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BDBM50455960 CHEMBL288430

SMILES: OC(=O)C(O)=O.COc1ccccc1C(=O)NC(=O)NC1CC2CCC(C1)N2C

InChI Key: InChIKey=LMWAXMVAPSCCBW-UHFFFAOYSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50455960   
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)
BDBM50455960
PNG
(CHEMBL288430)
Show SMILES OC(=O)C(O)=O.COc1ccccc1C(=O)NC(=O)NC1CC2CCC(C1)N2C |TLB:19:20:27:23.24|
Show InChI InChI=1S/C17H23N3O3.C2H2O4/c1-20-12-7-8-13(20)10-11(9-12)18-17(22)19-16(21)14-5-3-4-6-15(14)23-2;3-1(4)2(5)6/h3-6,11-13H,7-10H2,1-2H3,(H2,18,19,21,22);(H,3,4)(H,5,6)
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/a>32n/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