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BDBM50455968 CHEMBL37416

SMILES: COc1cc(ccc1C(=O)NC(=O)NC1CC2CCC(C1)N2C)[N+]([O-])=O

InChI Key: InChIKey=DGPKPILUPYJPQP-UHFFFAOYSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50455968   
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)		BDBM50455968
PNG
(CHEMBL37416)
Show SMILES COc1cc(ccc1C(=O)NC(=O)NC1CC2CCC(C1)N2C)[N+]([O-])=O |TLB:13:14:21:17.18|
Show InChI InChI=1S/C17H22N4O5/c1-20-11-3-4-12(20)8-10(7-11)18-17(23)19-16(22)14-6-5-13(21(24)25)9-15(14)26-2/h5-6,9-12H,3-4,7-8H2,1-2H3,(H2,18,19,22,23)
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/an/a>100n/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