BDBM50143962 CHEMBL62878::N-(2-{4-[3-(4-Chloro-phenoxy)-2-hydroxy-propyl]-piperazin-1-yl}-2-phenyl-ethyl)-4-trifluoromethyl-benzamide

SMILES OC(COc1ccc(Cl)cc1)CN1CCN(CC1)C(CNC(=O)c1ccc(cc1)C(F)(F)F)c1ccccc1

InChI Key InChIKey=LZRJWFJEAUSNDC-UHFFFAOYSA-N

Data  1 KI  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 2 hits for monomerid = 50143962   

TargetCytochrome P450 2D6(Homo sapiens (Human))
Arqule

Curated by ChEMBL
LigandPNGBDBM50143962(CHEMBL62878 | N-(2-{4-[3-(4-Chloro-phenoxy)-2-hydr...)
Affinity DataKi:  1.00E+3nMAssay Description:Predictive competitive inhibition of cytochrome P450 2D6 was determined in silicoMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium channel protein type 1/2/3 subunit alpha(Rattus norvegicus)
Arqule

Curated by ChEMBL
LigandPNGBDBM50143962(CHEMBL62878 | N-(2-{4-[3-(4-Chloro-phenoxy)-2-hydr...)
Affinity DataIC50:  208nMAssay Description:In vitro inhibition of [3H]-batrachotoxin binding to neurotoxin site 2 of sodium (Na+) channel in rat cerebral cortex membraneMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed