BDBM663065 2-((2S)-1-acryloyl-4- (8-fluoro-2-((S)-1- methylpyrrolidin-2-yl) methoxy)-7-(1,1a,6,6a- tetrahydrocyclopropa [a]inden-5-yl)pyridinyl [4,3-d]pyrimidin-4-yl) piperazin-2-yl)acetonitrile, 1st eluting isomer::US20240109893, Example 873

SMILES CN1CCC[C@H]1COc1nc(N2CCN([C@@H](CC#N)C2)C(=O)C=C)c2cnc(c(F)c2n1)-c1cccc2C3CC3Cc12

InChI Key InChIKey=OZDQYDQDOITSRP-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 = 663065   

TargetGTPase KRas [G12C](Human)
Shanghai Kechow Pharma

US Patent
LigandPNGBDBM663065(2-((2S)-1-acryloyl-4- (8-fluoro-2-((S)-1- methylpy...)
Affinity DataIC50: 0.790nMAssay Description:1. Serially 4×-diluted compounds (10 concentration points in total) were separately premixed with KRAS G12C-GDP (ICE, Kras 20191018) in a reaction bu...More data for this Ligand-Target Pair
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Date in BDB:
6/20/2024
Entry Details
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