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Ligand

NameCHEMBL3663458
Molecular formulaC21H25N3O3
IUPAC name(2-ethoxy-4-methylpyridin-3-yl)-[2-(pyridin-2-yloxymethyl)-7-azabicyclo[2.2.1]heptan-7-yl]methanone
Molecular weight367.449
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.3
SynonymsBDBM164024
SCHEMBL16040195
US9062078, 155
Inchi KeyFZMWFGXVRUFCCE-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H25N3O3/c1-3-26-20-19(14(2)9-11-23-20)21(25)24-16-7-8-17(24)15(12-16)13-27-18-6-4-5-10-22-18/h4-6,9-11,15-17H,3,7-8,12-13H2,1-2H3
PubChem CID90411865
ChEMBLCHEMBL3663458
IUPHARN/A
BindingDB164024
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
517799Orexin receptor type 1P56718Hcrtr1Rattus norvegicus (Rat)416
474143Orexin receptor type 2O43614HCRTR2Homo sapiens (Human)444

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