Bioactive Compound Details
| BioID | bio3473 |
|---|---|
| Name | VARLITINIB TOSYLATE |
| ChEMBL ID | CHEMBL2105679 |
| Molecular Formula | C36H35ClN6O8S3 |
| Molecular Weight | 811.36 |
| Molecular Weight (Monoisotopic) | 466.0979 |
| Type | Small molecule |
| Max Phase | Unknown |
| Target ID | Tar18 |
| Target Name | Serine/threonine-protein kinase cot (COT) |
| Synonyms | AR00334543|AR00334543 ARRY-334543 ARRY-543|AR00334543 DITOSILATE|ARRY-334543|ARRY-334543 DITOSILATE|ARRY-543|ARRY-543 DITOSILATE|VARLITINIB TOSILATE|VARLITINIB TOSYLATE |
| Smiles | C[C@@H]1COC(Nc2ccc3ncnc(Nc4ccc(OCc5nccs5)c(Cl)c4)c3c2)=N1.Cc1ccc(S(=O)(=O)O)cc1.Cc1ccc(S(=O)(=O)O)cc1 |
| Inchi | InChI=1S/C22H19ClN6O2S.2C7H8O3S/c1-13-10-31-22(27-13)29-14-2-4-18-16(8-14)21(26-12-25-18)28-15-3-5-19(17(23)9-15)30-11-20-24-6-7-32-20;2*1-6-2-4-7(5-3-6)11(8,9)10/h2-9,12-13H,10-11H2,1H3,(H,27,29)(H,25,26,28);2*2-5H,1H3,(H,8,9,10)/t13-;;/m1../s1 |
| Inchi Key | QSUPQMGDXOHVLK-FFXKMJQXSA-N |
| Molecular Species | NEUTRAL |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -1.34 |
| Records Key | ['VARLITINIB TOSYLATE'] |
| Records Name | ['VARLITINIB TOSYLATE'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
