BDBM72210 MLS000582589::N-(2-ethylphenyl)-3-(4-methoxyphenyl)-3-(1-pyrrolyl)propanamide::N-(2-ethylphenyl)-3-(4-methoxyphenyl)-3-(1H-pyrrol-1-yl)propanamide::N-(2-ethylphenyl)-3-(4-methoxyphenyl)-3-pyrrol-1-yl-propanamide::N-(2-ethylphenyl)-3-(4-methoxyphenyl)-3-pyrrol-1-yl-propionamide::N-(2-ethylphenyl)-3-(4-methoxyphenyl)-3-pyrrol-1-ylpropanamide::SMR000206575::cid_12005042

SMILES C[C@@H](NC(=O)c1cc(N2CCOCC2)c(F)cc1N[C@H]1CN2CCC1CC2)c1cccc(C(C)(F)F)c1F

InChI Key InChIKey=GSLCSOMDEHGGJY-UHFFFAOYSA-N

Data  1 EC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 72210   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 72210BDBM72210(N—((R)-1-(3-(1,1-difluoroethyl)-2-fluorophenyl)eth...)
Affinity DataIC50: 15.1nMAssay 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