BDBM72997 2-[1-[(4-methoxy-3-methyl-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-(oxan-4-ylmethyl)ethanamide::2-[1-[(4-methoxy-3-methylphenyl)methyl]-3-oxo-2-piperazinyl]-N-(4-oxanylmethyl)acetamide::2-[1-[(4-methoxy-3-methylphenyl)methyl]-3-oxopiperazin-2-yl]-N-(oxan-4-ylmethyl)acetamide::2-[3-keto-1-(4-methoxy-3-methyl-benzyl)piperazin-2-yl]-N-(tetrahydropyran-4-ylmethyl)acetamide::MLS001101086::SMR000653573::cid_24791117

SMILES CC(C)(C)[C@H](NC(=O)C(F)(F)F)C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)NC(C#N)CCC1C(=O)Nc3ccccc31)C2(C)C

InChI Key InChIKey=GZJYUQIVPYGYEW-UHFFFAOYSA-N

Data  1 EC50

  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 = 72997   

TargetReplicase polyprotein 1ab(2019-nCoV)
Trawsfynydd Therapeutics

US Patent
LigandChemical structure of BindingDB Monomer ID 72997BDBM72997((1S,2S,5S)-N-[1-cyano-3-(2-oxoindolin-3-yl)propyl]...)
Affinity DataIC50: 750nMAssay 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:
4/22/2026
Entry Details
US Patent