EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H26N8O2 |
| Net Charge | 0 |
| Average Mass | 458.526 |
| Monoisotopic Mass | 458.21787 |
| SMILES | [H][C@]12CN(C(C)C)[C@]([H])(CN1c1ccc(Nc3ncc(-c4coc(C(N)=O)c4)n4ncnc34)cc1)C2 |
| InChI | InChI=1S/C24H26N8O2/c1-14(2)30-10-19-8-18(30)11-31(19)17-5-3-16(4-6-17)29-23-24-27-13-28-32(24)20(9-26-23)15-7-21(22(25)33)34-12-15/h3-7,9,12-14,18-19H,8,10-11H2,1-2H3,(H2,25,33)(H,26,29)/t18-,19-/m0/s1 |
| InChIKey | YBFGSJUVEOYPIS-OALUTQOASA-N |
| Roles Classification |
|---|
| Application: | antirheumatic drug A drug used to treat rheumatoid arthritis. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| glpg-0259 (CHEBI:758615) has role antirheumatic drug (CHEBI:35842) |
| glpg-0259 (CHEBI:758615) is a piperazines (CHEBI:26144) |
| Synonyms | Source |
|---|---|
| GLPG-0259 | ChEMBL |
| GLPG0259 | ChEMBL |