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SMILES: CC(C)C(=O)OCC1(CCN(CCc2cccs2)CC1)N(C(=O)C(C)C)c1ccccc1

InChI Key: InChIKey=VRPQDRSWGVFSDR-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50228225   
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
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1


(Rattus norvegicus (rat)-RAT)		BDBM50228225
PNG
(CHEMBL174758)
Show SMILES CC(C)C(=O)OCC1(CCN(CCc2cccs2)CC1)N(C(=O)C(C)C)c1ccccc1
Show InChI InChI=1S/C26H36N2O3S/c1-20(2)24(29)28(22-9-6-5-7-10-22)26(19-31-25(30)21(3)4)13-16-27(17-14-26)15-12-23-11-8-18-32-23/h5-11,18,20-21H,12-17,19H2,1-4H3
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PubMed
 27n/an/an/an/an/an/an/an/a



Anaquest Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity to displace [3H]naloxone from opiate receptor in freshly prepared rat brain homogenates

J Med Chem 32: 968-74 (1989)


BindingDB Entry DOI: 10.7270/Q2XG9TBN
More data for this
Ligand-Target Pair