BDBM50037824 CHEMBL122641::{(2R,4S)-4-[(S)-3-((3S,4aS,8aS)-3-tert-Butylcarbamoyl-octahydro-isoquinolin-2-yl)-2-hydroxy-propylcarbamoyl]-5,5-dimethyl-thiazolidin-2-yl}-((S)-phenylacetylamino)-acetic acid methyl ester

SMILES COC(=O)C(NC(=O)Cc1ccccc1)[C@@H]1N[C@@H](C(=O)NC[C@H](O)CN2C[C@H]3CCCC[C@H]3C[C@H]2C(=O)NC(C)(C)C)C(C)(C)S1

InChI Key InChIKey=IDYCGGAEUOLTTN-UHFFFAOYSA-N

Data  1 IC50

  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 = 50037824   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Glaxo Research and Development

Curated by ChEMBL
LigandPNGBDBM50037824({(2R,4S)-4-[(S)-3-((3S,4aS,8aS)-3-tert-Butylcarbam...)
Affinity DataIC50: 54nMAssay Description:In vitro inhibitory activity against HIV proteinaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed