BDBM72198 (E)-2-cyano-N-(2-furanylmethyl)-3-[1-(phenylmethyl)-3-indolyl]-2-propenamide::(E)-2-cyano-N-(furan-2-ylmethyl)-3-[1-(phenylmethyl)indol-3-yl]prop-2-enamide::(E)-3-(1-benzylindol-3-yl)-2-cyano-N-(2-furfuryl)acrylamide::(E)-3-(1-benzylindol-3-yl)-2-cyano-N-(furan-2-ylmethyl)prop-2-enamide::3-(1-Benzyl-1H-indol-3-yl)-2-cyano-N-furan-2-ylmethyl-acrylamide::MLS000569131::SMR000177354::cid_1073560

SMILES C[C@@H](NC(=O)c1cc(N2CCCC2)c(F)cc1N[C@H]1CN2CCC1CC2)c1cccc(C(F)F)c1F

InChI Key InChIKey=MBWFUYNQIJHPJS-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 72198   

TargetGTPase KRas [1-169,G12C](Human)
SchroDinger

US Patent
LigandChemical structure of BindingDB Monomer ID 72198BDBM72198(N—((R)-1-(3-(difluoromethyl)-2-fluorophenyl)ethyl)...)
Affinity DataIC50: 35nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/15/2026
Entry Details
US Patent