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Ligand

NameDM6S
Molecular formulaC17H21NO6S
IUPAC name[(4R,4aR,7S,7aR,12bS)-9-hydroxy-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl] hydrogen sulfate
Molecular weight367.416
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP-0.8
SynonymsD0D6OA
CHEMBL385448
Inchi KeyQTALQTUQMLSRSG-KBQPJGBKSA-N
Inchi IDInChI=1S/C17H21NO6S/c1-18-7-6-17-10-3-5-13(24-25(20,21)22)16(17)23-15-12(19)4-2-9(14(15)17)8-11(10)18/h2,4,10-11,13,16,19H,3,5-8H2,1H3,(H,20,21,22)/t10-,11+,13-,16-,17-/m0/s1
PubChem CID44414784
ChEMBLCHEMBL385448
IUPHARN/A
BindingDB50189258
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
286190Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
286191Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380
286193Mu-type opioid receptorP97266OPRM1Cavia porcellus (Guinea pig)98
286192Nociceptin receptorP47748OPRL1Cavia porcellus (Guinea pig)370

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