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SMILES: Clc1ccc2c(CCN3CCC(=CC3)c3c[nH]c4ccccc34)coc2c1

InChI Key: InChIKey=IUSZBOCLQGETQQ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50306483   
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))
BDBM50306483
PNG
(3-(1-(2-(6-chlorobenzofuran-3-yl)ethyl)-1,2,3,6-te...)
Show SMILES Clc1ccc2c(CCN3CCC(=CC3)c3c[nH]c4ccccc34)coc2c1 |c:11|
Show InChI InChI=1S/C23H21ClN2O/c24-18-5-6-19-17(15-27-23(19)13-18)9-12-26-10-7-16(8-11-26)21-14-25-22-4-2-1-3-20(21)22/h1-7,13-15,25H,8-12H2
PDB

KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
12n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]paroxetine from 5-HT transporter in rat frontal cortical synaptosomes


Bioorg Med Chem Lett 20: 824-7 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.093
BindingDB Entry DOI: 10.7270/Q2B56JVJ
More data for this
Ligand-Target Pair