BDBM17874 Ketoamide inhibitor, 36::SCH 571696::tert-butyl N-[(1S)-2-[(1R,2S,5R)-2-[(1-carbamoyl-3-cyclobutyl-1-oxopropan-2-yl)carbamoyl]-7,7-dimethyl-6-oxa-3-azabicyclo[3.2.0]heptan-3-yl]-1-cyclohexyl-2-oxoethyl]carbamate

SMILES CC(C)(C)OC(=O)N[C@@H](C1CCCCC1)C(=O)N1C[C@@H]2OC(C)(C)[C@@H]2[C@H]1C(=O)NC(CC1CCC1)C(=O)C(N)=O

InChI Key InChIKey=WRVVRHORVNXEJF-UHFFFAOYSA-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 = 17874   

TargetGenome polyprotein(HCV)
Schering-Plough Research Institute

LigandPNGBDBM17874(tert-butyl N-[(1S)-2-[(1R,2S,5R)-2-[(1-carbamoyl-3...)
Affinity DataKi:  1.40E+3nM ΔG°:  -8.11kcal/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 Depth
Date in BDB:
9/18/2007
Entry Details Article
PubMed