BDBM71737 5-cyano-6-[(4-cyanobenzyl)thio]-2-methyl-nicotinic acid ethyl ester::5-cyano-6-[(4-cyanophenyl)methylthio]-2-methyl-3-pyridinecarboxylic acid ethyl ester::MLS000058511::SMR000068010::cid_2999550::ethyl 5-cyano-6-[(4-cyanophenyl)methylsulfanyl]-2-methyl-pyridine-3-carboxylate::ethyl 5-cyano-6-[(4-cyanophenyl)methylsulfanyl]-2-methylpyridine-3-carboxylate

SMILES CC(C)(O)c1csc([S@@](N)(=O)=NC(=O)Nc2c3c(c(F)c4c2CCC4)CCC3)c1

InChI Key InChIKey=ARCZVGSSHYDAMC-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 = 71737   

LigandChemical structure of BindingDB Monomer ID 71737BDBM71737(US11724992, Example 206 | US11724992, Compound 176...)
Affinity DataIC50: 24nMAssay Description:THP-1 cells were purchased from the American Type Culture Collection and sub-cultured according to instructions from the supplier. Prior to experimen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/21/2023
Entry Details
US Patent