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Ligand

NameCHEMBL3945795
Molecular formulaC15H25NO
IUPAC name(3aS,6R,6aS,9aR,9bR)-6-ethyl-1-methyl-3,3a,4,6,6a,7,8,9,9a,9b-decahydro-2H-benzo[de]quinolin-5-one
Molecular weight235.371
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP2.6
SynonymsBDBM50204325
Inchi KeyADPMDKKBKLIPOH-KMCWBVRRSA-N
Inchi IDInChI=1S/C15H25NO/c1-3-11-12-5-4-6-13-15(12)10(9-14(11)17)7-8-16(13)2/h10-13,15H,3-9H2,1-2H3/t10-,11+,12+,13+,15+/m0/s1
PubChem CID134147144
ChEMBLCHEMBL3945795
IUPHARN/A
BindingDB50204325
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
547926Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
547928Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
547927Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400

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