BDBM50087566 3-{[(R)-1-((S)-2-{(S)-2-[(S)-4-tert-Butoxycarbonyl-2-((S)-3-tert-butoxycarbonyl-2-tert-butoxycarbonylamino-propionylamino)-butyrylamino]-3-methyl-butyrylamino}-3-methyl-butyryl)-pyrrolidine-2-carbonyl]-amino}-2-oxo-hex-5-enoic acid methyl ester::CHEMBL162786

SMILES COC(=O)C(=O)C(CC=C)NC(=O)[C@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)OC(C)(C)C)NC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)C(C)C)C(C)C

InChI Key InChIKey=WVHLQQSHSYJAQQ-UHFFFAOYSA-N

Data  1 IC50

  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 = 50087566   

TargetGenome polyprotein(Hepatitis C virus genotype 1b (isolate Con1) (HCV))
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50087566(3-{[(R)-1-((S)-2-{(S)-2-[(S)-4-tert-Butoxycarbonyl...)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition against hepatitis C virus protease NS3 activityMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed