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Ligand

NameCHEMBL353990
Molecular formulaC21H31N3O
IUPAC name8-cyclooctyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Molecular weight341.499
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP4.2
SynonymsBDBM50087684
1-Phenyl-8-cyclooctyl-1,3,8-triazaspiro[4.5]decane-4-one
8-Cyclooctyl-1-phenyl-1,3,8-triaza-spiro[4.5]decan-4-one
Inchi KeyAHAGYUFSJZMVFM-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H31N3O/c25-20-21(24(17-22-20)19-11-7-4-8-12-19)13-15-23(16-14-21)18-9-5-2-1-3-6-10-18/h4,7-8,11-12,18H,1-3,5-6,9-10,13-17H2,(H,22,25)
PubChem CID19347402
ChEMBLCHEMBL353990
IUPHARN/A
BindingDB50087684
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5385Delta-type opioid receptorP33533Oprd1Rattus norvegicus (Rat)372
5384Kappa-type opioid receptorP34975Oprk1Rattus norvegicus (Rat)380
5387Mu-type opioid receptorP33535Oprm1Rattus norvegicus (Rat)398
5386Nociceptin receptorP35370Oprl1Rattus norvegicus (Rat)367

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