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SMILES: O=c1c(cccn1C(CN1CCCC1)c1ccccc1)-c1cccs1

InChI Key: InChIKey=MSHFBNAPZPBWBU-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50108451   
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))		BDBM50108451
PNG
(1-(1-Phenyl-2-pyrrolidin-1-yl-ethyl)-3-thiophen-2-...)
Show SMILES O=c1c(cccn1C(CN1CCCC1)c1ccccc1)-c1cccs1
Show InChI InChI=1S/C21H22N2OS/c24-21-18(20-11-7-15-25-20)10-6-14-23(21)19(16-22-12-4-5-13-22)17-8-2-1-3-9-17/h1-3,6-11,14-15,19H,4-5,12-13,16H2
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PubMed
n/an/a 1.18E+3n/an/an/an/an/an/a



AstraZeneca R&D Mölndal

Curated by ChEMBL


Assay Description
Binding affinity towards kappa opioid receptor by the displacement of [125I]-(D-Pro10)-Dynorphin A

Bioorg Med Chem Lett 12: 197-200 (2001)


BindingDB Entry DOI: 10.7270/Q28051XH
More data for this
Ligand-Target Pair