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Ligand

NameM3Pr6S
Molecular formulaC20H23NO7S
IUPAC name[(4R,4aR,7S,7aR,12bS)-3-methyl-9-propanoyloxy-1,2,3,4,4a,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-yl] sulfate
Molecular weight421.464
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP-1.4
SynonymsCHEMBL385048
BDBM50189256
Inchi KeyLWKYBVFQVUJKDT-ILIJTDRLSA-N
Inchi IDInChI=1S/C20H23NO7S/c1-3-16(22)26-14-6-4-11-10-13-12-5-7-15(28-29(23,24)25)19-20(12,8-9-21(13)2)17(11)18(14)27-19/h4-7,12-13,15,19H,3,8-10H2,1-2H3,(H,23,24,25)/t12-,13+,15-,19-,20-/m0/s1
PubChem CID44414843
ChEMBLCHEMBL385048
IUPHARN/A
BindingDB50189256
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
198132Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
198131Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380
198135Mu-type opioid receptorP97266OPRM1Cavia porcellus (Guinea pig)98
198133Nociceptin receptorP47748OPRL1Cavia porcellus (Guinea pig)370

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