BDBM2507 (+/-)-3-[1-(Cyclohexylthio)-3,3-dimethylbutyl]-4-hydroxy-6-phenyl-2H-pyran-2-one::3-[1-(cyclohexylsulfanyl)-3,3-dimethylbutyl]-4-hydroxy-6-phenyl-2H-pyran-2-one::C-3-substituted Pyran-2-one 16

SMILES CC(C)(C)CC(SC1CCCCC1)c1c(O)cc(oc1=O)-c1ccccc1

InChI Key InChIKey=XOMLSGLFNOYRSP-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 2507   

TargetDimer of Gag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Parke-Davis Pharmaceutical Research

LigandPNGBDBM2507(3-[1-(cyclohexylsulfanyl)-3,3-dimethylbutyl]-4-hyd...)
Affinity DataIC50: 300nMpH: 4.7 T: 2°CAssay Description:For determination of IC50 values, HIV-1 protease was added to assay buffer containing inhibitor and the substrate (H-His-Lys-Ala-Arg-Val-Leu- (p-NO2)...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/8/2004
Entry Details Article
PubMed