BDBM71239 (Z)-3-(2,5-dichloroanilino)-2-(2-furoyl)-3-(methylthio)acrylonitrile::(Z)-3-(2,5-dichloroanilino)-2-(furan-2-carbonyl)-3-methylsulfanylprop-2-enenitrile::(Z)-3-(2,5-dichloroanilino)-2-[2-furanyl(oxo)methyl]-3-(methylthio)-2-propenenitrile::(Z)-3-[[2,5-bis(chloranyl)phenyl]amino]-2-(furan-2-ylcarbonyl)-3-methylsulfanyl-prop-2-enenitrile::3-(2,5-dichloroanilino)-2-(2-furylcarbonyl)-3-(methylthio)acrylonitrile::MLS000851244::SMR000457587::cid_2804241

SMILES CC(C)c1cc(OC(F)F)cc(C(C)C)c1NC(=O)N=[S@](N)(=O)c1sc(C(C)(C)O)cc1F

InChI Key InChIKey=HJWLCQSMTQYYDR-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 = 71239   

LigandChemical structure of BindingDB Monomer ID 71239BDBM71239(US11724992, Example 95 | US11724992, Compound 187a)
Affinity DataIC50: 8nMAssay 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