17,1.65,;3.4,3.04,;5.69,1.55,;6.02,.04,)|

BDBM670266

COc1cc(NC(=O)N2CCC(CC2)n2c3ccccc3[nH]c2=O)ccc1C

BDBM670267

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(F)c3[nH]c2=O)cc1 |r,wU:12.15,9.8,(-9.73,0,;-8.67,-1.14,;-7.17,-.8,;-6.65,.68,;-5.12,.96,;-4.09,-.15,;-2.59,.16,;-1.55,-.95,;-1.99,-2.46,;-.02,-.67,;.5,.78,;2.02,1.09,;3.06,0,;2.57,-1.47,;1.06,-1.81,;4.56,.29,;5.75,-.75,;5.75,-2.27,;7.07,-3.03,;8.39,-2.27,;8.39,-.75,;9.73,.03,;7.07,0,;6.74,1.56,;5.23,1.66,;4.43,3.03,;-4.58,-1.63,;-6.11,-1.94,)|

BDBM670268

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(F)c3[nH]c2=O)cc1C |r,wU:12.15,9.8,(-9.71,0,;-8.65,-1.13,;-7.15,-.8,;-6.09,-1.93,;-4.57,-1.62,;-4.08,-.15,;-2.58,.16,;-1.55,-.95,;-1.99,-2.45,;-.02,-.67,;.49,.78,;2.02,1.09,;3.05,0,;2.56,-1.47,;1.06,-1.8,;4.55,.29,;5.74,-.74,;5.74,-2.26,;7.05,-3.03,;8.37,-2.26,;8.37,-.74,;9.71,.03,;7.05,0,;6.72,1.55,;5.22,1.66,;4.42,3.03,;-5.11,.96,;-6.64,.68,;-7.64,1.85,)|

BDBM670269

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(F)c3[nH]c2=O)cc1F |r,wU:12.15,9.8,(-9.73,0,;-8.67,-1.14,;-7.17,-.8,;-6.11,-1.94,;-4.58,-1.63,;-4.09,-.15,;-2.59,.16,;-1.55,-.95,;-1.99,-2.46,;-.02,-.67,;.5,.78,;2.02,1.09,;3.06,0,;2.57,-1.47,;1.06,-1.81,;4.56,.29,;5.75,-.75,;5.75,-2.27,;7.07,-3.03,;8.39,-2.27,;8.39,-.75,;9.73,.03,;7.07,0,;6.74,1.56,;5.23,1.66,;4.43,3.03,;-5.12,.96,;-6.65,.68,;-7.66,1.85,)|

BDBM670270

COc1ncc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(F)c3[nH]c2=O)cc1C |r,wU:12.15,9.8,(-9.73,0,;-8.67,-1.14,;-7.17,-.8,;-6.11,-1.94,;-4.58,-1.63,;-4.09,-.15,;-2.59,.16,;-1.55,-.95,;-1.99,-2.46,;-.02,-.67,;.5,.78,;2.02,1.09,;3.06,0,;2.57,-1.47,;1.06,-1.81,;4.56,.29,;5.75,-.75,;5.75,-2.27,;7.07,-3.03,;8.39,-2.27,;8.39,-.75,;9.73,.03,;7.07,0,;6.74,1.56,;5.23,1.66,;4.43,3.03,;-5.12,.96,;-6.65,.68,;-7.66,1.85,)|

BDBM670271

Fc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc4cc[nH]c4c3)c(=O)[nH]c12 |r,wU:7.6,10.13,(9.44,.02,;8.1,-.75,;8.1,-2.29,;6.77,-3.05,;5.44,-2.29,;5.44,-.75,;4.25,.29,;2.74,-.02,;1.7,1.1,;.19,.79,;-.31,-.67,;.76,-1.82,;2.24,-1.51,;-1.87,-.96,;-2.29,-2.47,;-2.88,.16,;-4.37,-.15,;-4.86,-1.64,;-6.4,-1.95,;-7.44,-.8,;-8.97,-.8,;-9.44,.68,;-8.22,1.59,;-6.92,.66,;-5.41,.94,;4.92,1.67,;4.12,3.05,;6.43,1.57,;6.77,.03,)|

BDBM670272

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cc(F)ccc3[nH]c2=O)cc1 |r,wU:12.15,9.8,(-8.97,.81,;-7.92,-.35,;-6.43,-.01,;-5.38,-1.14,;-3.89,-.86,;-3.38,.63,;-1.91,.94,;-.91,-.17,;-1.35,-1.68,;.63,.12,;1.14,1.58,;2.66,1.86,;3.66,.78,;3.17,-.71,;1.68,-1.01,;5.15,1.09,;6.33,.04,;6.33,-1.5,;7.66,-2.25,;7.66,-3.81,;8.97,-1.5,;8.97,.04,;7.64,.81,;7.3,2.32,;5.81,2.45,;5.02,3.81,;-4.4,1.73,;-5.92,1.42,)|

BDBM670273

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cc(F)ccc3[nH]c2=O)cc1C |r,wU:12.15,9.8,(-8.97,.77,;-7.91,-.36,;-6.45,-.03,;-5.4,-1.16,;-3.89,-.85,;-3.4,.61,;-1.91,.92,;-.91,-.18,;-1.35,-1.67,;.63,.07,;1.14,1.56,;2.66,1.84,;3.66,.77,;3.17,-.72,;1.71,-1.03,;5.14,1.07,;6.32,.02,;6.32,-1.49,;7.66,-2.26,;7.66,-3.79,;8.97,-1.49,;8.97,.02,;7.63,.79,;7.3,2.31,;5.81,2.43,;5.02,3.79,;-4.43,1.72,;-5.91,1.43,;-6.99,2.56,)|

BDBM670274

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cc(F)ccc3[nH]c2=O)cc1F |r,wU:12.15,9.8,(-9.03,.79,;-7.96,-.37,;-6.49,-.04,;-5.43,-1.18,;-3.9,-.87,;-3.41,.64,;-1.9,.92,;-.89,-.17,;-1.33,-1.72,;.66,.09,;1.18,1.57,;2.71,1.85,;3.72,.77,;3.22,-.74,;1.7,-1.05,;5.22,1.08,;6.38,.01,;6.38,-1.52,;7.7,-2.27,;7.7,-3.82,;9.03,-1.52,;9.03,.01,;7.7,.79,;7.39,2.32,;5.89,2.45,;5.09,3.82,;-4.44,1.72,;-5.94,1.44,;-7.01,2.6,)|

BDBM670275

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cc(F)ccc3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-7.04,3.97,;-7.5,2.47,;-6.44,1.33,;-4.94,1.62,;-3.91,.5,;-2.43,.81,;-1.42,-.3,;-1.86,-1.82,;.13,-.01,;.62,1.46,;2.15,1.75,;3.16,.66,;2.66,-.84,;1.16,-1.15,;4.66,.97,;5.82,-.09,;5.82,-1.64,;7.16,-2.39,;7.16,-3.97,;8.48,-1.64,;8.48,-.12,;7.14,.69,;6.83,2.21,;5.33,2.34,;4.53,3.71,;-4.42,-.97,;-5.92,-1.28,;-6.98,-.14,;-8.48,-.45,)|

BDBM670276

Cc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cc(F)ccc3[nH]c2=O)ccc1O |r,wU:10.13,7.6,(-7.47,2.59,;-6.44,1.44,;-4.93,1.72,;-3.9,.62,;-2.44,.92,;-1.44,-.18,;-1.85,-1.67,;.1,.08,;.62,1.57,;2.1,1.85,;3.13,.77,;2.64,-.72,;1.13,-1.03,;4.62,1.08,;5.77,.03,;5.77,-1.49,;7.11,-2.26,;7.11,-3.8,;8.42,-1.49,;8.42,.03,;7.08,.8,;6.77,2.31,;5.26,2.44,;4.49,3.8,;-4.41,-.85,;-5.9,-1.15,;-6.95,-.03,;-8.42,-.36,)|

BDBM670277

Cc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1O |r,wU:11.14,8.7,(-9.24,-1.17,;-7.73,-.8,;-6.67,-1.95,;-5.13,-1.63,;-4.61,-.15,;-3.13,.16,;-2.12,-.96,;-2.56,-2.47,;-.56,-.67,;-.04,.78,;1.47,1.1,;2.51,-.02,;2.02,-1.5,;.54,-1.82,;4.05,.29,;5.24,-.75,;5.24,-2.29,;6.57,-3.05,;7.89,-2.29,;7.89,-.75,;9.24,.02,;6.57,.03,;6.23,1.56,;4.7,1.67,;3.92,3.05,;-5.68,.94,;-7.19,.65,;-8.25,1.82,)|

BDBM670278

Cc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c(O)c1 |r,wU:11.14,8.7,(-9.24,-1.17,;-7.73,-.8,;-6.67,-1.95,;-5.13,-1.63,;-4.61,-.15,;-3.13,.16,;-2.12,-.96,;-2.56,-2.47,;-.56,-.67,;-.04,.78,;1.47,1.1,;2.51,-.02,;2.02,-1.5,;.54,-1.82,;4.05,.29,;5.24,-.75,;5.24,-2.29,;6.57,-3.05,;7.89,-2.29,;7.89,-.75,;9.24,.02,;6.57,.03,;6.23,1.56,;4.7,1.67,;3.92,3.05,;-5.68,.94,;-5.21,2.42,;-7.19,.65,)|

BDBM670279

Cc1cc(N)c(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1C |r,wU:12.15,9.8,(-9.22,-.93,;-7.72,-.59,;-7.2,.85,;-5.73,1.16,;-5.24,2.64,;-4.64,.05,;-3.14,.36,;-2.11,-.75,;-2.55,-2.25,;-.58,-.47,;-.06,.98,;1.46,1.29,;2.5,.21,;2,-1.27,;.48,-1.58,;4,.49,;5.19,-.52,;5.19,-2.07,;6.53,-2.82,;7.88,-2.07,;7.88,-.52,;9.22,.23,;6.51,.23,;6.19,1.76,;4.67,1.86,;3.87,3.23,;-5.13,-1.4,;-6.66,-1.71,;-7.1,-3.23,)|

BDBM670280

NC(=O)c1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)cc1 |r,wU:13.16,10.9,(-9.78,-.04,;-8.71,-1.17,;-9.15,-2.65,;-7.2,-.8,;-6.65,.65,;-5.14,.94,;-4.08,-.15,;-2.6,.16,;-1.58,-.96,;-2.02,-2.47,;-.02,-.67,;.5,.78,;2.01,1.1,;3.05,-.02,;2.55,-1.5,;1.07,-1.82,;4.58,.29,;5.78,-.75,;5.78,-2.29,;7.1,-3.05,;8.43,-2.29,;8.43,-.75,;9.78,.02,;7.1,.03,;6.76,1.56,;5.23,1.67,;4.45,3.05,;-4.6,-1.63,;-6.13,-1.95,)|

BDBM670281

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(-c4cccc(OCCN(C)C)c4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-12.38,3.14,;-12.84,1.68,;-11.79,.52,;-10.27,.8,;-9.24,-.28,;-7.78,.08,;-6.77,-1.08,;-7.21,-2.59,;-5.26,-.79,;-4.72,.65,;-3.25,.93,;-2.2,-.15,;-2.69,-1.62,;-4.2,-1.92,;-.71,.16,;.45,-.87,;.45,-2.38,;1.76,-3.14,;3.07,-2.38,;3.07,-.87,;4.46,-.1,;4.49,1.44,;5.77,2.19,;7.11,1.42,;7.11,-.07,;8.44,-.87,;9.76,-.12,;11.14,-.87,;12.43,-.1,;12.43,1.44,;13.79,-.9,;5.82,-.84,;1.76,-.12,;1.45,1.42,;-.06,1.55,;-.84,2.88,;-9.76,-1.74,;-11.2,-2.08,;-12.28,-.97,;-13.79,-1.28,)|

BDBM670282

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3ccccc3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-6.98,3.17,;-7.44,1.68,;-6.41,.53,;-4.9,.81,;-3.87,-.3,;-2.41,.04,;-1.41,-1.06,;-1.85,-2.6,;.1,-.81,;.62,.65,;2.1,.96,;3.13,-.14,;2.64,-1.63,;1.15,-1.94,;4.62,.17,;5.77,-.86,;5.77,-2.42,;7.13,-3.17,;8.42,-2.42,;8.42,-.89,;7.08,-.12,;6.77,1.42,;5.26,1.53,;4.49,2.91,;-4.39,-1.76,;-5.88,-2.07,;-6.93,-.94,;-8.42,-1.24,)|

BDBM670283

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(O)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-7.7,3.16,;-8.18,1.68,;-7.13,.52,;-5.6,.81,;-4.57,-.29,;-3.11,.04,;-2.09,-1.09,;-2.52,-2.6,;-.55,-.81,;-.06,.65,;1.45,.93,;2.47,-.14,;1.98,-1.63,;.47,-1.93,;3.96,.17,;5.13,-.88,;5.13,-2.42,;6.49,-3.16,;7.8,-2.42,;7.8,-.88,;9.13,-.09,;6.44,-.12,;6.13,1.42,;4.62,1.52,;3.83,2.91,;-5.08,-1.75,;-6.59,-2.06,;-7.64,-.93,;-9.13,-1.29,)|

BDBM670284

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NCCN(C)C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-11.99,-3.41,;-10.48,-3.05,;-9.99,-1.54,;-8.49,-1.26,;-8,.25,;-6.49,.53,;-5.48,-.58,;-5.92,-2.09,;-3.95,-.3,;-3.43,1.15,;-1.91,1.46,;-.87,.38,;-1.36,-1.1,;-2.89,-1.41,;.64,.66,;1.8,-.35,;1.8,-1.87,;3.12,-2.64,;4.45,-1.87,;4.45,-.35,;5.82,.38,;5.82,1.92,;7.17,-.35,;8.46,.38,;9.89,-.35,;11.21,.4,;11.21,1.96,;12.58,-.4,;3.12,.4,;2.81,1.93,;1.28,2.06,;.51,3.41,;-9.03,1.33,;-10.54,1.02,;-11.05,-.43,;-12.58,-.74,)|

BDBM670285

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N(C)CCN(C)C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.39,3.18,;-10.85,1.69,;-9.8,.54,;-8.29,.82,;-7.26,-.28,;-5.8,.05,;-4.77,-1.08,;-5.21,-2.59,;-3.26,-.8,;-2.74,.67,;-1.26,.97,;-.21,-.13,;-.69,-1.62,;-2.21,-1.92,;1.28,.18,;2.44,-.87,;2.44,-2.41,;3.77,-3.18,;5.1,-2.41,;5.1,-.87,;6.41,-.08,;6.41,1.46,;7.8,-.85,;9.06,-.1,;10.42,-.85,;11.8,-.08,;10.42,-2.39,;3.77,-.08,;3.44,1.44,;1.92,1.54,;1.15,2.92,;-7.77,-1.74,;-9.26,-2.05,;-10.31,-.92,;-11.8,-1.28,)|

BDBM670286

COc1ccc(CSc2cccc3n([C@@H]4CC[C@@H](CC4)C(=O)Nc4ccc(C)c(OC)c4)c(=O)[nH]c23)cc1 |r,wU:14.13,17.20,(13.21,1.38,;11.84,2.19,;10.5,1.44,;9.16,2.21,;7.83,1.44,;7.83,-.1,;6.5,-.87,;5.12,-.1,;3.75,-.87,;3.75,-2.39,;2.43,-3.16,;1.11,-2.39,;1.11,-.87,;-.05,.16,;-1.55,-.12,;-2.58,.96,;-4.08,.65,;-4.6,-.8,;-3.54,-1.94,;-2.04,-1.63,;-6.13,-1.08,;-6.57,-2.58,;-7.16,.03,;-8.63,-.28,;-9.13,-1.75,;-10.65,-2.06,;-11.71,-.93,;-13.21,-1.24,;-11.17,.52,;-12.23,1.69,;-11.76,3.16,;-9.67,.81,;.6,1.53,;-.18,2.9,;2.1,1.43,;2.43,-.12,;9.16,-.87,;10.5,-.1,)|

BDBM670287

OCc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)c1 |r,wU:13.16,10.9,(-8.28,3.18,;-8.75,1.7,;-7.68,.53,;-8.23,-.93,;-7.16,-2.07,;-5.63,-1.76,;-5.11,-.28,;-3.62,.03,;-2.61,-1.09,;-3.05,-2.59,;-1.05,-.8,;-.53,.66,;.98,.97,;2.02,-.15,;1.52,-1.63,;.04,-1.94,;3.55,.16,;4.75,-.88,;4.75,-2.42,;6.07,-3.18,;7.4,-2.42,;7.4,-.88,;8.75,-.11,;6.07,-.1,;5.74,1.44,;4.2,1.54,;3.42,2.92,;-6.17,.81,)|

BDBM670288

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccnc3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-7.02,3.17,;-7.48,1.69,;-6.43,.54,;-4.92,.82,;-3.9,-.26,;-2.42,.05,;-1.42,-1.07,;-1.85,-2.58,;.11,-.79,;.63,.66,;2.11,.97,;3.16,-.13,;2.67,-1.61,;1.16,-1.92,;4.64,.18,;5.79,-.84,;5.79,-2.4,;7.18,-3.17,;8.45,-2.4,;8.45,-.84,;7.12,-.08,;6.79,1.43,;5.31,1.53,;4.51,2.92,;-4.39,-1.74,;-5.9,-2.05,;-6.94,-.92,;-8.45,-1.23,)|

BDBM670289

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccnc3[nH]c2=O)cc1C |r,wU:12.15,9.8,(-9.03,.04,;-7.96,-1.13,;-6.49,-.79,;-5.43,-1.93,;-3.92,-1.62,;-3.41,-.14,;-1.93,.17,;-.92,-.95,;-1.36,-2.45,;.63,-.66,;1.15,.79,;2.63,1.1,;3.69,.01,;3.2,-1.49,;1.7,-1.8,;5.19,.3,;6.36,-.74,;6.36,-2.27,;7.7,-3.04,;9.03,-2.29,;9.03,-.74,;7.68,.04,;7.37,1.57,;5.84,1.67,;5.06,3.04,;-4.44,.95,;-5.97,.66,;-7.03,1.83,)|

BDBM670290

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccnc3[nH]c2=O)cc1 |r,wU:12.15,9.8,(-9.03,.04,;-7.96,-1.13,;-6.49,-.79,;-5.97,.66,;-4.44,.95,;-3.41,-.14,;-1.93,.17,;-.92,-.95,;-1.33,-2.45,;.63,-.66,;1.15,.79,;2.65,1.1,;3.69,.01,;3.2,-1.46,;1.7,-1.77,;5.19,.3,;6.36,-.71,;6.36,-2.27,;7.73,-3.04,;9.03,-2.27,;9.03,-.74,;7.68,.04,;7.37,1.57,;5.84,1.67,;5.06,3.04,;-3.92,-1.62,;-5.4,-1.93,)|

BDBM670291

COc1ncc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccnc3[nH]c2=O)cc1C |r,wU:12.15,9.8,(-9.03,-.04,;-7.96,-1.13,;-6.46,-.82,;-5.43,-1.96,;-3.92,-1.64,;-3.41,-.14,;-1.93,.17,;-.92,-.95,;-1.36,-2.45,;.63,-.66,;1.15,.79,;2.63,1.1,;3.69,.01,;3.2,-1.49,;1.67,-1.8,;5.19,.3,;6.36,-.74,;6.36,-2.27,;7.71,-3.04,;9.03,-2.29,;9.03,-.74,;7.68,.04,;7.37,1.54,;5.84,1.7,;5.06,3.04,;-4.47,.97,;-5.97,.69,;-7.03,1.83,)|

BDBM670292

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3ccncc3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-7.03,3.14,;-7.52,1.68,;-6.46,.55,;-4.98,.81,;-3.92,-.27,;-2.44,.04,;-1.44,-1.06,;-1.87,-2.55,;.1,-.78,;.62,.65,;2.1,.96,;3.16,-.12,;2.67,-1.6,;1.15,-1.91,;4.64,.17,;5.82,-.86,;5.82,-2.37,;7.16,-3.14,;8.47,-2.37,;8.47,-.86,;7.13,-.09,;6.8,1.4,;5.31,1.53,;4.51,2.89,;-4.41,-1.73,;-5.93,-2.04,;-6.98,-.91,;-8.47,-1.27,)|

BDBM670293

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(S)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-7.71,3.14,;-8.18,1.67,;-7.12,.5,;-5.59,.78,;-4.55,-.3,;-3.08,.01,;-2.07,-1.11,;-2.51,-2.61,;-.51,-.82,;0,.66,;1.48,.94,;2.54,-.15,;2.05,-1.65,;.52,-1.96,;4.04,.14,;5.24,-.9,;5.24,-2.4,;6.53,-3.14,;7.83,-2.4,;7.83,-.9,;9.16,-.13,;6.53,-.15,;6.22,1.38,;4.69,1.54,;3.92,2.88,;-5.07,-1.78,;-6.57,-2.09,;-7.64,-.95,;-9.16,-1.26,)|

BDBM670294

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3ccc(cc3[nH]c2=O)C#N)ccc1C |r,wU:11.14,8.7,(-8.42,3.6,;-8.88,2.09,;-7.82,.92,;-6.31,1.21,;-5.26,.09,;-3.78,.42,;-2.76,-.72,;-3.18,-2.26,;-1.2,-.46,;-.68,1.05,;.8,1.36,;1.87,.24,;1.38,-1.27,;-.16,-1.58,;3.38,.55,;4.55,-.51,;4.55,-2.03,;5.86,-2.77,;7.16,-2.03,;7.16,-.51,;5.86,.27,;5.54,1.83,;4.03,1.93,;3.25,3.34,;8.5,-2.82,;9.85,-3.6,;-5.76,-1.4,;-7.3,-1.71,;-8.36,-.57,;-9.85,-.93,)|

BDBM670295

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(c3[nH]c2=O)S(=O)(=O)CC(O)=O)ccc1C |r,wU:11.14,8.7,(-9.69,3.17,;-10.15,1.68,;-9.1,.53,;-7.59,.81,;-6.58,-.3,;-5.1,.04,;-4.09,-1.09,;-4.53,-2.61,;-2.55,-.81,;-2.07,.65,;-.58,.96,;.45,-.14,;-.04,-1.63,;-1.53,-1.94,;1.94,.17,;3.12,-.89,;3.12,-2.43,;4.48,-3.17,;5.76,-2.43,;5.76,-.86,;4.4,-.12,;4.09,1.42,;2.61,1.53,;1.81,2.91,;7.1,-.09,;6.33,1.24,;7.87,-1.45,;8.41,.65,;9.72,-.12,;9.72,-1.65,;11.1,.68,;-7.07,-1.76,;-8.56,-2.07,;-9.61,-.94,;-11.1,-1.3,)|

BDBM670296

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N4CCNCC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.09,3.18,;-9.56,1.69,;-8.5,.52,;-7.01,.81,;-5.95,-.26,;-4.44,.03,;-3.43,-1.09,;-3.87,-2.6,;-1.89,-.8,;-1.37,.65,;.14,.97,;1.18,-.13,;.68,-1.63,;-.8,-1.95,;2.69,.16,;3.86,-.88,;3.86,-2.41,;5.18,-3.18,;6.51,-2.41,;6.51,-.88,;7.84,-.1,;9.19,-.87,;10.52,-.1,;10.52,1.44,;9.19,2.21,;7.84,1.44,;5.18,-.13,;4.87,1.43,;3.33,1.56,;2.56,2.92,;-6.44,-1.76,;-7.98,-2.08,;-9.02,-.93,;-10.52,-1.3,)|

BDBM670297

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N4CCOCC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.09,3.18,;-9.56,1.69,;-8.5,.52,;-7.01,.81,;-5.95,-.26,;-4.44,.03,;-3.43,-1.09,;-3.87,-2.6,;-1.89,-.8,;-1.37,.65,;.14,.97,;1.18,-.13,;.68,-1.63,;-.8,-1.95,;2.69,.16,;3.86,-.88,;3.86,-2.41,;5.18,-3.18,;6.51,-2.41,;6.51,-.88,;7.84,-.1,;9.19,-.87,;10.52,-.1,;10.52,1.44,;9.19,2.21,;7.84,1.44,;5.18,-.13,;4.87,1.43,;3.33,1.56,;2.56,2.92,;-6.44,-1.76,;-7.98,-2.08,;-9.02,-.93,;-10.52,-1.3,)|

BDBM670298

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(OCC(O)=O)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.8,3.2,;-10.27,1.69,;-9.21,.52,;-7.7,.81,;-6.66,-.28,;-5.15,.03,;-4.13,-1.11,;-4.58,-2.65,;-2.6,-.83,;-2.08,.65,;-.57,.97,;.47,-.15,;-.03,-1.66,;-1.53,-1.97,;1.98,.16,;3.15,-.91,;3.15,-2.44,;4.47,-3.2,;5.8,-2.44,;5.8,-.91,;7.2,-.1,;8.58,-.88,;9.85,-.15,;11.23,-.91,;9.88,1.46,;4.47,-.13,;4.16,1.43,;2.65,1.54,;1.85,2.94,;-7.15,-1.79,;-8.66,-2.1,;-9.72,-.96,;-11.23,-1.32,)|

BDBM670299

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N(C)Cc4ccccc4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.39,3.16,;-10.86,1.69,;-9.8,.52,;-8.32,.81,;-7.26,-.25,;-5.76,.03,;-4.75,-1.08,;-5.19,-2.59,;-3.22,-.8,;-2.7,.65,;-1.2,.96,;-.16,-.13,;-.65,-1.63,;-2.13,-1.94,;1.34,.16,;2.51,-.88,;2.51,-2.4,;3.83,-3.16,;5.15,-2.4,;5.15,-.88,;6.48,-.1,;6.48,1.44,;7.82,-.86,;9.15,-.1,;10.48,-.87,;11.82,-.1,;11.82,1.44,;10.48,2.21,;9.15,1.44,;3.83,-.13,;3.52,1.43,;1.99,1.56,;1.21,2.9,;-7.75,-1.76,;-9.28,-2.07,;-10.31,-.93,;-11.82,-1.29,)|

BDBM670300

CNc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc(C)c(OC)c3)c(=O)[nH]c12 |r,wU:8.7,11.14,(9.79,-.91,;8.41,-.09,;7.1,-.88,;7.1,-2.42,;5.82,-3.17,;4.43,-2.42,;4.43,-.88,;3.28,.17,;1.79,-.14,;.77,.96,;-.72,.65,;-1.23,-.81,;-.21,-1.94,;1.31,-1.63,;-2.77,-1.06,;-3.2,-2.6,;-3.77,.04,;-5.25,-.29,;-5.74,-1.76,;-7.23,-2.06,;-8.3,-.94,;-9.79,-1.29,;-7.77,.53,;-8.82,1.68,;-8.36,3.17,;-6.28,.81,;3.95,1.53,;3.15,2.91,;5.43,1.42,;5.77,-.09,)|

BDBM670301

COCCOc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc(C)c(OC)c3)c(=O)[nH]c12 |r,wU:11.10,14.17,(11.86,-.11,;10.52,-.88,;9.18,-.1,;7.85,-.87,;6.5,-.1,;5.17,-.88,;5.17,-2.41,;3.84,-3.18,;2.52,-2.41,;2.52,-.88,;1.35,.16,;-.16,-.13,;-1.2,.97,;-2.71,.65,;-3.23,-.8,;-2.14,-1.95,;-.66,-1.63,;-4.76,-1.09,;-5.21,-2.6,;-5.78,.03,;-7.29,-.26,;-7.78,-1.76,;-9.32,-2.08,;-10.36,-.93,;-11.86,-1.3,;-9.84,.52,;-10.9,1.69,;-10.43,3.18,;-8.35,.81,;2,1.56,;1.22,2.92,;3.53,1.43,;3.84,-.13,)|

BDBM670302

COCCOc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc4cc[nH]c4c3)c(=O)[nH]c12 |r,wU:11.10,14.17,(12.04,-.04,;10.73,-.78,;9.44,-.03,;8.14,-.77,;6.84,-.01,;5.54,-.75,;5.54,-2.27,;4.22,-3.04,;2.9,-2.27,;2.9,-.75,;1.69,.28,;.19,-.04,;-.86,1.07,;-2.36,.75,;-2.88,-.71,;-1.78,-1.85,;-.3,-1.52,;-4.43,-1.01,;-4.84,-2.52,;-5.45,.11,;-6.93,-.22,;-7.44,-1.7,;-8.98,-2.02,;-10.02,-.89,;-11.58,-.9,;-12.04,.58,;-10.82,1.5,;-9.51,.57,;-7.98,.87,;2.36,1.66,;1.57,3.04,;3.9,1.57,;4.22,.01,)|

BDBM670303

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NCCN)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.32,3.18,;-10.78,1.69,;-9.73,.54,;-8.24,.82,;-7.21,-.28,;-5.75,.05,;-4.72,-1.08,;-5.16,-2.59,;-3.21,-.8,;-2.7,.67,;-1.23,.98,;-.18,-.13,;-.67,-1.62,;-2.18,-1.93,;1.31,.18,;2.46,-.87,;2.46,-2.41,;3.8,-3.18,;5.11,-2.41,;5.11,-.87,;6.42,-.13,;6.42,1.41,;7.78,-.85,;9.09,-.1,;10.47,-.85,;11.76,-.08,;3.77,-.1,;3.47,1.44,;1.95,1.54,;1.18,2.93,;-7.7,-1.75,;-9.21,-2.05,;-10.27,-.92,;-11.76,-1.28,)|

BDBM670304

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NCC(O)CO)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-12.02,-3.41,;-10.49,-3.07,;-10,-1.57,;-8.49,-1.26,;-7.98,.22,;-6.5,.53,;-5.49,-.58,;-5.93,-2.08,;-3.94,-.32,;-3.42,1.15,;-1.92,1.46,;-.88,.35,;-1.37,-1.13,;-2.87,-1.44,;.62,.66,;1.81,-.38,;1.81,-1.9,;3.16,-2.65,;4.48,-1.9,;4.48,-.38,;5.8,.35,;5.8,1.89,;7.15,-.38,;8.52,.4,;9.87,-.38,;9.87,-1.93,;11.21,.4,;12.56,-.38,;3.13,.4,;2.8,1.9,;1.29,2.03,;.49,3.41,;-9.01,1.31,;-10.54,1.02,;-11.06,-.43,;-12.56,-.79,)|

BDBM670305

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-7.69,3.16,;-8.15,1.68,;-7.1,.53,;-5.59,.81,;-4.57,-.27,;-3.08,.04,;-2.08,-1.09,;-2.52,-2.6,;-.55,-.81,;-.04,.65,;1.45,.96,;2.5,-.14,;2.01,-1.62,;.5,-1.93,;3.98,.17,;5.13,-.86,;5.13,-2.38,;6.46,-3.16,;7.8,-2.38,;7.8,-.86,;9.12,-.08,;6.46,-.11,;6.13,1.42,;4.65,1.52,;3.85,2.91,;-5.05,-1.75,;-6.56,-2.06,;-7.61,-.93,;-9.12,-1.24,)|

BDBM670306

COCC(=O)Nc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc(C)c(OC)c3)c(=O)[nH]c12 |r,wU:12.11,15.18,(10.42,-3.97,;10.42,-2.42,;9.1,-1.63,;9.1,-.09,;10.53,.7,;7.77,.69,;6.43,-.08,;6.43,-1.58,;5.13,-2.33,;3.83,-1.58,;3.83,-.08,;2.63,.96,;1.13,.64,;.12,1.73,;-1.39,1.45,;-1.91,-.03,;-.84,-1.15,;.66,-.84,;-3.44,-.32,;-3.88,-1.82,;-4.45,.83,;-5.93,.49,;-6.45,-.97,;-7.93,-1.3,;-8.97,-.16,;-10.53,-.5,;-8.5,1.32,;-9.54,2.49,;-9.07,3.97,;-6.97,1.6,;3.31,2.33,;2.51,3.71,;4.82,2.2,;5.13,.67,)|

BDBM670307

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NCCNS(C)(=O)=O)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-13.47,1.02,;-11.98,1.45,;-10.88,.38,;-9.37,.73,;-8.32,-.32,;-6.86,.09,;-5.78,-.98,;-6.22,-2.49,;-4.24,-.7,;-3.76,.76,;-2.24,1.07,;-1.22,-.03,;-1.7,-1.52,;-3.22,-1.83,;.27,.27,;1.42,-.75,;1.42,-2.26,;2.73,-3.02,;4.04,-2.26,;4.04,-.75,;5.42,-.01,;5.42,1.53,;6.75,-.75,;8.09,-.01,;9.45,-.75,;10.75,.02,;12.09,-.75,;13.47,-1.57,;12.88,.58,;11.34,-2.11,;2.73,-.01,;2.42,1.53,;.94,1.63,;.14,3.02,;-8.73,-1.8,;-10.21,-2.19,;-11.32,-1.14,;-12.8,-1.55,)|

BDBM670308

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NCCN4CCNCC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-11.63,3.18,;-12.09,1.69,;-11.06,.54,;-9.55,.82,;-8.52,-.28,;-7.06,.05,;-6.06,-1.08,;-6.49,-2.59,;-4.52,-.8,;-4.03,.67,;-2.54,.98,;-1.51,-.13,;-2,-1.62,;-3.49,-1.93,;-.03,.18,;1.13,-.87,;1.13,-2.41,;2.46,-3.18,;3.77,-2.41,;3.77,-.87,;5.08,-.13,;5.08,1.41,;6.42,-.85,;7.75,-.1,;9.14,-.85,;10.42,-.08,;11.78,-.85,;13.06,-.1,;13.06,1.46,;11.76,2.23,;10.42,1.46,;2.44,-.1,;2.13,1.44,;.62,1.54,;-.15,2.93,;-9.04,-1.75,;-10.52,-2.05,;-11.58,-.92,;-13.06,-1.28,)|

BDBM670309

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NCCNC(C)=O)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-13.46,1.49,;-11.92,1.8,;-10.87,.67,;-9.38,.95,;-8.33,-.15,;-6.84,.15,;-5.84,-.95,;-6.28,-2.44,;-4.32,-.67,;-3.79,.77,;-2.27,1.08,;-1.27,,;-1.76,-1.46,;-3.25,-1.77,;.22,.28,;1.4,-.72,;1.4,-2.26,;2.76,-3,;4.07,-2.26,;4.07,-.72,;5.38,,;5.38,1.53,;6.74,-.72,;8.07,.03,;9.43,-.72,;10.74,.03,;12.1,-.67,;13.46,.05,;12.1,-2.26,;2.73,.05,;2.4,1.54,;.89,1.67,;.12,3,;-8.84,-1.62,;-10.33,-1.92,;-11.38,-.8,;-12.9,-1.15,)|

BDBM670310

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NCC4CCCN4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.84,3.17,;-11.31,1.68,;-10.28,.53,;-8.76,.81,;-7.74,-.3,;-6.28,.04,;-5.27,-1.09,;-5.68,-2.61,;-3.73,-.81,;-3.22,.65,;-1.76,.96,;-.71,-.14,;-1.19,-1.63,;-2.71,-1.94,;.78,.17,;1.94,-.89,;1.94,-2.43,;3.3,-3.17,;4.58,-2.43,;4.58,-.86,;5.89,-.14,;5.89,1.39,;7.22,-.86,;8.56,-.12,;9.92,-.86,;11.28,-.27,;12.28,-1.4,;11.56,-2.73,;10.05,-2.4,;3.22,-.12,;2.91,1.42,;1.42,1.53,;.65,2.91,;-8.25,-1.76,;-9.74,-2.07,;-10.79,-.94,;-12.28,-1.3,)|

BDBM670311

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(=O)CN)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.03,3.17,;-9.49,1.68,;-8.44,.53,;-6.92,.81,;-5.89,-.27,;-4.4,.04,;-3.4,-1.09,;-3.84,-2.58,;-1.88,-.81,;-1.35,.65,;.15,.96,;1.17,-.14,;.68,-1.63,;-.81,-1.92,;2.66,.17,;3.85,-.86,;3.85,-2.37,;5.16,-3.13,;6.47,-2.37,;6.47,-.86,;7.8,-.09,;9.13,-.86,;10.47,-.09,;9.13,-2.4,;10.47,-3.17,;5.16,-.12,;4.82,1.42,;3.33,1.53,;2.53,2.92,;-6.38,-1.76,;-7.9,-2.07,;-8.95,-.94,;-10.47,-1.25,)|

BDBM670312

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3ccc(CN)cc3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-7.76,4,;-8.22,2.5,;-7.16,1.33,;-5.66,1.62,;-4.62,.5,;-3.12,.82,;-2.11,-.3,;-2.55,-1.83,;-.58,-.01,;-.04,1.46,;1.46,1.75,;2.5,.66,;2.01,-.84,;.48,-1.15,;4,.97,;5.19,-.09,;5.19,-1.62,;6.51,-2.38,;7.83,-1.62,;9.21,-2.45,;9.21,-4,;7.83,-.09,;6.51,.69,;6.18,2.24,;4.67,2.34,;3.87,3.74,;-5.12,-1,;-6.64,-1.31,;-7.68,-.17,;-9.21,-.51,)|

BDBM670313

Cn1c(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Br)c3[nH]c2=O)nc2ccccc12 |r,wU:9.12,6.5,(-4.07,-3.16,;-4.91,-1.8,;-4.3,-.36,;-2.86,.03,;-1.81,-1.08,;-2.19,-2.59,;-.3,-.74,;.17,.74,;1.63,1.1,;2.71,.03,;2.27,-1.46,;.81,-1.85,;4.2,.41,;5.4,-.62,;5.48,-2.16,;6.87,-2.87,;8.1,-2.05,;8.07,-.51,;9.35,.31,;6.69,.21,;6.3,1.75,;4.81,1.8,;3.96,3.16,;-5.53,.64,;-6.81,-.21,;-8.3,.21,;-9.35,-.85,;-9.02,-2.34,;-7.56,-2.77,;-6.45,-1.69,)|

BDBM670314

COC(=O)c1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc(C)c(OC)c3)c(=O)[nH]c12 |r,wU:10.9,13.16,(10.46,-.14,;9.12,-.91,;7.79,-.13,;7.79,1.41,;6.45,-.9,;6.45,-2.42,;5.13,-3.17,;3.82,-2.42,;3.82,-.9,;2.66,.16,;1.16,-.15,;.13,.96,;-1.36,.65,;-1.88,-.85,;-.85,-1.95,;.67,-1.65,;-3.4,-1.1,;-3.84,-2.62,;-4.43,.03,;-5.9,-.31,;-6.39,-1.77,;-7.91,-2.08,;-8.97,-.95,;-10.46,-1.31,;-8.45,.52,;-9.48,1.68,;-9.02,3.17,;-6.93,.8,;3.3,1.52,;2.53,2.92,;4.82,1.42,;5.13,-.12,)|

BDBM670315

CNC(=O)c1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc(C)c(OC)c3)c(=O)[nH]c12 |r,wU:10.9,13.16,(10.49,-.09,;9.15,-.86,;7.82,-.09,;7.82,1.45,;6.48,-.86,;6.48,-2.38,;5.16,-3.15,;3.84,-2.38,;3.84,-.86,;2.68,.15,;1.18,-.14,;.17,.95,;-1.36,.64,;-1.87,-.81,;-.79,-1.92,;.69,-1.61,;-3.4,-1.1,;-3.84,-2.6,;-4.41,.02,;-5.91,-.29,;-6.4,-1.77,;-7.93,-2.08,;-8.99,-.94,;-10.49,-1.3,;-8.44,.53,;-9.5,1.67,;-9.04,3.15,;-6.97,.82,;3.33,1.54,;2.55,2.89,;4.85,1.41,;5.16,-.11,)|

BDBM670316

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)N(C)C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.05,3.14,;-9.52,1.67,;-8.46,.5,;-6.95,.78,;-5.92,-.3,;-4.41,.01,;-3.4,-1.11,;-3.85,-2.61,;-1.88,-.82,;-1.36,.63,;.14,.94,;1.18,-.17,;.69,-1.65,;-.79,-1.96,;2.68,.14,;3.87,-.9,;3.87,-2.4,;5.17,-3.14,;6.46,-2.4,;6.46,-.9,;7.8,-.13,;7.8,1.42,;9.14,-.9,;10.47,-.13,;9.14,-2.44,;5.17,-.15,;4.86,1.38,;3.35,1.51,;2.55,2.88,;-6.41,-1.78,;-7.94,-2.09,;-8.97,-.95,;-10.47,-1.31,)|

BDBM670317

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)N4CCNCC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.67,3.17,;-10.14,1.7,;-9.08,.54,;-7.56,.82,;-6.55,-.26,;-5.05,.1,;-4.05,-1.09,;-4.49,-2.59,;-2.53,-.81,;-2.01,.66,;-.49,.95,;.52,-.13,;.03,-1.61,;-1.47,-1.91,;2.01,.17,;3.2,-.86,;3.2,-2.35,;4.49,-3.09,;5.78,-2.35,;5.78,-.86,;7.12,-.09,;7.12,1.45,;8.45,-.86,;8.45,-2.4,;9.78,-3.17,;11.12,-2.4,;11.12,-.86,;9.78,-.09,;4.49,-.11,;4.18,1.41,;2.69,1.54,;1.89,2.91,;-7.04,-1.76,;-8.54,-2.07,;-9.62,-.93,;-11.12,-1.3,)|

BDBM670318

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)N4CCOCC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.67,3.17,;-10.14,1.7,;-9.08,.54,;-7.56,.82,;-6.55,-.26,;-5.05,.1,;-4.05,-1.09,;-4.49,-2.59,;-2.53,-.81,;-2.01,.66,;-.49,.95,;.52,-.13,;.03,-1.61,;-1.47,-1.91,;2.01,.17,;3.2,-.86,;3.2,-2.35,;4.49,-3.09,;5.78,-2.35,;5.78,-.86,;7.12,-.09,;7.12,1.45,;8.45,-.86,;8.45,-2.4,;9.78,-3.17,;11.12,-2.4,;11.12,-.86,;9.78,-.09,;4.49,-.11,;4.18,1.41,;2.69,1.54,;1.89,2.91,;-7.04,-1.76,;-8.54,-2.07,;-9.62,-.93,;-11.12,-1.3,)|

BDBM670319

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NCCO)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.34,3.13,;-10.81,1.66,;-9.75,.5,;-8.23,.78,;-7.22,-.3,;-5.72,.06,;-4.72,-1.13,;-5.16,-2.62,;-3.19,-.84,;-2.68,.63,;-1.16,.91,;-.15,-.17,;-.64,-1.64,;-2.14,-1.95,;1.35,.14,;2.54,-.9,;2.54,-2.39,;3.83,-3.13,;5.12,-2.39,;5.12,-.9,;6.45,-.12,;6.45,1.42,;7.79,-.9,;9.12,-.12,;10.45,-.9,;11.79,-.12,;3.83,-.15,;3.52,1.38,;2.02,1.5,;1.22,2.87,;-7.71,-1.8,;-9.21,-2.11,;-10.29,-.97,;-11.79,-1.33,)|

BDBM670320

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NC(=O)CCN)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-11.94,-3.39,;-10.41,-3.03,;-9.95,-1.54,;-8.43,-1.25,;-7.94,.22,;-6.44,.53,;-5.43,-.58,;-5.87,-2.08,;-3.91,-.3,;-3.39,1.17,;-1.87,1.46,;-.86,.37,;-1.36,-1.1,;-2.85,-1.41,;.63,.68,;1.82,-.35,;1.82,-1.9,;3.19,-2.65,;4.48,-1.9,;4.48,-.35,;5.79,.37,;5.79,1.91,;7.14,-.35,;8.48,.4,;8.48,1.94,;9.85,-.35,;11.16,.37,;12.51,-.35,;3.14,.43,;2.8,1.92,;1.3,2.03,;.5,3.39,;-9,1.33,;-10.47,1.05,;-11.01,-.43,;-12.51,-.79,)|

BDBM670321

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NCCCN)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-11.94,-3.39,;-10.42,-3.03,;-9.95,-1.54,;-8.43,-1.25,;-7.94,.22,;-6.44,.53,;-5.43,-.58,;-5.87,-2.08,;-3.91,-.3,;-3.39,1.17,;-1.87,1.46,;-.86,.37,;-1.36,-1.1,;-2.85,-1.41,;.63,.68,;1.82,-.35,;1.82,-1.9,;3.19,-2.65,;4.48,-1.9,;4.48,-.35,;5.8,.37,;5.8,1.91,;7.14,-.35,;8.48,.4,;9.85,-.35,;11.16,.4,;12.51,-.35,;3.14,.43,;2.8,1.92,;1.3,2.03,;.5,3.39,;-9,1.33,;-10.47,1.05,;-11.01,-.43,;-12.51,-.79,)|

BDBM670322

CNCCN(C)C(=O)c1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc(C)c(OC)c3)c(=O)[nH]c12 |r,wU:14.13,17.20,(12.57,-.4,;11.2,.4,;9.87,-.35,;8.5,.4,;7.15,-.35,;7.15,-1.9,;5.81,.38,;5.81,1.92,;4.43,-.35,;4.43,-1.87,;3.11,-2.64,;1.79,-1.87,;1.79,-.35,;.62,.69,;-.88,.38,;-1.92,1.46,;-3.42,1.18,;-3.97,-.3,;-2.9,-1.41,;-1.37,-1.1,;-5.49,-.56,;-5.94,-2.09,;-6.51,.53,;-7.98,.22,;-9.05,1.33,;-10.55,1.02,;-11.07,-.43,;-12.57,-.79,;-10,-1.54,;-10.5,-3.05,;-12.03,-3.41,;-8.5,-1.26,;1.27,2.06,;.49,3.41,;2.8,1.93,;3.11,.4,)|

BDBM670323

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)N4CCC(C4)N(C)C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.86,3.14,;-11.33,1.64,;-10.27,.5,;-8.77,.78,;-7.73,-.3,;-6.23,.06,;-5.22,-1.13,;-5.66,-2.63,;-3.7,-.85,;-3.18,.63,;-1.66,.91,;-.65,-.17,;-1.14,-1.65,;-2.64,-1.96,;.85,.14,;2.04,-.9,;2.04,-2.39,;3.34,-3.14,;4.63,-2.39,;4.63,-.9,;6.03,-.17,;6.03,1.37,;7.37,-.9,;7.55,-2.45,;9.08,-2.76,;9.78,-1.41,;8.82,-.28,;11.38,-1.26,;12.31,-2.55,;12.03,.11,;3.34,-.15,;3.03,1.38,;1.53,1.51,;.72,2.88,;-8.22,-1.8,;-9.75,-2.11,;-10.81,-.97,;-12.31,-1.34,)|

BDBM670324

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)N4CCN(C)CC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.41,3.21,;-10.88,1.73,;-9.81,.55,;-8.27,.84,;-7.25,-.26,;-5.74,.11,;-4.72,-1.07,;-5.17,-2.6,;-3.18,-.8,;-2.66,.68,;-1.15,.97,;-.08,-.13,;-.57,-1.61,;-2.11,-1.93,;1.43,.19,;2.61,-.86,;2.6,-2.39,;3.92,-3.16,;5.25,-2.4,;5.26,-.87,;6.59,-.12,;6.6,1.41,;7.91,-.89,;7.9,-2.42,;9.22,-3.2,;10.55,-2.44,;11.87,-3.21,;10.56,-.91,;9.24,-.13,;3.94,-.1,;3.63,1.44,;2.09,1.57,;1.3,2.95,;-7.75,-1.77,;-9.26,-2.08,;-10.33,-.93,;-11.87,-1.3,)|

BDBM670325

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)N4CCN(CC4)C(C)C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-11.1,3.96,;-11.56,2.48,;-10.5,1.32,;-9.03,1.6,;-7.97,.52,;-6.47,.91,;-5.46,-.28,;-5.9,-1.78,;-3.93,,;-3.41,1.45,;-1.91,1.76,;-.88,.65,;-1.37,-.83,;-2.87,-1.14,;.62,.96,;1.81,-.08,;1.81,-1.6,;3.16,-2.35,;4.47,-1.6,;4.47,-.08,;5.79,.67,;5.79,2.22,;7.14,-.08,;7.16,-1.63,;8.51,-2.38,;9.83,-1.6,;9.83,-.08,;8.51,.7,;11.2,-2.38,;12.54,-1.63,;11.2,-3.96,;3.13,.7,;2.79,2.22,;1.29,2.33,;.49,3.7,;-8.46,-.96,;-9.98,-1.27,;-11.04,-.13,;-12.54,-.49,)|

BDBM670326

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NCc4ncc[nH]4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.86,3.16,;-11.32,1.67,;-10.27,.52,;-8.76,.8,;-7.73,-.3,;-6.27,.03,;-5.26,-1.1,;-5.7,-2.62,;-3.72,-.82,;-3.21,.65,;-1.69,.93,;-.69,-.15,;-1.18,-1.64,;-2.67,-1.95,;.8,.16,;1.95,-.89,;1.96,-2.41,;3.29,-3.16,;4.6,-2.39,;4.58,-.87,;5.89,-.1,;5.89,1.44,;7.22,-.85,;8.5,-.11,;9.91,-.88,;11.27,-.24,;12.3,-1.37,;11.56,-2.73,;10.04,-2.39,;3.26,-.12,;2.95,1.42,;1.46,1.52,;.67,2.91,;-8.24,-1.77,;-9.73,-2.08,;-10.79,-.95,;-12.3,-1.25,)|

BDBM670327

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)N4CCC[C@H]4CN4CCCC4)c3[nH]c2=O)ccc1C |r,wU:11.14,26.28,8.7,(-10.84,2.22,;-11.31,.71,;-10.25,-.43,;-8.74,-.14,;-7.7,-1.23,;-6.22,-.92,;-5.18,-2.04,;-5.62,-3.55,;-3.65,-1.75,;-3.13,-.3,;-1.65,.01,;-.58,-1.08,;-1.08,-2.56,;-2.61,-2.87,;.92,-.79,;2.09,-1.81,;2.09,-3.34,;3.44,-4.12,;4.77,-3.36,;4.77,-1.81,;6.06,-1.03,;7.47,-1.83,;6.06,.51,;4.82,1.42,;5.29,2.88,;6.83,2.88,;7.34,1.42,;8.87,.95,;9.99,1.96,;11.52,1.65,;12.27,3,;11.26,4.12,;9.88,3.49,;3.39,-1.05,;3.08,.45,;1.57,.58,;.79,1.96,;-8.19,-2.69,;-9.73,-3,;-10.77,-1.88,;-12.27,-2.22,)|

BDBM670328

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NCCN4CCOCC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-11.78,3.15,;-12.24,1.66,;-11.19,.51,;-9.67,.79,;-8.64,-.29,;-7.15,.02,;-6.15,-1.11,;-6.58,-2.63,;-4.6,-.83,;-4.09,.63,;-2.6,.94,;-1.54,-.16,;-2.03,-1.65,;-3.55,-1.96,;-.05,.15,;1.13,-.88,;1.13,-2.4,;2.44,-3.15,;3.75,-2.4,;3.75,-.88,;5.09,-.11,;5.09,1.43,;6.42,-.88,;7.75,-.11,;9.09,-.88,;10.42,-.11,;11.75,-.88,;13.09,-.11,;13.09,1.43,;11.75,2.2,;10.42,1.43,;2.44,-.11,;2.11,1.41,;.62,1.51,;-.18,2.9,;-9.13,-1.78,;-10.65,-2.09,;-11.7,-.96,;-13.09,-1.27,)|

BDBM670329

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NCC4CCCO4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.87,3.18,;-11.33,1.69,;-10.28,.54,;-8.77,.82,;-7.75,-.28,;-6.29,.05,;-5.29,-1.08,;-5.72,-2.59,;-3.75,-.79,;-3.24,.67,;-1.75,.97,;-.73,-.13,;-1.22,-1.61,;-2.7,-1.92,;.76,.18,;1.91,-.87,;1.91,-2.42,;3.24,-3.18,;4.57,-2.42,;4.57,-.84,;5.88,-.13,;5.88,1.41,;7.23,-.84,;8.52,-.1,;9.92,-.87,;11.33,-.26,;12.31,-1.36,;11.56,-2.71,;10.05,-2.41,;3.24,-.08,;2.91,1.44,;1.42,1.54,;.63,2.92,;-8.26,-1.74,;-9.74,-2.05,;-10.79,-.92,;-12.31,-1.23,)|

BDBM670330

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)N4CCNC(C4)C(F)(F)F)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-11.05,3.17,;-11.52,1.7,;-10.46,.54,;-8.94,.82,;-7.93,-.26,;-6.44,.1,;-5.43,-1.09,;-5.87,-2.59,;-3.91,-.81,;-3.39,.66,;-1.87,.95,;-.86,-.13,;-1.35,-1.61,;-2.85,-1.92,;.63,.17,;1.82,-.86,;1.82,-2.41,;3.19,-3.15,;4.48,-2.41,;4.48,-.86,;5.82,-.11,;5.82,1.44,;7.13,-.86,;7.15,-2.4,;8.48,-3.17,;9.82,-2.4,;9.82,-.86,;8.48,-.09,;11.21,-.08,;12.5,.69,;12.5,-.86,;11.21,1.46,;3.13,-.11,;2.8,1.41,;1.3,1.54,;.53,2.91,;-8.42,-1.76,;-9.92,-2.07,;-11,-.93,;-12.5,-1.3,)|

BDBM670331

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)N4CCN(CCN(C)C)CC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-12.43,3.94,;-12.89,2.47,;-11.83,1.31,;-10.34,1.59,;-9.31,.51,;-7.81,.9,;-6.8,-.29,;-7.24,-1.79,;-5.25,-.01,;-4.76,1.44,;-3.27,1.75,;-2.23,.64,;-2.7,-.83,;-4.22,-1.14,;-.74,.95,;.45,-.08,;.45,-1.6,;1.77,-2.36,;3.08,-1.6,;3.08,-.08,;4.45,.66,;4.45,2.21,;5.79,-.08,;5.81,-1.63,;7.14,-2.4,;8.48,-1.63,;9.85,-2.4,;11.16,-1.65,;12.51,-2.4,;13.87,-1.65,;12.51,-3.94,;8.48,-.08,;7.14,.69,;1.77,.66,;1.43,2.21,;-.07,2.32,;-.84,3.68,;-9.8,-.96,;-11.32,-1.27,;-12.38,-.14,;-13.87,-.5,)|

BDBM670332

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NCc4ncccn4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.97,3.19,;-11.43,1.7,;-10.38,.54,;-8.89,.82,;-7.86,-.26,;-6.37,.05,;-5.37,-1.08,;-5.8,-2.59,;-3.85,-.79,;-3.34,.67,;-1.85,.98,;-.82,-.13,;-1.31,-1.62,;-2.8,-1.93,;.67,.18,;1.83,-.87,;1.83,-2.39,;3.14,-3.14,;4.45,-2.39,;4.45,-.87,;5.78,-.11,;5.78,1.43,;7.12,-.85,;8.4,-.11,;9.74,-.88,;9.74,-2.42,;11.07,-3.19,;12.41,-2.42,;12.41,-.88,;11.07,-.11,;3.14,-.1,;2.83,1.44,;1.31,1.54,;.54,2.93,;-8.35,-1.75,;-9.86,-2.05,;-10.89,-.92,;-12.41,-1.23,)|

BDBM670333

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)N(C)C4CCN(C)C4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-11.17,3.18,;-11.63,1.69,;-10.57,.52,;-9.03,.81,;-7.99,-.28,;-6.51,.03,;-5.5,-1.09,;-5.94,-2.6,;-3.94,-.8,;-3.42,.65,;-1.91,.97,;-.87,-.13,;-1.36,-1.63,;-2.9,-1.95,;.64,.16,;1.83,-.88,;1.83,-2.42,;3.16,-3.18,;4.48,-2.42,;4.48,-.88,;5.84,-.15,;5.84,1.4,;7.19,-.88,;7.19,-2.43,;8.57,-.1,;8.75,1.43,;10.26,1.75,;11.01,.42,;12.6,.26,;10,-.72,;3.16,-.1,;2.82,1.41,;1.31,1.54,;.51,2.92,;-8.51,-1.76,;-10.02,-2.08,;-11.06,-.96,;-12.6,-1.3,)|

BDBM670334

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)N4CCCC4C(N)=O)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.73,2.63,;-10.17,1.12,;-9.11,.02,;-7.58,.31,;-6.53,-.76,;-5.05,-.42,;-4.02,-1.49,;-4.44,-3.03,;-2.47,-1.21,;-2.01,.25,;-.48,.57,;.55,-.5,;.08,-1.96,;-1.41,-2.3,;2.05,-.17,;3.23,-1.18,;3.23,-2.74,;4.57,-3.49,;5.9,-2.74,;5.9,-1.18,;7.24,-.41,;8.62,-1.16,;7.23,1.14,;6,2.03,;6.44,3.49,;7.97,3.49,;8.46,2.07,;9.95,1.58,;10.31,.11,;11.1,2.67,;4.57,-.38,;4.2,1.12,;2.7,1.22,;1.87,2.58,;-7.02,-2.25,;-8.52,-2.59,;-9.6,-1.46,;-11.1,-1.85,)|

BDBM670335

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(Nc4ncccn4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.67,3.18,;-10.13,1.69,;-9.08,.54,;-7.57,.82,;-6.57,-.26,;-5.08,.05,;-4.08,-1.08,;-4.51,-2.59,;-2.56,-.79,;-2.05,.67,;-.54,.95,;.46,-.13,;-.02,-1.62,;-1.51,-1.92,;1.95,.18,;3.11,-.87,;3.11,-2.42,;4.44,-3.18,;5.77,-2.42,;5.77,-.85,;7.11,-.08,;8.44,-.85,;8.44,-2.38,;9.77,-3.15,;11.11,-2.38,;11.11,-.85,;9.77,-.08,;4.44,-.08,;4.11,1.44,;2.62,1.54,;1.82,2.93,;-7.05,-1.74,;-8.54,-2.05,;-9.59,-.92,;-11.11,-1.23,)|

BDBM670336

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NCCN(C)C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.4,3.15,;-10.89,1.71,;-9.83,.55,;-8.31,.83,;-7.28,-.28,;-5.81,.06,;-4.78,-1.08,;-5.22,-2.6,;-3.26,-.8,;-2.75,.67,;-1.22,.96,;-.19,-.12,;-.71,-1.62,;-2.2,-1.93,;1.28,.18,;2.46,-.87,;2.46,-2.4,;3.78,-3.15,;5.09,-2.4,;5.09,-.87,;6.46,-.07,;7.85,-.87,;9.14,-.1,;10.48,-.87,;11.87,-.07,;10.48,-2.42,;3.78,-.1,;3.47,1.45,;1.95,1.55,;1.17,2.94,;-7.8,-1.75,;-9.27,-2.08,;-10.35,-.95,;-11.87,-1.28,)|

BDBM670337

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N4CCC(C4)NC(=O)OC(C)(C)C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-12.11,2.73,;-12.57,1.24,;-11.52,.12,;-10.01,.4,;-9.01,-.71,;-7.52,-.32,;-6.52,-1.5,;-6.95,-2.99,;-5,-1.22,;-4.49,.24,;-2.98,.53,;-1.95,-.55,;-2.44,-2.01,;-3.95,-2.32,;-.49,-.24,;.69,-1.27,;.69,-2.81,;2.05,-3.55,;3.34,-2.81,;3.34,-1.27,;4.67,-.5,;4.85,1.01,;6.36,1.3,;7.11,.04,;6.08,-1.12,;8.62,-.17,;9.55,1.06,;8.9,2.48,;11.06,.91,;11.98,2.19,;11.32,3.55,;12.85,3.4,;13.52,2.01,;2,-.53,;1.67,.99,;.18,1.12,;-.59,2.48,;-9.49,-2.17,;-10.96,-2.48,;-12.03,-1.35,;-13.52,-1.71,)|

BDBM670338

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N4CCC(N)C4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.66,3.14,;-10.13,1.66,;-9.07,.53,;-7.56,.81,;-6.56,-.27,;-5.07,.09,;-4.07,-1.09,;-4.5,-2.58,;-2.55,-.78,;-2.04,.65,;-.53,.94,;.47,-.14,;-.01,-1.6,;-1.5,-1.91,;1.96,.17,;3.14,-.86,;3.14,-2.4,;4.5,-3.14,;5.79,-2.4,;5.79,-.86,;7.12,-.09,;7.3,1.42,;8.79,1.73,;9.56,.45,;11.08,.27,;8.53,-.71,;4.43,-.12,;4.12,1.4,;2.63,1.53,;1.84,2.89,;-7.05,-1.73,;-8.53,-2.04,;-9.56,-.96,;-11.08,-1.27,)|

BDBM670339

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(=O)CN(C)C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.76,3.95,;-10.23,2.45,;-9.17,1.31,;-7.64,1.6,;-6.6,.51,;-5.13,.82,;-4.12,-.29,;-4.56,-1.82,;-2.59,-.01,;-2.07,1.44,;-.54,1.73,;.49,.64,;0,-.84,;-1.53,-1.15,;1.99,.95,;3.16,-.09,;3.16,-1.61,;4.48,-2.37,;5.8,-1.61,;5.8,-.09,;7.14,.69,;8.48,-.09,;9.82,.69,;8.48,-1.63,;9.82,-2.41,;11.16,-1.63,;9.82,-3.95,;4.48,.66,;4.17,2.19,;2.64,2.32,;1.87,3.69,;-7.12,-.99,;-8.6,-1.28,;-9.66,-.19,;-11.16,-.5,)|

BDBM670340

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(=O)CCN)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.36,3.14,;-10.82,1.68,;-9.77,.53,;-8.25,.81,;-7.22,-.3,;-5.76,.09,;-4.76,-1.06,;-5.2,-2.58,;-3.22,-.81,;-2.71,.65,;-1.19,.94,;-.19,-.14,;-.68,-1.6,;-2.17,-1.91,;1.3,.17,;2.48,-.86,;2.48,-2.4,;3.81,-3.14,;5.12,-2.4,;5.12,-.86,;6.43,-.04,;7.79,-.81,;7.79,-2.4,;9.1,-.12,;10.43,-.86,;11.77,-.09,;3.79,-.09,;3.45,1.4,;1.96,1.53,;1.17,2.89,;-7.74,-1.76,;-9.2,-2.07,;-10.28,-.94,;-11.77,-1.3,)|

BDBM670341

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(=O)CN4CCOCC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-11.16,3.18,;-11.63,1.7,;-10.57,.54,;-9.07,.82,;-8.03,-.26,;-6.53,.1,;-5.52,-1.09,;-5.96,-2.59,;-3.99,-.78,;-3.47,.67,;-1.97,.98,;-.93,-.13,;-1.4,-1.61,;-2.93,-1.92,;.57,.18,;1.76,-.86,;1.76,-2.38,;3.08,-3.15,;4.4,-2.38,;4.4,-.86,;5.77,-.01,;7.15,-.81,;7.15,-2.36,;8.44,-.11,;9.79,-.86,;9.8,-2.41,;11.14,-3.18,;12.48,-2.41,;12.48,-.86,;11.14,-.09,;3.08,-.11,;2.74,1.45,;1.24,1.57,;.46,2.95,;-8.52,-1.74,;-10.02,-2.08,;-11.09,-.94,;-12.48,-1.27,)|

BDBM670342

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(=O)C4C[C@@H](O)CN4)c3[nH]c2=O)ccc1C |r,wU:11.14,25.26,8.7,(-10.22,3.16,;-10.68,1.69,;-9.63,.54,;-8.14,.82,;-7.12,-.26,;-5.63,.1,;-4.63,-1.08,;-5.06,-2.56,;-3.11,-.79,;-2.6,.67,;-1.09,.95,;-.09,-.13,;-.57,-1.59,;-2.06,-1.9,;1.4,.18,;2.56,-.85,;2.56,-2.39,;3.89,-3.16,;5.22,-2.39,;5.22,-.85,;6.55,-.08,;7.91,-.9,;7.91,-2.46,;9.27,-.13,;9.4,1.36,;10.89,1.67,;11.53,3.08,;11.66,.36,;10.63,-.8,;3.89,-.08,;3.56,1.41,;2.07,1.54,;1.27,2.9,;-7.6,-1.74,;-9.09,-2.05,;-10.17,-.92,;-11.66,-1.26,)|

BDBM670343

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(=O)C4CCN4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.02,3.16,;-10.48,1.66,;-9.42,.52,;-7.92,.81,;-6.88,-.28,;-5.38,.08,;-4.37,-1.11,;-4.81,-2.61,;-2.84,-.82,;-2.33,.65,;-.8,.94,;.24,-.15,;-.25,-1.63,;-1.78,-1.94,;1.71,.16,;2.9,-.88,;2.9,-2.4,;4.23,-3.16,;5.55,-2.4,;5.55,-.88,;6.88,-.1,;8.23,-.9,;8.23,-2.45,;9.63,-.12,;9.99,1.33,;11.47,.91,;11.05,-.56,;4.23,-.13,;3.89,1.4,;2.39,1.53,;1.61,2.9,;-7.38,-1.78,;-8.9,-2.09,;-9.94,-.95,;-11.47,-1.32,)|

BDBM670344

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(C)=O)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.1,3.18,;-9.57,1.69,;-8.5,.52,;-6.99,.81,;-5.95,-.28,;-4.47,.03,;-3.46,-1.09,;-3.9,-2.6,;-1.92,-.8,;-1.4,.65,;.1,.97,;1.14,-.13,;.65,-1.63,;-.86,-1.95,;2.65,.16,;3.82,-.88,;3.82,-2.42,;5.15,-3.18,;6.47,-2.42,;6.47,-.88,;7.83,-.1,;9.15,-.88,;9.15,-2.43,;10.53,-.1,;5.15,-.1,;4.81,1.43,;3.3,1.54,;2.52,2.92,;-6.47,-1.76,;-7.98,-2.08,;-9.05,-.93,;-10.53,-1.3,)|

BDBM670345

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(=O)C4CNCCO4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.36,3.15,;-10.83,1.69,;-9.77,.53,;-8.28,.81,;-7.25,-.27,;-5.75,.09,;-4.75,-1.09,;-5.19,-2.59,;-3.23,-.79,;-2.72,.66,;-1.22,.97,;-.19,-.14,;-.66,-1.61,;-2.18,-1.92,;1.3,.17,;2.48,-.86,;2.48,-2.41,;3.85,-3.15,;5.14,-2.41,;5.14,-.86,;6.48,-.01,;7.84,-.81,;7.84,-2.35,;9.15,-.09,;10.49,-.86,;11.81,-.09,;11.81,1.45,;10.47,2.2,;9.15,1.45,;3.8,-.12,;3.46,1.43,;1.97,1.53,;1.2,2.92,;-7.74,-1.74,;-9.23,-2.07,;-10.29,-.94,;-11.81,-1.27,)|

BDBM670346

CC(=O)Nc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc4cc[nH]c4c3)c(=O)[nH]c12 |r,wU:10.9,13.16,(9.3,-2.27,;9.3,-.74,;10.69,.05,;7.99,.05,;6.68,-.72,;6.68,-2.26,;5.35,-3.03,;4.02,-2.26,;4.02,-.72,;2.86,.31,;1.37,0,;.35,1.1,;-1.14,.8,;-1.65,-.64,;-.6,-1.77,;.89,-1.46,;-3.17,-.92,;-3.6,-2.41,;-4.17,.18,;-5.66,-.13,;-6.15,-1.59,;-7.66,-1.9,;-8.69,-.79,;-10.22,-.79,;-10.69,.66,;-9.45,1.56,;-8.17,.67,;-6.68,.95,;3.53,1.67,;2.73,3.03,;5.02,1.54,;5.35,.05,)|

BDBM670347

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(N)=O)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-8.41,3.17,;-8.88,1.66,;-7.81,.49,;-6.3,.77,;-5.26,-.32,;-3.75,-.01,;-2.74,-1.15,;-3.18,-2.68,;-1.21,-.86,;-.69,.62,;.82,.93,;1.86,-.19,;1.37,-1.7,;-.14,-2.01,;3.37,.12,;4.56,-.92,;4.56,-2.42,;5.86,-3.17,;7.16,-2.42,;7.16,-.92,;8.51,-.14,;9.86,-.89,;8.51,1.42,;5.86,-.16,;5.55,1.4,;4.04,1.5,;3.24,2.91,;-5.76,-1.83,;-7.26,-2.14,;-8.33,-.99,;-9.86,-1.31,)|

BDBM670348

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NCC4COCCN4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-11.01,3.17,;-11.47,1.68,;-10.42,.53,;-8.9,.81,;-7.9,-.27,;-6.41,.04,;-5.41,-1.09,;-5.85,-2.6,;-3.87,-.81,;-3.38,.65,;-1.87,.94,;-.87,-.14,;-1.36,-1.63,;-2.85,-1.94,;.62,.17,;1.8,-.89,;1.8,-2.42,;3.16,-3.17,;4.44,-2.42,;4.44,-.86,;5.75,-.14,;5.75,1.4,;7.09,-.86,;8.42,-.12,;9.78,-.86,;11.11,-.09,;12.44,-.86,;12.44,-2.4,;11.11,-3.17,;9.78,-2.4,;3.08,-.12,;2.77,1.42,;1.29,1.53,;.49,2.91,;-8.39,-1.76,;-9.88,-2.07,;-10.93,-.94,;-12.44,-1.24,)|

BDBM670349

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NC4CNC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.08,3.18,;-10.54,1.69,;-9.48,.52,;-7.97,.81,;-6.93,-.28,;-5.42,.03,;-4.41,-1.09,;-4.85,-2.6,;-2.85,-.8,;-2.35,.65,;-.85,.97,;.2,-.15,;-.27,-1.63,;-1.78,-1.95,;1.7,.16,;2.9,-.88,;2.9,-2.41,;4.23,-3.18,;5.55,-2.41,;5.55,-.88,;6.93,-.13,;6.93,1.42,;8.28,-.88,;9.63,-.1,;10.05,1.38,;11.53,.99,;11.14,-.49,;4.23,-.13,;3.89,1.41,;2.38,1.54,;1.6,2.92,;-7.42,-1.76,;-8.96,-2.08,;-10.02,-.93,;-11.53,-1.3,)|

BDBM670350

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C(=O)NC4CCNC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.39,3.16,;-10.85,1.69,;-9.79,.53,;-8.27,.81,;-7.24,-.27,;-5.74,.04,;-4.73,-1.04,;-5.17,-2.57,;-3.19,-.81,;-2.67,.66,;-1.17,.97,;-.14,-.14,;-.63,-1.61,;-2.1,-1.92,;1.35,.17,;2.54,-.86,;2.54,-2.39,;3.88,-3.16,;5.23,-2.39,;5.23,-.86,;6.54,-.14,;6.54,1.4,;7.91,-.86,;9.25,-.09,;9.43,1.43,;10.93,1.74,;11.7,.43,;10.7,-.68,;3.86,-.12,;3.55,1.43,;2.03,1.54,;1.25,2.9,;-7.73,-1.74,;-9.25,-2.05,;-10.31,-.92,;-11.7,-1.23,)|

BDBM670351

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N4CCC(C4)N(C)C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.13,3.14,;-10.59,1.68,;-9.53,.53,;-8.05,.81,;-7.02,-.27,;-5.53,.09,;-4.53,-1.09,;-4.97,-2.58,;-3.02,-.81,;-2.5,.65,;-.99,.94,;.01,-.14,;-.47,-1.6,;-1.96,-1.91,;1.5,.17,;2.68,-.86,;2.68,-2.4,;4.04,-3.14,;5.33,-2.4,;5.33,-.86,;6.66,-.09,;6.84,1.42,;8.35,1.71,;9.02,.45,;8.07,-.71,;10.61,.27,;11.56,1.48,;11.28,-1.17,;3.97,-.12,;3.66,1.4,;2.17,1.53,;1.37,2.89,;-7.51,-1.76,;-9,-2.07,;-10.07,-.94,;-11.56,-1.27,)|

BDBM670352

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N(C)C4CCN(C)C4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.34,3.16,;-10.81,1.69,;-9.75,.54,;-8.24,.82,;-7.21,-.28,;-5.75,.1,;-4.75,-1.05,;-5.18,-2.57,;-3.23,-.8,;-2.72,.67,;-1.21,.95,;-.21,-.13,;-.67,-1.59,;-2.18,-1.9,;1.28,.18,;2.46,-.85,;2.46,-2.39,;3.8,-3.16,;5.11,-2.39,;5.11,-.85,;6.44,-.08,;6.44,1.46,;7.8,-.85,;7.93,-2.39,;9.45,-2.7,;10.19,-1.36,;11.76,-1.21,;9.19,-.23,;3.75,-.1,;3.44,1.41,;1.95,1.54,;1.18,2.9,;-7.73,-1.75,;-9.19,-2.05,;-10.27,-.92,;-11.76,-1.28,)|

BDBM670353

CNCCN(C)c1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc(C)c(OC)c3)c(=O)[nH]c12 |r,wU:12.11,15.18,(11.92,-.14,;10.52,-.89,;9.17,-.14,;7.84,-.89,;6.47,-.11,;6.47,1.44,;5.15,-.89,;5.15,-2.41,;3.82,-3.18,;2.5,-2.41,;2.5,-.89,;1.31,.15,;-.19,-.16,;-1.21,.95,;-2.74,.64,;-3.25,-.84,;-2.19,-1.98,;-.69,-1.67,;-4.81,-1.12,;-5.23,-2.65,;-5.82,.02,;-7.3,-.32,;-7.82,-1.8,;-9.32,-2.11,;-10.39,-.97,;-11.92,-1.33,;-9.87,.51,;-10.93,1.68,;-10.46,3.18,;-8.34,.8,;1.98,1.52,;1.18,2.92,;3.51,1.42,;3.82,-.14,)|

BDBM670354

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N(C)CCN)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.75,3.16,;-10.22,1.68,;-9.15,.54,;-7.68,.83,;-6.62,-.28,;-5.11,.03,;-4.1,-1.09,;-4.54,-2.59,;-2.58,-.8,;-2.06,.65,;-.56,.96,;.48,-.13,;-.01,-1.63,;-1.51,-1.94,;1.98,.16,;3.15,-.88,;3.15,-2.41,;4.52,-3.16,;5.81,-2.41,;5.81,-.85,;7.13,-.1,;7.13,1.44,;8.53,-.85,;9.85,-.1,;11.17,-.88,;4.44,-.13,;4.13,1.42,;2.63,1.55,;1.85,2.9,;-7.11,-1.76,;-8.64,-2.07,;-9.67,-.93,;-11.17,-1.29,)|

BDBM670355

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(=O)c4cc[nH]n4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.31,3.14,;-10.77,1.64,;-9.71,.5,;-8.21,.78,;-7.17,-.3,;-5.67,.06,;-4.66,-1.13,;-5.1,-2.63,;-3.13,-.85,;-2.62,.63,;-1.09,.91,;-.08,-.17,;-.57,-1.65,;-2.05,-1.99,;1.42,.14,;2.62,-.9,;2.62,-2.4,;3.91,-3.14,;5.21,-2.4,;5.21,-.9,;6.63,-.07,;7.98,-.85,;7.98,-2.45,;9.32,-.12,;9.48,1.41,;11.03,1.69,;11.76,.4,;10.72,-.77,;3.91,-.15,;3.6,1.38,;2.1,1.51,;1.29,2.88,;-7.67,-1.81,;-9.19,-2.12,;-10.23,-.98,;-11.76,-1.29,)|

BDBM670356

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(=O)c4cc(C)on4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.22,3.14,;-10.69,1.65,;-9.63,.53,;-8.15,.81,;-7.12,-.27,;-5.63,.09,;-4.63,-1.09,;-5.07,-2.58,;-3.12,-.81,;-2.6,.65,;-1.09,.94,;-.09,-.14,;-.58,-1.6,;-2.04,-1.94,;1.4,.17,;2.58,-.86,;2.58,-2.4,;3.91,-3.17,;5.22,-2.4,;5.22,-.86,;6.56,-.04,;7.89,-.81,;7.89,-2.4,;9.22,-.09,;9.38,1.42,;10.89,1.71,;11.51,3.17,;11.66,.42,;10.61,-.73,;3.86,-.12,;3.55,1.4,;2.07,1.53,;1.27,2.89,;-7.61,-1.76,;-9.12,-2.07,;-10.15,-.94,;-11.66,-1.24,)|

BDBM670357

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(=O)c4cnco4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.3,3.16,;-10.77,1.66,;-9.71,.52,;-8.21,.81,;-7.17,-.28,;-5.67,.08,;-4.66,-1.11,;-5.1,-2.61,;-3.13,-.82,;-2.61,.65,;-1.09,.94,;-.08,-.15,;-.54,-1.63,;-2.07,-1.94,;1.42,.16,;2.61,-.88,;2.61,-2.39,;3.93,-3.16,;5.25,-2.39,;5.25,-.88,;6.63,-.05,;8,-.82,;8,-2.37,;9.32,-.1,;10.74,-.75,;11.75,.42,;11.03,1.71,;9.47,1.43,;3.93,-.13,;3.6,1.4,;2.1,1.53,;1.32,2.9,;-7.66,-1.76,;-9.16,-2.09,;-10.22,-.95,;-11.75,-1.32,)|

BDBM670358

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N(C)CCCN)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.3,3.18,;-10.77,1.69,;-9.71,.54,;-8.23,.82,;-7.2,-.28,;-5.74,.05,;-4.74,-1.08,;-5.17,-2.59,;-3.22,-.8,;-2.71,.67,;-1.22,.98,;-.19,-.13,;-.68,-1.62,;-2.17,-1.93,;1.3,.18,;2.45,-.87,;2.45,-2.41,;3.79,-3.18,;5.09,-2.41,;5.09,-.87,;6.4,-.08,;6.4,1.46,;7.79,-.85,;9.02,-.1,;10.43,-.85,;11.72,-.08,;3.73,-.1,;3.43,1.44,;1.94,1.54,;1.17,2.93,;-7.71,-1.75,;-9.2,-2.05,;-10.25,-.92,;-11.72,-1.28,)|

BDBM670359

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N4CCC(N)CC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.65,3.13,;-10.12,1.64,;-9.06,.48,;-7.55,.77,;-6.52,-.34,;-5.06,-.01,;-4.05,-1.14,;-4.49,-2.65,;-2.51,-.85,;-2,.61,;-.51,.92,;.52,-.18,;.03,-1.67,;-1.46,-1.98,;2.01,.12,;3.19,-.9,;3.19,-2.39,;4.47,-3.13,;5.76,-2.39,;5.76,-.9,;7.09,-.13,;8.42,-.9,;9.76,-.13,;9.76,1.41,;11.09,2.18,;8.42,2.18,;7.09,1.41,;4.47,-.16,;4.16,1.38,;2.67,1.48,;1.88,2.87,;-7.03,-1.83,;-8.52,-2.11,;-9.58,-.98,;-11.09,-1.34,)|

BDBM670360

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(OCCN(C)C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.48,3.19,;-10.95,1.69,;-9.89,.52,;-8.36,.81,;-7.32,-.31,;-5.84,.03,;-4.81,-1.11,;-5.25,-2.64,;-3.28,-.83,;-2.76,.65,;-1.26,.96,;-.19,-.15,;-.71,-1.65,;-2.22,-1.97,;1.28,.16,;2.48,-.9,;2.48,-2.44,;3.8,-3.19,;5.12,-2.44,;5.12,-.9,;6.52,-.1,;7.89,-.88,;9.19,-.13,;10.54,-.88,;11.94,-.13,;10.54,-2.43,;3.8,-.13,;3.49,1.43,;1.96,1.53,;1.18,2.93,;-7.84,-1.78,;-9.34,-2.09,;-10.41,-.95,;-11.94,-1.32,)|

BDBM670361

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N(C)CCCNC(=O)OC(C)(C)C)c3[nH]c2=O)ccc1C |r,wU:8.7,11.14,(-13.88,-3.37,;-12.37,-3.01,;-11.91,-1.55,;-10.39,-1.24,;-9.9,.22,;-8.42,.53,;-7.42,-.58,;-7.85,-2.07,;-5.9,-.29,;-5.39,1.14,;-3.9,1.45,;-2.87,.35,;-3.36,-1.12,;-4.82,-1.42,;-1.39,.65,;-.23,-.37,;-.23,-1.91,;1.1,-2.68,;2.44,-1.91,;2.44,-.37,;3.75,.4,;3.75,1.93,;5.13,-.35,;6.44,.4,;7.8,-.35,;9.08,.4,;10.42,-.32,;10.42,-1.85,;11.75,.4,;13.14,-.37,;14.45,.42,;14.45,-1.17,;13.14,-1.9,;1.1,.4,;.77,1.91,;-.72,2.01,;-1.51,3.37,;-10.93,1.3,;-12.44,1.01,;-12.96,-.42,;-14.45,-.78,)|

BDBM670362

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(OCCCN(C)C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-12.76,1.45,;-11.24,1.81,;-10.21,.68,;-8.68,.93,;-7.65,-.18,;-6.18,.16,;-5.15,-.98,;-5.59,-2.5,;-3.63,-.69,;-3.11,.78,;-1.61,1.09,;-.58,-.02,;-1.07,-1.52,;-2.59,-1.83,;.92,.29,;2.08,-.77,;2.08,-2.3,;3.4,-3.05,;4.71,-2.3,;4.71,-.77,;6.05,0,;7.42,-.77,;8.66,-.02,;10.1,-.77,;11.37,0,;12.76,-.8,;11.37,1.55,;3.4,0,;3.09,1.55,;1.56,1.68,;.79,3.05,;-8.14,-1.65,;-9.66,-1.96,;-10.72,-.82,;-12.22,-1.18,)|

BDBM670363

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(OC4CCNCC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.79,3.19,;-10.26,1.7,;-9.19,.53,;-7.68,.82,;-6.64,-.27,;-5.14,.04,;-4.12,-1.08,;-4.56,-2.59,;-2.56,-.79,;-2.07,.66,;-.56,.97,;.48,-.14,;-.01,-1.62,;-1.52,-1.94,;1.99,.17,;3.19,-.87,;3.19,-2.37,;4.49,-3.12,;5.78,-2.37,;5.78,-.87,;7.21,-.09,;8.57,-.87,;8.57,-2.41,;9.92,-3.19,;11.24,-2.41,;11.24,-.87,;9.92,-.09,;4.49,-.12,;4.17,1.42,;2.67,1.55,;1.86,2.92,;-7.14,-1.76,;-8.67,-2.07,;-9.71,-.92,;-11.24,-1.23,)|

BDBM670364

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(OCCN(C)C(=O)OC(C)(C)C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-13.25,-3.37,;-11.74,-3.01,;-11.25,-1.55,;-9.76,-1.24,;-9.25,.22,;-7.79,.53,;-6.79,-.58,;-7.2,-2.07,;-5.25,-.3,;-4.73,1.14,;-3.25,1.45,;-2.22,.35,;-2.71,-1.12,;-4.17,-1.42,;-.73,.65,;.45,-.37,;.43,-2,;1.76,-2.74,;3.12,-1.92,;3.12,-.37,;4.45,.4,;5.81,-.35,;7.12,.4,;8.43,-.37,;8.43,-1.9,;9.76,.35,;9.76,1.88,;11.12,-.37,;12.48,.4,;13.82,1.19,;13.82,-.4,;12.48,1.93,;1.76,.37,;1.45,1.89,;-.06,2.01,;-.83,3.37,;-10.28,1.3,;-11.79,1.01,;-12.3,-.42,;-13.82,-.78,)|

BDBM670365

CNCCOc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc(C)c(OC)c3)c(=O)[nH]c12 |r,wU:11.10,14.17,(11.91,-.14,;10.51,-.89,;9.17,-.14,;7.85,-.89,;6.5,-.11,;5.11,-.89,;5.11,-2.4,;3.79,-3.17,;2.47,-2.4,;2.47,-.89,;1.28,.15,;-.22,-.16,;-1.23,.95,;-2.75,.64,;-3.27,-.84,;-2.21,-1.97,;-.71,-1.66,;-4.82,-1.12,;-5.24,-2.65,;-5.83,.02,;-7.31,-.32,;-7.82,-1.79,;-9.32,-2.1,;-10.38,-.97,;-11.91,-1.33,;-9.87,.51,;-10.92,1.67,;-10.46,3.17,;-8.34,.79,;1.95,1.52,;1.15,2.91,;3.48,1.41,;3.79,-.14,)|

BDBM670366

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N4CCCC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-8.97,3.21,;-9.44,1.7,;-8.37,.53,;-6.86,.82,;-5.82,-.3,;-4.34,.04,;-3.33,-1.08,;-3.77,-2.64,;-1.79,-.82,;-1.27,.66,;.23,.97,;1.27,-.14,;.78,-1.65,;-.73,-1.96,;2.78,.17,;3.95,-.87,;3.95,-2.46,;5.33,-3.21,;6.63,-2.46,;6.63,-.87,;7.96,-.09,;9.41,-.71,;10.43,.43,;9.67,1.75,;8.16,1.44,;5.25,-.12,;4.94,1.44,;3.43,1.55,;2.65,2.95,;-6.34,-1.78,;-7.85,-2.09,;-8.92,-.95,;-10.43,-1.26,)|

BDBM670367

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C4=CCNCC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,t:21,(-9,3.19,;-9.46,1.7,;-8.43,.54,;-6.91,.82,;-5.89,-.28,;-4.42,.05,;-3.42,-1.08,;-3.83,-2.6,;-1.87,-.8,;-1.36,.67,;.11,.98,;1.16,-.13,;.67,-1.62,;-.84,-1.93,;2.63,.18,;3.81,-.87,;3.81,-2.42,;5.15,-3.19,;6.46,-2.42,;6.46,-.85,;7.77,-.08,;7.77,1.46,;9.12,2.21,;10.44,1.46,;10.44,-.08,;9.12,-.83,;5.1,-.1,;4.79,1.44,;3.3,1.54,;2.52,2.93,;-6.4,-1.75,;-7.89,-2.06,;-8.95,-.93,;-10.44,-1.29,)|

BDBM670368

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(C4=CCN(C)CC4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,t:21,(-9.66,3.18,;-10.12,1.69,;-9.07,.53,;-7.58,.81,;-6.55,-.3,;-5.08,.04,;-4.08,-1.07,;-4.51,-2.61,;-2.56,-.81,;-2.04,.66,;-.53,.94,;.48,-.14,;-.01,-1.63,;-1.5,-1.94,;1.97,.17,;3.13,-.89,;3.13,-2.43,;4.49,-3.18,;5.78,-2.43,;5.78,-.89,;7.09,-.09,;7.09,1.45,;8.46,2.27,;9.75,1.57,;11.08,2.35,;9.75,.03,;8.46,-.8,;4.44,-.09,;4.11,1.43,;2.61,1.53,;1.84,2.92,;-7.06,-1.76,;-8.55,-2.07,;-9.61,-.94,;-11.08,-1.3,)|

BDBM670369

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N4CCC(C4)NC(C)=O)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.99,3.16,;-11.46,1.66,;-10.4,.52,;-8.87,.81,;-7.84,-.31,;-6.36,.08,;-5.35,-1.08,;-5.79,-2.61,;-3.83,-.82,;-3.28,.65,;-1.81,.94,;-.75,-.15,;-1.24,-1.63,;-2.77,-1.94,;.75,.16,;1.91,-.87,;1.91,-2.39,;3.23,-3.16,;4.55,-2.39,;4.55,-.87,;5.92,-.1,;6.1,1.43,;7.63,1.71,;8.38,.44,;7.37,-.72,;9.91,.26,;10.84,1.48,;12.41,1.35,;10.22,2.9,;3.23,-.13,;2.92,1.4,;1.4,1.53,;.62,2.9,;-8.35,-1.78,;-9.85,-2.09,;-10.91,-.95,;-12.41,-1.31,)|

BDBM670370

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N4Cc5cn[nH]c5C4)c3[nH]c2=O)ccc1C |r,wU:8.7,11.14,(-9.8,3.18,;-10.26,1.68,;-9.2,.51,;-7.72,.82,;-6.66,-.29,;-5.18,.02,;-4.17,-1.1,;-4.59,-2.63,;-2.64,-.81,;-2.1,.66,;-.6,.95,;.41,-.16,;-.05,-1.64,;-1.58,-1.95,;1.92,.15,;3.11,-.89,;3.11,-2.42,;4.43,-3.18,;5.75,-2.42,;5.75,-.89,;7.1,-.11,;7.28,1.44,;8.78,1.75,;9.85,2.92,;11.22,2.3,;11.07,.74,;9.54,.43,;8.53,-.73,;4.43,-.11,;4.09,1.42,;2.59,1.55,;1.79,2.92,;-7.15,-1.77,;-8.66,-2.11,;-9.72,-.97,;-11.22,-1.3,)|

BDBM670371

CC(=O)Nc1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc4cc[nH]c4c3)c(=O)[nH]c12 |r,wU:10.9,13.16,(9.4,-2.33,;9.4,-.78,;10.78,-.01,;8,-.01,;6.66,-.78,;6.66,-2.28,;5.36,-3.02,;4.07,-2.28,;4.07,-.78,;2.88,.25,;1.38,-.06,;.37,1.06,;-1.16,.75,;-1.68,-.7,;-.62,-1.84,;.91,-1.53,;-3.21,-.99,;-3.65,-2.52,;-4.22,.12,;-5.69,-.19,;-6.21,-1.69,;-7.71,-2,;-8.75,-.86,;-10.31,-.86,;-10.78,.62,;-9.51,1.54,;-8.26,.62,;-6.76,.93,;3.55,1.63,;2.77,3.02,;5.05,1.52,;5.36,-.03,)|

BDBM670372

COC(=O)NC1CCN(C1)c1cccc2n([C@@H]3CC[C@@H](CC3)C(=O)Nc3ccc(C)c(OC)c3)c(=O)[nH]c12 |r,wU:16.16,19.23,(12.86,2.6,;11.97,1.33,;10.45,1.48,;9.82,2.91,;9.51,.26,;7.98,.45,;7.23,1.72,;5.7,1.43,;5.52,-.1,;6.97,-.72,;4.15,-.88,;4.15,-2.4,;2.83,-3.17,;1.5,-2.4,;1.5,-.88,;.34,.16,;-1.17,-.15,;-2.23,.94,;-3.71,.65,;-4.25,-.83,;-3.19,-1.94,;-1.66,-1.63,;-5.78,-1.08,;-6.22,-2.61,;-6.79,.08,;-8.27,-.31,;-8.79,-1.78,;-10.29,-2.1,;-11.35,-.95,;-12.86,-1.32,;-10.83,.52,;-11.9,1.66,;-11.43,3.17,;-9.3,.81,;.99,1.53,;.21,2.91,;2.51,1.4,;2.83,-.13,)|

BDBM670373

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(N4CCC(C4)NC(=O)C(C)(C)O)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-11.68,3.15,;-12.15,1.68,;-11.09,.52,;-9.6,.8,;-8.57,-.28,;-7.07,.08,;-6.07,-1.1,;-6.5,-2.6,;-4.55,-.79,;-4.03,.65,;-2.51,.93,;-1.51,-.15,;-1.97,-1.62,;-3.49,-1.93,;.01,.16,;1.17,-.87,;1.17,-2.38,;2.49,-3.15,;3.8,-2.38,;3.8,-.87,;5.17,-.1,;5.35,1.42,;6.87,1.7,;7.61,.44,;6.58,-.72,;9.13,.26,;10.06,1.47,;9.44,2.89,;11.61,1.34,;12.48,2.61,;12.25,-.1,;13.13,1.16,;2.49,-.12,;2.18,1.42,;.66,1.55,;-.12,2.89,;-9.06,-1.75,;-10.55,-2.08,;-11.61,-.95,;-13.13,-1.28,)|

BDBM670374

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(=O)c4nccn4C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.29,3.16,;-10.76,1.66,;-9.7,.52,;-8.17,.81,;-7.16,-.31,;-5.66,.08,;-4.65,-1.08,;-5.09,-2.61,;-3.13,-.82,;-2.61,.65,;-1.09,.94,;-.05,-.15,;-.54,-1.62,;-2.07,-1.94,;1.45,.16,;2.61,-.87,;2.61,-2.39,;3.93,-3.16,;5.25,-2.39,;5.25,-.87,;6.62,-.05,;7.99,-.82,;7.99,-2.37,;9.28,-.1,;9.46,1.43,;11.02,1.71,;11.74,.39,;10.71,-.75,;11.07,-2.27,;3.93,-.12,;3.62,1.4,;2.09,1.53,;1.32,2.9,;-7.65,-1.78,;-9.18,-2.09,;-10.21,-.95,;-11.74,-1.26,)|

BDBM670375

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(=O)c4cn(C)cn4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.29,3.16,;-10.76,1.66,;-9.7,.52,;-8.17,.81,;-7.16,-.31,;-5.66,.08,;-4.65,-1.08,;-5.09,-2.61,;-3.13,-.82,;-2.61,.65,;-1.09,.94,;-.05,-.15,;-.54,-1.62,;-2.07,-1.94,;1.45,.16,;2.61,-.87,;2.61,-2.39,;3.93,-3.16,;5.25,-2.39,;5.25,-.87,;6.62,-.05,;7.99,-.82,;7.99,-2.37,;9.28,-.1,;9.49,1.43,;10.96,1.76,;11.66,3.16,;11.74,.39,;10.71,-.75,;3.93,-.12,;3.62,1.4,;2.09,1.53,;1.32,2.9,;-7.65,-1.78,;-9.18,-2.09,;-10.21,-.95,;-11.74,-1.26,)|

BDBM670376

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(=O)c4coc(N)n4)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.32,3.18,;-10.79,1.67,;-9.72,.54,;-8.22,.82,;-7.19,-.27,;-5.68,.1,;-4.67,-1.1,;-5.11,-2.6,;-3.12,-.81,;-2.63,.64,;-1.1,.95,;-.06,-.16,;-.56,-1.64,;-2.06,-1.95,;1.44,.15,;2.6,-.89,;2.6,-2.41,;3.92,-3.18,;5.24,-2.41,;5.24,-.89,;6.62,-.03,;7.96,-.84,;7.96,-2.39,;9.31,-.11,;10.73,-.73,;11.77,.41,;10.99,1.75,;11.61,3.18,;9.47,1.44,;3.92,-.14,;3.61,1.42,;2.08,1.55,;1.31,2.92,;-7.68,-1.77,;-9.21,-2.08,;-10.24,-.94,;-11.77,-1.25,)|

BDBM670377

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NC(=O)c4ccnn4C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.31,3.16,;-10.77,1.66,;-9.71,.52,;-8.21,.81,;-7.17,-.28,;-5.67,.08,;-4.66,-1.11,;-5.1,-2.61,;-3.13,-.82,;-2.62,.65,;-1.09,.94,;-.05,-.15,;-.54,-1.65,;-2.05,-1.96,;1.45,.16,;2.62,-.88,;2.62,-2.4,;3.94,-3.16,;5.26,-2.4,;5.26,-.88,;6.63,-.05,;8,-.82,;8,-2.38,;9.32,-.1,;10.75,-.75,;11.76,.39,;11.01,1.77,;9.48,1.43,;8.34,2.41,;3.94,-.13,;3.63,1.4,;2.1,1.53,;1.32,2.9,;-7.67,-1.78,;-9.19,-2.09,;-10.23,-.95,;-11.76,-1.26,)|

BDBM670378

Fc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2c3ccccc3[nH]c2=O)cc1 |r,wU:11.14,8.7,(-8.53,-1.13,;-7.02,-.81,;-6.5,.64,;-4.99,.95,;-3.93,-.16,;-2.44,.15,;-1.43,-.97,;-1.87,-2.48,;.13,-.68,;.65,.77,;2.18,1.08,;3.2,-.01,;2.7,-1.49,;1.22,-1.8,;4.71,.28,;5.88,-.74,;5.88,-2.26,;7.2,-3.03,;8.53,-2.26,;8.53,-.74,;7.2,.02,;6.89,1.55,;5.38,1.66,;4.58,3.03,;-4.45,-1.65,;-5.95,-1.96,)|

BDBM670379

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NCC(F)(F)F)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.77,3.18,;-10.23,1.68,;-9.18,.52,;-7.65,.8,;-6.62,-.31,;-5.15,.03,;-4.12,-1.11,;-4.56,-2.63,;-2.59,-.82,;-2.08,.65,;-.55,.93,;.48,-.15,;-.04,-1.65,;-1.54,-1.96,;1.95,.16,;3.14,-.9,;3.14,-2.43,;4.45,-3.18,;5.77,-2.43,;5.77,-.9,;7.14,-.1,;8.53,-.87,;9.87,-.1,;11.19,.68,;11.19,-.87,;9.87,1.45,;4.45,-.12,;4.14,1.42,;2.62,1.53,;1.85,2.92,;-7.14,-1.78,;-8.63,-2.09,;-9.69,-.95,;-11.19,-1.31,)|

BDBM670380

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(NCC(F)F)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-9.77,3.18,;-10.23,1.68,;-9.18,.52,;-7.65,.8,;-6.62,-.31,;-5.15,.03,;-4.12,-1.11,;-4.56,-2.63,;-2.59,-.82,;-2.08,.65,;-.55,.93,;.48,-.15,;-.04,-1.65,;-1.54,-1.96,;1.95,.16,;3.14,-.9,;3.14,-2.43,;4.45,-3.18,;5.77,-2.43,;5.77,-.9,;7.14,-.1,;8.53,-.87,;9.85,-.1,;9.85,1.45,;11.19,-.87,;4.45,-.12,;4.14,1.42,;2.62,1.53,;1.85,2.92,;-7.14,-1.78,;-8.63,-2.09,;-9.69,-.95,;-11.19,-1.31,)|

BDBM670381

COc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2c3cccc(OCCC(C)C)c3[nH]c2=O)ccc1C |r,wU:11.14,8.7,(-10.38,3.15,;-10.84,1.66,;-9.79,.5,;-8.27,.79,;-7.25,-.32,;-5.79,.02,;-4.76,-1.11,;-5.2,-2.63,;-3.25,-.83,;-2.73,.63,;-1.24,.94,;-.22,-.16,;-.71,-1.65,;-2.19,-1.96,;1.27,.15,;2.45,-.88,;2.45,-2.39,;3.76,-3.15,;5.07,-2.39,;5.07,-.88,;6.45,-.11,;7.79,-.88,;9.1,-.14,;10.46,-.88,;11.82,-.14,;10.46,-2.42,;3.76,-.14,;3.45,1.4,;1.94,1.53,;1.17,2.89,;-7.76,-1.78,;-9.25,-2.09,;-10.3,-.96,;-11.82,-1.32,)|

BDBM50630974

c1ccc2c(c1)c(nc(n2)C3CC3)NC4CCCCC4

BDBM50630975

OC(Cn1ccnc1)(C1CCCCC1)c1ccc(Cl)cc1Cl

BDBM50630976

Cc1cnc(nc1Oc1ccc(cc1)-n1ccnc1)N1CCN2CCCC2C1

BDBM50630977

CNc1nnc(C)c2n(C)c(cc12)-c1ccc(F)cc1

BDBM50630978

C[C@H](Nc1cc(C)nc(Nc2ccccc2)n1)C(=O)Nc1ccccc1 |r|