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Ligand

NameMorphinan-3,6.alpha.-diol, 7,8-didehydro-4,5.alpha.-epoxy-17-methyl-
Molecular formulaC17H19NO3
IUPAC name3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol
Molecular weight285.343
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP0.8
SynonymsBDBM86258
SCHEMBL10031250
(5.alpha.,6.alpha.)-7,8-Didehydro-4,5-epoxy-17-methylmorphinan-3,6-diol
4-methyl-12-oxa-4-azapentacyclo[9.6.1.0;{1,13}.0;{5,17}.0;{7,18}]octadeca-7(18),8,10,15-tetraene-10,14-diol
Kadain
[ Show all ]
Inchi KeyBQJCRHHNABKAKU-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3
PubChem CID4253
ChEMBLN/A
IUPHARN/A
BindingDB86258
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: 13
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
30369Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
30371Delta-type opioid receptorP33533Oprd1Rattus norvegicus (Rat)372
30364Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
30366Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380
30367Kappa-type opioid receptorP34975Oprk1Rattus norvegicus (Rat)380
30370Kappa-type opioid receptorQ2KIP6OPRK1Bos taurus (Bovine)380
30362Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
30363Mu-type opioid receptorP42866Oprm1Mus musculus (Mouse)398
30365Mu-type opioid receptorP97266OPRM1Cavia porcellus (Guinea pig)98
30368Mu-type opioid receptorP79350OPRM1Bos taurus (Bovine)401
30372Mu-type opioid receptorP33535Oprm1Rattus norvegicus (Rat)398
459476Nociceptin receptorP41146OPRL1Homo sapiens (Human)370
555597Nociceptin receptorP35377Oprl1Mus musculus (Mouse)367

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