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Ligand

NameCHEMBL1082013
Molecular formulaC15H17NO2
IUPAC name(2-hydroxy-6-methylphenyl)-[(8S)-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methanone
Molecular weight243.306
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.6
SynonymsBDBM50313166
(S)-(2-hydroxy-6-methylphenyl)(2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methanone
Inchi KeyASMSNIHFROSTMQ-LBPRGKRZSA-N
Inchi IDInChI=1S/C15H17NO2/c1-10-4-2-6-13(17)14(10)15(18)11-7-9-16-8-3-5-12(11)16/h2,4,6-7,12,17H,3,5,8-9H2,1H3/t12-/m0/s1
PubChem CID46865103
ChEMBLCHEMBL1082013
IUPHARN/A
BindingDB50313166
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
13292Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
13294Kappa-type opioid receptorP34975Oprk1Rattus norvegicus (Rat)380
13293Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400

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