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SMILES: C[C@H]1[C@H]2CCCCN2CC[C@@]1(C)c1cccc(O)c1

InChI Key: InChIKey=QSNKCELEYRXWPD-IAOVAPTHSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50199904   
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
Kappa-type opioid receptor


(Homo sapiens (Human))		BDBM50199904
PNG
(3-((1R,2R,9-alpha-R)-1,2-dimethyl-octahydro-1H-qui...)
Show SMILES C[C@H]1[C@H]2CCCCN2CC[C@@]1(C)c1cccc(O)c1 |r|
Show InChI InChI=1S/C17H25NO/c1-13-16-8-3-4-10-18(16)11-9-17(13,2)14-6-5-7-15(19)12-14/h5-7,12-13,16,19H,3-4,8-11H2,1-2H3/t13-,16+,17+/m0/s1
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 520n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Partial agonist activity at human cloned kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding

J Med Chem 49: 7278-89 (2006)


Article DOI: 10.1021/jm060486f
BindingDB Entry DOI: 10.7270/Q27P906S
More data for this
Ligand-Target Pair