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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 = 'BDBM83319'   
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))
BDBM83319
PNG
(1-[2-(dimethylamino)-2-(3-pyridinyl)ethyl]-3-(3-me...)
Show SMILES CN(C)C(CNC(=S)Nc1cccc(C)c1)c1cccnc1
Show InChI InChI=1S/C17H22N4S/c1-13-6-4-8-15(10-13)20-17(22)19-12-16(21(2)3)14-7-5-9-18-11-14/h4-11,16H,12H2,1-3H3,(H2,19,20,22)
PDB

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PC cid
PC sid
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Similars

PCBioAssay
n/an/an/an/a>9.25E+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