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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50371822'   
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
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50371822
PNG
(CHEMBL255768)
Show SMILES CN(C)C[C@H]1CCCC[C@]1(OCC1CC1)c1cccc(O)c1
Show InChI InChI=1S/C19H29NO2/c1-20(2)13-17-6-3-4-11-19(17,22-14-15-9-10-15)16-7-5-8-18(21)12-16/h5,7-8,12,15,17,21H,3-4,6,9-11,13-14H2,1-2H3/t17-,19+/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 130n/an/an/an/an/an/a



Sepracor Inc.

Curated by ChEMBL


Assay Description
Binding affinity to mu opioid receptor


Bioorg Med Chem Lett 18: 1674-80 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.051
BindingDB Entry DOI: 10.7270/Q2VQ33HQ
More data for this
Ligand-Target Pair