BDBM50014028 2-{[1-(2-{2-[2-(2-Acetylamino-3-hydroxy-propionylamino)-4-methyl-pentanoylamino]-3-carbamoyl-propionylamino}-1-hydroxy-3-phenyl-propyl)-pyrrolidine-2-carbonyl]-amino}-3-methyl-pentanoic acid methyl ester::CHEMBL3143739

SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(C)=O)C(=O)OC

InChI Key InChIKey=OZXURBBJHFLDSZ-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 = 50014028   

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

Curated by ChEMBL
LigandPNGBDBM50014028(2-{[1-(2-{2-[2-(2-Acetylamino-3-hydroxy-propionyla...)
Affinity DataKi:  420nMpH: 6.4Assay Description:Inhibitory activity against HIV Protease was measured at pH 6.4 and 37 degrees CMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed