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BDBM50455963 CHEMBL544952

SMILES: Cl.COc1ccc(Cl)cc1C(=O)NC(=O)NC1CC2CCC(C1)N2C

InChI Key: InChIKey=GIKANQFUUNESEP-UHFFFAOYSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50455963   
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
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)		BDBM50455963
PNG
(CHEMBL544952)
Show SMILES Cl.COc1ccc(Cl)cc1C(=O)NC(=O)NC1CC2CCC(C1)N2C |TLB:15:16:23:19.20|
Show InChI InChI=1S/C17H22ClN3O3.ClH/c1-21-12-4-5-13(21)9-11(8-12)19-17(23)20-16(22)14-7-10(18)3-6-15(14)24-2;/h3,6-7,11-13H,4-5,8-9H2,1-2H3,(H2,19,20,22,23);1H
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PubMed
n/an/an/a 47n/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
In vitro antagonism of the 5-HT-3 receptor determined by inhibition of 5-HT-induced depolarization of the isolated rat vagus nerve.

J Med Chem 35: 1515-20 (1992)


BindingDB Entry DOI: 10.7270/Q24B32SK
More data for this
Ligand-Target Pair