BDBM50330014 ((3R,5R)-4-(4-chlorophenylsulfonyl)-5-(1-methylcyclopropyl)morpholin-3-yl)methyl 4-(hydroxymethyl)piperidine-1-carboxylate::CHEMBL1271763

SMILES CC1(CC1)[C@@H]1COC[C@H](COC(=O)N2CCC(CO)CC2)N1S(=O)(=O)c1ccc(Cl)cc1

InChI Key InChIKey=YNBKEKSKMRNJDI-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 = 50330014   

TargetCytochrome P450 3A4(Human)
Merck Research Lab.

Curated by ChEMBL
LigandPNGBDBM50330014(((3R,5R)-4-(4-chlorophenylsulfonyl)-5-(1-methylcyc...)
Affinity DataIC50: 5.5nMAssay Description:Inhibition of CYP3A4 after 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/13/2011
Entry Details Article
PubMed