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Ligand

NameCHEMBL2207678
Molecular formulaC22H27NO2
IUPAC name15-(cyclopropylmethyl)-4-hydroxy-15-azapentacyclo[9.6.2.01,9.02,7.09,14]nonadeca-2(7),3,5-trien-19-one
Molecular weight337.463
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.1
SynonymsBDBM50402138
Inchi KeyBQPOPACASUDVEO-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H27NO2/c24-17-5-3-15-10-22-11-16-4-6-20(22)23(13-14-1-2-14)8-7-21(22,12-19(16)25)18(15)9-17/h3,5,9,14,16,20,24H,1-2,4,6-8,10-13H2
PubChem CID71452534
ChEMBLCHEMBL2207678
IUPHARN/A
BindingDB50402138
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
30531Delta-type opioid receptorP32300Oprd1Mus musculus (Mouse)372
30529Kappa-type opioid receptorP33534Oprk1Mus musculus (Mouse)380
30530Mu-type opioid receptorP97266OPRM1Cavia porcellus (Guinea pig)98

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