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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 = 'BDBM83335'   
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))
BDBM83335
PNG
(4-(2-phenoxyethyl)-1-[[1-(3-pyridinyl)-2-pyrrolyl]...)
Show SMILES CCOC(=O)C1(CCOc2ccccc2)CCN(Cc2cccn2-c2cccnc2)CC1
Show InChI InChI=1S/C26H31N3O3/c1-2-31-25(30)26(14-19-32-24-10-4-3-5-11-24)12-17-28(18-13-26)21-23-9-7-16-29(23)22-8-6-15-27-20-22/h3-11,15-16,20H,2,12-14,17-19,21H2,1H3
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PC cid
PC sid
UniChem
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