BDBM27057 2-[(3S,13S,16S,17R,19S)-3-({[(1S)-1-cyclohexyl-2-cyclopropyl-2-oxoethyl]carbamoyl}amino)-18,18-dimethyl-2,15-dioxo-5-oxa-1,14-diazatricyclo[14.4.0.0^{17,19}]icosan-13-yl]-2-oxo-N-(prop-2-en-1-yl)acetamide::Macrocyclic Peptidomimetic, 25

SMILES CC1(C)[C@H]2CN3[C@@H]([C@@H]12)C(=O)N[C@@H](CCCCCCCOC[C@H](NC(=O)N[C@@H](C1CCCCC1)C(=O)C1CC1)C3=O)C(=O)C(=O)NCC=C

InChI Key InChIKey=JLQJJGKYIDWNPK-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 = 27057   

TargetGenome polyprotein(HCV)
Schering-Plough Research Institute

LigandPNGBDBM27057(2-[(3S,13S,16S,17R,19S)-3-({[(1S)-1-cyclohexyl-2-c...)
Affinity DataKi:  160nM ΔG°:  -9.42kcal/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:
2/20/2009
Entry Details Article
PubMed