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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50019829'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50019829
PNG
(CHEMBL2372402 | N-[1-(Carbamoylmethyl-carbamoyl)-2...)
Show SMILES [#6][S+]([#8-])[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-[#6](-[#7])=O
Show InChI InChI=1S/C26H35N7O6S/c1-40(39)12-11-19(31-25(38)21(33-26(28)29)14-17-7-9-18(34)10-8-17)24(37)32-20(23(36)30-15-22(27)35)13-16-5-3-2-4-6-16/h2-10,19-21,34H,11-15H2,1H3,(H2,27,35)(H,30,36)(H,31,38)(H,32,37)(H4,28,29,33)/t19-,20-,21-,40?/m0/s1
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n/an/a 300n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Evaluated for the inhibition of [3H]DADLE binding to Opioid receptor delta 1 of guinea pig brain

J Med Chem 30: 1538-42 (1987)


BindingDB Entry DOI: 10.7270/Q20Z73VC
More data for this
Ligand-Target Pair