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Name | IPSU |
---|---|
Molecular formula | C23H27N5O2 |
IUPAC name | 2-(1H-indol-3-ylmethyl)-9-(4-methoxypyrimidin-2-yl)-2,9-diazaspiro[5.5]undecan-1-one |
Molecular weight | 405.502 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 2.8 |
Synonyms | AKOS027470240 MolPort-039-338-071 2,9-Diazaspiro[5.5]undecan-1-one, 2-(1H-indol-3-ylMethyl)-9-(4-Methoxy-2-pyriMidinyl)- CHEMBL2435402 ZINC96285053 [ Show all ] |
Inchi Key | PCMHOSYCWRRHTG-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H27N5O2/c1-30-20-7-11-24-22(26-20)27-13-9-23(10-14-27)8-4-12-28(21(23)29)16-17-15-25-19-6-3-2-5-18(17)19/h2-3,5-7,11,15,25H,4,8-10,12-14,16H2,1H3 |
PubChem CID | 56970858 |
ChEMBL | CHEMBL2435402 |
IUPHAR | N/A |
BindingDB | 50441375 |
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 |
---|---|---|---|---|---|
256423 | Orexin receptor type 1 | P58307 | Hcrtr1 | Mus musculus (Mouse) | 416 |
256426 | Orexin receptor type 1 | O43613 | HCRTR1 | Homo sapiens (Human) | 425 |
256424 | Orexin receptor type 2 | O43614 | HCRTR2 | Homo sapiens (Human) | 444 |
256425 | Orexin receptor type 2 | P58308 | Hcrtr2 | Mus musculus (Mouse) | 460 |
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