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Ligand

NameCHEMBL3893150
Molecular formulaC22H20FN7O3
IUPAC name[2-[[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,3-oxazinan-3-yl]-[6-methyl-3-(triazol-2-yl)pyridin-2-yl]methanone
Molecular weight449.446
Hydrogen bond acceptor9
Hydrogen bond donor0
XlogP3.1
SynonymsSCHEMBL16648847
US9266870, 38
BDBM208522
Inchi KeyABQUTJKCXJRSSO-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H20FN7O3/c1-14-3-8-17(30-24-9-10-25-30)20(26-14)22(31)29-11-2-12-32-19(29)13-18-27-21(33-28-18)15-4-6-16(23)7-5-15/h3-10,19H,2,11-13H2,1H3
PubChem CID72704197
ChEMBLCHEMBL3893150
IUPHARN/A
BindingDB208522
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
535941Orexin receptor type 1O43613HCRTR1Homo sapiens (Human)425
535940Orexin receptor type 2O43614HCRTR2Homo sapiens (Human)444

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