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BDBM50299286 3-(3-Fluoropropyl)-1'-octyl-3H-spiro[[2]benzofuran-1,4'-piperidine]::CHEMBL574235

SMILES: CCCCCCCCN1CCC2(CC1)OC(CCCF)c1ccccc21

InChI Key: InChIKey=ZWCDRAZLDQFJFS-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50299286   
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))		BDBM50299286
PNG
(3-(3-Fluoropropyl)-1'-octyl-3H-spiro[[2]benzofuran...)
Show SMILES CCCCCCCCN1CCC2(CC1)OC(CCCF)c1ccccc21
Show InChI InChI=1S/C23H36FNO/c1-2-3-4-5-6-9-17-25-18-14-23(15-19-25)21-12-8-7-11-20(21)22(26-23)13-10-16-24/h7-8,11-12,22H,2-6,9-10,13-19H2,1H3
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Similars
Article
PubMed
 37n/an/an/an/an/an/an/an/a



Institut f£r Pharmazeutische und Medizinische Chemie der Westf£lischen Wilhelms-Universit£t M£nster

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain membrane after 180 mins by scintillation counting

J Med Chem 52: 6062-72 (2009)


Article DOI: 10.1021/jm900909e
BindingDB Entry DOI: 10.7270/Q2KH0ND9
More data for this
Ligand-Target Pair