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Name | MLS000122379 |
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Molecular formula | C18H19N3O2 |
IUPAC name | 2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)-N-(2-phenylethyl)acetamide |
Molecular weight | 309.369 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 3 |
XlogP | 2.1 |
Synonyms | BDBM96593 MolPort-000-685-080 Z31269343 2-(3-oxo-1,2,3,4-tetrahydro-2-quinoxalinyl)-N-(2-phenylethyl)acetamide 2-(3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)-N-phenethyl-acetamide [ Show all ] |
Inchi Key | ALYVOKZTHSTUAG-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H19N3O2/c22-17(19-11-10-13-6-2-1-3-7-13)12-16-18(23)21-15-9-5-4-8-14(15)20-16/h1-9,16,20H,10-12H2,(H,19,22)(H,21,23) |
PubChem CID | 3155914 |
ChEMBL | CHEMBL1337758 |
IUPHAR | N/A |
BindingDB | 96593 |
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 |
---|---|---|---|---|---|
8675 | Trace amine-associated receptor 1 | Q96RJ0 | TAAR1 | Homo sapiens (Human) | 339 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218