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Ligand

NameCHEMBL143800
Molecular formulaC23H25NO3
IUPAC name(8E)-5-(3-hydroxyphenyl)-8-[(4-methoxyphenyl)methylidene]-2-methyl-2-azabicyclo[3.3.1]nonan-7-one
Molecular weight363.457
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.6
SynonymsBDBM50029786
5-(3-Hydroxy-phenyl)-8-[1-(4-methoxy-phenyl)-meth-(E)-ylidene]-2-methyl-2-aza-bicyclo[3.3.1]nonan-7-one
Inchi KeyABVYYLMONIBFMA-UDWIEESQSA-N
Inchi IDInChI=1S/C23H25NO3/c1-24-11-10-23(17-4-3-5-18(25)13-17)14-21(24)20(22(26)15-23)12-16-6-8-19(27-2)9-7-16/h3-9,12-13,21,25H,10-11,14-15H2,1-2H3/b20-12+
PubChem CID10713756
ChEMBLCHEMBL143800
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1230Delta-type opioid receptorP33533Oprd1Rattus norvegicus (Rat)372
1231Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380
1229Mu-type opioid receptorP33535Oprm1Rattus norvegicus (Rat)398

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