BDBM50134416 CHEMBL332974::Trifluoro-acetate{4-[3-((8R,9R)-7,7-dibutyl-2-dimethylamino-8-hydroxy-5,5-dioxo-6,7,8,9-tetrahydro-5H-5lambda*6*-thia-6-aza-benzocyclohepten-9-yl)-phenylcarbamoyl]-butyl}-triethyl-ammonium;

SMILES CCCCC1(CCCC)NS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1cccc(NC(=O)CCCC[N+](CC)(CC)CC)c1)N(C)C

InChI Key InChIKey=XWCZKGRAQFTZBN-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 = 50134416   

TargetIleal sodium/bile acid cotransporter(Human)
Pfizer

Curated by ChEMBL
LigandPNGBDBM50134416(Trifluoro-acetate{4-[3-((8R,9R)-7,7-dibutyl-2-dime...)
Affinity DataIC50: 1.60nMAssay 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