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Ligand

NameCHEMBL1079942
Molecular formulaC26H36N4O2
IUPAC name2-[8-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-4-oxo-1-phenyl-2,3,8-triazaspiro[4.5]dec-1-en-3-yl]-N-methylacetamide
Molecular weight436.6
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.5
SynonymsBDBM50311479
2-(8-(decahydronaphthalen-2-yl)-1-oxo-4-phenyl-2,3,8-triazaspiro[4.5]dec-3-en-2-yl)-N-methylacetamide
Inchi KeyAMSDLHMBLLSAKF-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H36N4O2/c1-27-23(31)18-30-25(32)26(24(28-30)20-8-3-2-4-9-20)13-15-29(16-14-26)22-12-11-19-7-5-6-10-21(19)17-22/h2-4,8-9,19,21-22H,5-7,10-18H2,1H3,(H,27,31)
PubChem CID46879669
ChEMBLCHEMBL1079942
IUPHARN/A
BindingDB50311479
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
9192Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
9191Nociceptin receptorP41146OPRL1Homo sapiens (Human)370

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