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BDBM50000477 CHEMBL538775

SMILES: Cl.CCc1cccc(C(=O)N[C@@H]2CN3CCC2CC3)c1C

InChI Key: InChIKey=OXRIHEFNNJIDDZ-PKLMIRHRSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50000477   
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)		BDBM50000477
PNG
(CHEMBL538775)
Show SMILES Cl.CCc1cccc(C(=O)N[C@@H]2CN3CCC2CC3)c1C |r,wU:11.9,(7.78,-2.05,;-6.64,-1.69,;-5.58,-2.32,;-4.24,-1.57,;-4.22,-.03,;-2.88,.72,;-1.56,-.06,;-1.57,-1.6,;-.25,-2.38,;-.26,-3.62,;1.1,-1.63,;2.43,-2.41,;2.41,-4.03,;3.81,-4.83,;4.33,-3.38,;3.26,-2.74,;3.81,-1.57,;5.21,-2.38,;5.21,-4.01,;-2.92,-2.36,;-2.93,-3.59,)|
Show InChI InChI=1S/C17H24N2O.ClH/c1-3-13-5-4-6-15(12(13)2)17(20)18-16-11-19-9-7-14(16)8-10-19;/h4-6,14,16H,3,7-11H2,1-2H3,(H,18,20);1H/t16-;/m1./s1
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PC cid
PC sid
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PubMed
 501n/an/an/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 3 (5-HT3) receptor in rat brain cortical membranes using radioligand [3H]quipazine

J Med Chem 36: 2645-57 (1993)

Checked by Author
BindingDB Entry DOI: 10.7270/Q2GM88T8
More data for this
Ligand-Target Pair