BDBM50156000 2-{2-[(2R,4S)-2-Benzyl-5-(2-benzyloxycarbonylamino-propionylamino)-4-hydroxy-6-phenyl-hexanoylamino]-3-methyl-butyrylamino}-3-methyl-butyric acid methyl ester::CHEMBL188203

SMILES COC(=O)C(NC(=O)C(NC(=O)[C@@H](C[C@H](O)C(Cc1ccccc1)NC(=O)C(C)NC(=O)OCc1ccccc1)Cc1ccccc1)C(C)C)C(C)C

InChI Key InChIKey=YBWAJXBCPYCNKK-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50156000   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
University of ZüRich

Curated by ChEMBL
LigandPNGBDBM50156000(2-{2-[(2R,4S)-2-Benzyl-5-(2-benzyloxycarbonylamino...)
Affinity DataKi:  0.600nMAssay Description:Binding affinity towards human immunodeficiency virus type 1 protease determined using continuum electrostatics solvationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed