BDBM9702 1,4-disodium (2S)-2-[2-(3-{[(2S)-1-[(2S)-3-methyl-2-{[(2-methylpropoxy)carbonyl]amino}butanoyl]pyrrolidin-2-yl]formamido}-2-oxohexanamido)acetamido]butanedioate::P3-capped alpha-ketoamide inhibitor 16

SMILES CCCC(NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)OCC(C)C)C(C)C)C(=O)C(=O)NCC(=O)N[C@@H](CC([O-])=O)C([O-])=O

InChI Key InChIKey=RNMFQYYYNKBIOK-VVIDKITLSA-L

Data  1 KI

  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 = 9702   

TargetGenome polyprotein(Hepatitis C virus (HCV genotype 1a, isolate H))
Schering-Plough Research Institute

LigandPNGBDBM9702(1,4-disodium (2S)-2-[2-(3-{[(2S)-1-[(2S)-3-methyl-...)
Affinity DataKi: >1.00E+5nM ΔG°: >-5.54kcal/molepH: 6.5 T: 2°CAssay Description:Proteolytic cleavage of the ester linkage between the Nva (L-norvaline) and the chromophore (PAP) was monitored for change in absorbance at 370 nm. I...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed