BDBM50223250 2-(1-((2R,4S,6S)-1-(4-chlorophenylsulfonyl)-6-cyclopropyl-4-hydroxypiperidin-2-yl)cyclopropyl)-1-(4-(1-hydroxy-2-methylpropan-2-yl)piperazin-1-yl)ethanone::CHEMBL249494

SMILES CC(C)(CO)N1CCN(CC1)C(=O)CC1(CC1)[C@H]1C[C@@H](O)C[C@@H](C2CC2)N1S(=O)(=O)c1ccc(Cl)cc1

InChI Key InChIKey=FVMSLFYQMWOIFN-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 = 50223250   

TargetCytochrome P450 3A4(Human)
Schering-Plough Research Institute

Curated by ChEMBL
LigandPNGBDBM50223250(2-(1-((2R,4S,6S)-1-(4-chlorophenylsulfonyl)-6-cycl...)
Affinity DataIC50: 1.10E+4nMAssay Description:Inhibition of CYP3A4 after 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed