BDBM651002 20-chloro-2-[(2S,5R)-2,5- dimethyl-4-(prop-2- enoyl)piperazin-1-yl]-17-fluoro- 6-(propan-2-yl)-11,12-dihydro- 4H,10H-1,18- (ethanediylidene)pyrido[4,3- e]pyrimido[1,6-g][1,7,9] benzoxadiazacyclodo- decin-4-one::US20240043448, Example 63

SMILES CC(C)c1nccc2CCCOc3cccc(F)c3-c3nc4n(-c12)c(=O)nc(N1C[C@@H](C)N(C[C@@H]1C)C(=O)C=C)c4cc3Cl

InChI Key InChIKey=UHEOFLHYKUNBOG-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 651002   

TargetGTPase KRas [2-169,G12C,C51S,C80L,C118S](Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM651002(20-chloro-2-[(2S,5R)-2,5- dimethyl-4-(prop-2- enoy...)
Affinity DataIC50: 3.60nMAssay Description:Each test compound (10 mM stock in DMSO) is diluted in DMSO to make a 10-point, 3-fold dilution series in a 384-well low dead volume microplate (Labc...More data for this Ligand-Target Pair
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Date in BDB:
4/12/2024
Entry Details
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