EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H27ClFN7O4S |
| Net Charge | 0 |
| Average Mass | 540.021 |
| Monoisotopic Mass | 539.15178 |
| SMILES | [H][C@](C)(CNc1nccc(-c2cn(C(C)C)nc2-c2cc(Cl)cc(NS(C)(=O)=O)c2F)n1)NC(=O)OC |
| InChI | InChI=1S/C22H27ClFN7O4S/c1-12(2)31-11-16(17-6-7-25-21(28-17)26-10-13(3)27-22(32)35-4)20(29-31)15-8-14(23)9-18(19(15)24)30-36(5,33)34/h6-9,11-13,30H,10H2,1-5H3,(H,27,32)(H,25,26,28)/t13-/m0/s1 |
| InChIKey | CMJCXYNUCSMDBY-ZDUSSCGKSA-N |
| Roles Classification |
|---|
| Application: | antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| encorafenib (CHEBI:755294) has role antineoplastic agent (CHEBI:35610) |
| encorafenib (CHEBI:755294) is a pyrazoles (CHEBI:26410) |
| encorafenib (CHEBI:755294) is a ring assembly (CHEBI:36820) |
| Synonyms | Source |
|---|---|
| Encorafenib | ChEMBL |
| Lgx-818 | ChEMBL |
| Lgx818 | ChEMBL |
| NVP-LGX818 | ChEMBL |
| NVP-LGX-818-NXA | ChEMBL |
| NVP-LGX818-NXA | ChEMBL |
| Brand Name | Source |
|---|---|
| Braftovi | ChEMBL |
| Citations |
|---|