BDBM50125376 CHEMBL275290::{(S)-3-[(S)-3-Cyclohexyl-2-((2S,3S)-3-methyl-2-{(S)-4-methyl-2-[(pyrazine-2-carbonyl)-amino]-pentanoylamino}-pentanoylamino)-propionylamino]-5,5-difluoro-2-oxo-pentanoylamino}-acetic acid::{(S)-3-[(S)-3-Cyclohexyl-2-((S)-3-methyl-2-{(S)-4-methyl-2-[((S)-oxo-pyrazin-2-yl-methyl)-amino]-pentanoylamino}-pentanoylamino)-1-oxo-propylamino]-5,5-difluoro-2-oxo-pentanoylamino}-acetic acid

SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)c1cnccn1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC(F)F)C(=O)C(=O)NCC(O)=O

InChI Key InChIKey=VNYOJACRBDECNH-QMJGUQGKSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50125376   

TargetGenome polyprotein(Hepatitis C virus)
Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50125376(CHEMBL275290 | {(S)-3-[(S)-3-Cyclohexyl-2-((2S,3S)...)
Affinity DataIC50:  60nMAssay Description:Inhibitory concentration against glycine alpha-ketoamide HCV NS3 proteaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGenome polyprotein(Hepatitis C virus (HCV))
Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50125376(CHEMBL275290 | {(S)-3-[(S)-3-Cyclohexyl-2-((2S,3S)...)
Affinity DataIC50:  60nMAssay Description:Inhibitory concentration of the compound against HCV NS3 protease was determinedMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed