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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 = 'BDBM83376'   
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))
BDBM83376
PNG
((E)-3-(2-chloranylimidazo[1,2-a]pyridin-3-yl)-N-[2...)
Show SMILES COc1ccc(cc1)C(CNC(=O)\C=C\c1c(Cl)nc2ccccn12)N(C)C
Show InChI InChI=1S/C21H23ClN4O2/c1-25(2)18(15-7-9-16(28-3)10-8-15)14-23-20(27)12-11-17-21(22)24-19-6-4-5-13-26(17)19/h4-13,18H,14H2,1-3H3,(H,23,27)/b12-11+
PDB

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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