BDBM50073268 CHEMBL331294::{2-[(1S,2S,3R,4S)-1-Benzyl-2,3-dihydroxy-4-(3-hydroxy-2-methyl-benzoylamino)-5-phenyl-pentylcarbamoyl]-phenyl}-carbamic acid pyridin-2-ylmethyl ester

SMILES Cc1c(O)cccc1C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1NC(=O)OCc1ccccn1

InChI Key InChIKey=QYYDGLUFMLECTL-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 = 50073268   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Aids Drug Screening and Development Laboratory

Curated by ChEMBL
LigandPNGBDBM50073268({2-[(1S,2S,3R,4S)-1-Benzyl-2,3-dihydroxy-4-(3-hydr...)
Affinity DataKi:  0.0900nMAssay Description:Inhibitory activity against HIV proteaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed