BDBM31677 imidazole-dioxolane, 29

SMILES Clc1ccc(CC[C@@]2(Cn3ccnc3)OC[C@@H](COc3ccc(cc3)C#N)O2)cc1

InChI Key InChIKey=RGJNTVPHUAKXGQ-DHIUTWEWSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 31677   

TargetCytochrome P450 3A1(Rattus norvegicus (rat))
Queen'S University

LigandPNGBDBM31677(imidazole-dioxolane, 29)
Affinity DataIC50:  6.90E+3nMAssay Description:CYP3A1/3A2-catalyzed erythromycin N-demethylase activity was determined by the spectrophotometric measurement of formaldehyde. Briefly, reaction mixt...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed