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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 = 'BDBM78424'   
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))
BDBM78424
PNG
(MLS001239250 | N-(4,6-difluoro-1,3-benzothiazol-2-...)
Show SMILES CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1)c1nc2c(F)cc(F)cc2s1
Show InChI InChI=1S/C28H28F2N4O3S2/c1-32(2)13-5-14-34(28-31-26-24(30)16-22(29)17-25(26)38-28)27(35)20-8-10-23(11-9-20)39(36,37)33-15-12-19-6-3-4-7-21(19)18-33/h3-4,6-11,16-17H,5,12-15,18H2,1-2H3
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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