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Ligand

NameSCHEMBL4540837
Molecular formulaC25H25FN2O3
IUPAC name6-(2,6-dimethoxyphenyl)-1-[(2-fluoro-3-pyridin-2-ylphenyl)methyl]piperidin-2-one
Molecular weight420.484
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.8
SynonymsCHEMBL3912462
BDBM202894
6-(2,6-dimethoxyphenyl)-1-(2-fluoro-3-(pyridin-2-yl)benzyl)piperidin-2-one
US9242970, 37
AGDHLORZIGVLKC-UHFFFAOYSA-N
Inchi KeyAGDHLORZIGVLKC-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H25FN2O3/c1-30-21-12-7-13-22(31-2)24(21)20-11-6-14-23(29)28(20)16-17-8-5-9-18(25(17)26)19-10-3-4-15-27-19/h3-5,7-10,12-13,15,20H,6,11,14,16H2,1-2H3
PubChem CID69084725
ChEMBLCHEMBL3912462
IUPHARN/A
BindingDB202894
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
536056Orexin receptor type 1O43613HCRTR1Homo sapiens (Human)425
536055Orexin receptor type 2O43614HCRTR2Homo sapiens (Human)444

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