BDBM50009262 1-[1-[1-[1-amino-2-hydroxy-(1S)-ethylcarboxamido]-(1S)-ethylcarboxamido]-(1S)-ethylcarboxamido]-2-phenyl-(1S)-ethyl{2-[2-methyl-1-[2-methyl-1-methyloxycarbonyl-(1S)-propylcarbamoyl]-(1S)-propylcarbamoyl]ethyl}phosphinic acid::CHEMBL308254

SMILES COC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CCP(O)(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)C(C)C)C(C)C

InChI Key InChIKey=QNEGZKIGTFPZCG-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 = 50009262   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50009262(1-[1-[1-[1-amino-2-hydroxy-(1S)-ethylcarboxamido]-...)
Affinity DataKi:  4.40E+3nMAssay Description:Binding affinity for HIV-1 proteaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/21/2012
Entry Details Article
PubMed