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Ligand

NameSCHEMBL1717368
Molecular formulaC24H24FN3O2
IUPAC name[(2R,5R)-5-[(5-fluoropyridin-2-yl)oxymethyl]-2-methylpiperidin-1-yl]-(3-phenylpyridin-2-yl)methanone
Molecular weight405.473
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.5
SynonymsCHEMBL3655682
BDBM104709
US8569311, 1-38
Inchi KeySRNAGDGPIQRAFX-QZTJIDSGSA-N
Inchi IDInChI=1S/C24H24FN3O2/c1-17-9-10-18(16-30-22-12-11-20(25)14-27-22)15-28(17)24(29)23-21(8-5-13-26-23)19-6-3-2-4-7-19/h2-8,11-14,17-18H,9-10,15-16H2,1H3/t17-,18-/m1/s1
PubChem CID59396047
ChEMBLCHEMBL3655682
IUPHARN/A
BindingDB104709
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
321457Orexin receptor type 1P56718Hcrtr1Rattus norvegicus (Rat)416
321456Orexin receptor type 2P56719Hcrtr2Rattus norvegicus (Rat)460

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