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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 = 'BDBM83391'   
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))		BDBM83391
PNG
((1S,4aS,8aS)-7-[2-(1H-indol-3-yl)ethyl]-1-methyl-1...)
Show SMILES COC(=O)C1=CO[C@@H](C)[C@@H]2CN(CCc3c[nH]c4ccccc34)CC[C@H]12 |t:4|
Show InChI InChI=1S/C21H26N2O3/c1-14-18-12-23(10-8-17(18)19(13-26-14)21(24)25-2)9-7-15-11-22-20-6-4-3-5-16(15)20/h3-6,11,13-14,17-18,22H,7-10,12H2,1-2H3/t14-,17-,18-/m0/s1
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PCBioAssay
n/an/an/an/a>9.24E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...

PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q22V2DN3
More data for this
Ligand-Target Pair