BDBM50121732 CHEMBL172850::{1-[(S)-3-[N-Benzyl-N'-(3-hydroxy-2-methyl-benzoyl)-hydrazino]-2-hydroxy-3-oxo-1-((S)-phenylmethyl)-propylcarbamoyl]-2-methylsulfanyl-ethyl}-carbamic acid isoquinolin-5-ylmethyl ester

SMILES CSC[C@H](NC(=O)OCc1cccc2cnccc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)C(=O)N(Cc1ccccc1)NC(=O)c1cccc(O)c1C

InChI Key InChIKey=YEIHIAKNVFDXRE-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 = 50121732   

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

Curated by ChEMBL
LigandPNGBDBM50121732({1-[(S)-3-[N-Benzyl-N'-(3-hydroxy-2-methyl-benzoyl...)
Affinity DataKi:  0.470nMAssay Description:Inhibitory activity against HIV-1 proteaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed