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Name | SCHEMBL1716476 |
---|---|
Molecular formula | C21H21F2N5O2 |
IUPAC name | [(2R,5R)-5-[(5-fluoropyridin-2-yl)oxymethyl]-2-methylpiperidin-1-yl]-[5-fluoro-2-(triazol-2-yl)phenyl]methanone |
Molecular weight | 413.429 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 0 |
XlogP | 3.7 |
Synonyms | US8569311, 1-8 CHEMBL3655672 BDBM104699 |
Inchi Key | PGLITYXHMZQGDR-HUUCEWRRSA-N |
Inchi ID | InChI=1S/C21H21F2N5O2/c1-14-2-3-15(13-30-20-7-5-17(23)11-24-20)12-27(14)21(29)18-10-16(22)4-6-19(18)28-25-8-9-26-28/h4-11,14-15H,2-3,12-13H2,1H3/t14-,15-/m1/s1 |
PubChem CID | 25125517 |
ChEMBL | CHEMBL3655672 |
IUPHAR | N/A |
BindingDB | 104699 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
259187 | Orexin receptor type 1 | P56718 | Hcrtr1 | Rattus norvegicus (Rat) | 416 |
259186 | Orexin receptor type 2 | P56719 | Hcrtr2 | Rattus norvegicus (Rat) | 460 |
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