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SMILES: CN(C)CCCC1(OCc2cc(CN(C)C)ccc12)c1ccc(F)cc1

InChI Key: InChIKey=LCSGAWOOXVASDT-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50494796   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))		BDBM50494796
PNG
(CHEMBL3094196)
Show SMILES CN(C)CCCC1(OCc2cc(CN(C)C)ccc12)c1ccc(F)cc1
Show InChI InChI=1S/C22H29FN2O/c1-24(2)13-5-12-22(19-7-9-20(23)10-8-19)21-11-6-17(15-25(3)4)14-18(21)16-26-22/h6-11,14H,5,12-13,15-16H2,1-4H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
 32n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from Sprague-Dawley rat brain stem SERT site S1 by scintillation counting analysis

J Med Chem 56: 9709-24 (2013)


Article DOI: 10.1021/jm4014136
BindingDB Entry DOI: 10.7270/Q2N58Q90
More data for this
Ligand-Target Pair