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SMILES: COc1cc(Br)cc(C(=O)NCCCCN(C)CCc2ccccc2)c1OC

InChI Key: InChIKey=QVIFOKZGFUAKHS-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50338989   
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))		BDBM50338989
PNG
(5-Bromo-N-(4-((3,4-dimethoxyphenethyl)(methyl)-ami...)
Show SMILES COc1cc(Br)cc(C(=O)NCCCCN(C)CCc2ccccc2)c1OC
Show InChI InChI=1S/C22H29BrN2O3/c1-25(14-11-17-9-5-4-6-10-17)13-8-7-12-24-22(26)19-15-18(23)16-20(27-2)21(19)28-3/h4-6,9-10,15-16H,7-8,11-14H2,1-3H3,(H,24,26)
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Similars
Article
PubMed
 583n/an/an/an/an/an/an/an/a



University of Missouri-Columbia

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)-pentazocine from Sigma1-receptor in guinea pig brain membrane

Bioorg Med Chem 19: 1852-9 (2011)


Article DOI: 10.1016/j.bmc.2011.02.006
BindingDB Entry DOI: 10.7270/Q2K64JC1
More data for this
Ligand-Target Pair