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BDBM50455957 CHEMBL431499

SMILES: Cc1ccc(cc1)S(O)(=O)=O.COc1ccccc1C(=O)NC(=O)NC1CC2CCCC(C1)N2C

InChI Key: InChIKey=JPIPKJWGNCKVRT-UHFFFAOYSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50455957   
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)
BDBM50455957
PNG
(CHEMBL431499)
Show SMILES COc1ccccc1C(=O)NC(=O)NC1CC2CCCC(C1)N2C
Show InChI InChI=1S/C18H25N3O3.C7H8O3S/c1-21-13-6-5-7-14(21)11-12(10-13)19-18(23)20-17(22)15-8-3-4-9-16(15)24-2;1-6-2-4-7(5-3-6)11(8,9)10/h3-4,8-9,12-14H,5-7,10-11H2,1-2H3,(H2,19,20,22,23);2-5H,1H3,(H,8,9,10)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 40n/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)


Article DOI: 10.1021/jm00087a003
BindingDB Entry DOI: 10.7270/Q24B32SK
More data for this
Ligand-Target Pair