BDBM50308021 1-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-(2-(3-methoxypropylamino)-5,6-dimethyl-1H-benzo[d]imidazol-1-yl)ethanone::2-(2-(3-Methoxypropylamino)-5,6-dimethyl-1H-benzo-[d]imidazol-1-yl)-1-(3,5-di-tert-butyl-4-hydroxyphenyl)ethanone::CHEMBL600058

SMILES COCCCNc1nc2cc(C)c(C)cc2n1CC(=O)c1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C

InChI Key InChIKey=OCJFISAERVJZBG-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 = 50308021   

TargetCytochrome P450 3A4(Human)
Human Biomolecular Research Institute

Curated by ChEMBL
LigandPNGBDBM50308021(2-(2-(3-Methoxypropylamino)-5,6-dimethyl-1H-benzo-...)
Affinity DataIC50: 9.70E+4nMAssay Description:Inhibition of CYP3A4-mediated hydroxylation of testosterone in human liver microsomes in NADPH co-factor system by RP-HPLCMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/2/2010
Entry Details Article
PubMed