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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 = 'BDBM50123278'   
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


(Rattus norvegicus (rat))
BDBM50123278
PNG
(19-cyclopropylmethyl-6-cyano-11-oxa-8,19-diazahexa...)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@@H](Oc1c24)c1ncc(cc1C[C@@]35O)C#N
Show InChI InChI=1S/C24H23N3O3/c25-10-14-7-16-9-24(29)18-8-15-3-4-17(28)21-19(15)23(24,22(30-21)20(16)26-11-14)5-6-27(18)12-13-1-2-13/h3-4,7,11,13,18,22,28-29H,1-2,5-6,8-9,12H2/t18-,22+,23+,24-/m1/s1
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PubMed
16n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Binding affinity to mu opioid receptor was measured using [3H]DAMGO


Bioorg Med Chem Lett 13: 529-32 (2003)


BindingDB Entry DOI: 10.7270/Q27S7P9P
More data for this
Ligand-Target Pair