BDBM9747 2-aza-bicyclo[2.2.1]heptane-3-carboxylic acid deriv. 11::tert-butyl N-[(2S)-3,3-dimethyl-1-oxo-1-[(3S)-3-{[1-oxo-1-(prop-2-en-1-ylcarbamoyl)pentan-2-yl]carbamoyl}-2-azabicyclo[2.2.1]heptan-2-yl]butan-2-yl]carbamate

SMILES CCCC(NC(=O)[C@@H]1C2CCC(C2)N1C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)C(=O)NCC=C

InChI Key InChIKey=XGSMFFHGIXCNMG-VIMZLGPTSA-N

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 = 9747   

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

LigandPNGBDBM9747(2-aza-bicyclo[2.2.1]heptane-3-carboxylic acid deri...)
Affinity DataKi:  5.50E+3nM ΔG°:  -7.29kcal/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