BDBM50286995 3-[4-Hydroxy-5-(2-isopropyl-phenylsulfanyl)-6-oxo-6H-pyran-2-yl]-benzoic acid ethyl ester::CHEMBL12622

SMILES CCOC(=O)c1cccc(c1)-c1cc(O)c(Sc2ccccc2C(C)C)c(=O)o1

InChI Key InChIKey=WLIOPFHPKLKOSK-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50286995   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
TBA

Curated by ChEMBL
LigandPNGBDBM50286995(3-[4-Hydroxy-5-(2-isopropyl-phenylsulfanyl)-6-oxo-...)
Affinity DataIC50: 1.93E+3nMpH: 4.7Assay Description:Inhibitory activity against purified HIV-1 protease (BH10) at a pH of 4.7 and a final enzyme concentration of 0.45-1.1 nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/20/2010
Entry Details Article