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SMILES: Fc1ccccc1NC(=O)CN1CCN(CC1)S(=O)(=O)c1ccccc1F

InChI Key: InChIKey=HTGVYMXTLJPURK-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50419605   
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
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Homo sapiens (Human))		BDBM50419605
PNG
(CHEMBL1940791)
Show SMILES Fc1ccccc1NC(=O)CN1CCN(CC1)S(=O)(=O)c1ccccc1F
Show InChI InChI=1S/C18H19F2N3O3S/c19-14-5-1-3-7-16(14)21-18(24)13-22-9-11-23(12-10-22)27(25,26)17-8-4-2-6-15(17)20/h1-8H,9-13H2,(H,21,24)
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Similars
Article
PubMed
n/an/a 8.00E+3n/an/an/an/an/an/a



The Ohio State University

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...

J Med Chem 54: 8681-92 (2011)


Article DOI: 10.1021/jm201294r
BindingDB Entry DOI: 10.7270/Q2057H6W
More data for this
Ligand-Target Pair