BDBM50134417 CHEMBL122229::{4-[3-((8R,9R)-7,7-Dibutyl-2-dimethylamino-8-hydroxy-6-methyl-5,5-dioxo-6,7,8,9-tetrahydro-5H-5lambda*6*-thia-6-aza-benzocyclohepten-9-yl)-phenylcarbamoyl]-butyl}-triethyl-ammonium; bromide

SMILES CCCCC1(CCCC)[C@H](O)[C@H](c2cccc(NC(=O)CCCC[N+](CC)(CC)CC)c2)c2cc(ccc2S(=O)(=O)N1C)N(C)C

InChI Key InChIKey=QXQQMHKVTSFINM-UHFFFAOYSA-O

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 = 50134417   

TargetIleal sodium/bile acid cotransporter(Human)
Pfizer

Curated by ChEMBL
LigandPNGBDBM50134417({4-[3-((8R,9R)-7,7-Dibutyl-2-dimethylamino-8-hydro...)
Affinity DataIC50: 83nMAssay Description:In vitro inhibitory activity against uptake of [14C]taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepend...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed