BDBM50494769 CHEMBL3094159

SMILES CN(C)CCCC1(OCc2cc(CN(C)CCCC3(OCc4cc(ccc34)C#N)c3ccc(F)cc3)ccc12)c1ccc(F)cc1

InChI Key InChIKey=PVWATSQEKUHFAQ-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 = 50494769   

TargetSodium-dependent serotonin transporter(Rat)
National Institute On Drug Abuse-Intramural Research Program

Curated by ChEMBL
LigandPNGBDBM50494769(CHEMBL3094159)
Affinity DataKi:  30nMAssay Description:Displacement of [3H]citalopram from Sprague-Dawley rat brain stem SERT site S1 by scintillation counting analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/2/2020
Entry Details Article
PubMed
TargetSodium-dependent serotonin transporter(Human)
National Institute On Drug Abuse-Intramural Research Program

Curated by ChEMBL
LigandPNGBDBM50494769(CHEMBL3094159)
Affinity DataIC50: 4.90E+3nMAssay Description:Allosteric modulation at wild-type human SERT site S2 expressed in african green monkey COS7 cells assessed as inhibition of [3H]citalopram dissociat...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/2/2020
Entry Details Article
PubMed