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SMILES: COC(=O)C1(CC1CN1CCN(CC1)c1ncccn1)c1ccc(Cl)cc1

InChI Key: InChIKey=JSJZBMMECIILOT-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50206596   
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
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))		BDBM50206596
PNG
(CHEMBL221347 | methyl (1R,2S/1S,2R)-1-(4-chlorophe...)
Show SMILES COC(=O)C1(CC1CN1CCN(CC1)c1ncccn1)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H23ClN4O2/c1-27-18(26)20(15-3-5-17(21)6-4-15)13-16(20)14-24-9-11-25(12-10-24)19-22-7-2-8-23-19/h2-8,16H,9-14H2,1H3
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Article
PubMed
 350n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H](+)pentazocine from guinea pig brain sigma 1 receptor

J Med Chem 50: 951-61 (2007)


Article DOI: 10.1021/jm0611197
BindingDB Entry DOI: 10.7270/Q2GH9HN8
More data for this
Ligand-Target Pair