Bioactive Compound Details
| BioID | bio3499 |
|---|---|
| Name | REBASTINIB TOSYLATE |
| ChEMBL ID | CHEMBL2107833 |
| Molecular Formula | C37H36FN7O6S |
| Molecular Weight | 725.8 |
| Molecular Weight (Monoisotopic) | 553.2238 |
| Type | Small molecule |
| Max Phase | Unknown |
| Target ID | Tar18 |
| Target Name | Serine/threonine-protein kinase cot (COT) |
| Synonyms | DP-1919.TO|DP-1919.TO, DCC-2036|REBASTINIB TOSILATE|REBASTINIB TOSYLATE |
| Smiles | CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc4ncccc4c3)c(F)c2)ccn1.Cc1ccc(S(=O)(=O)O)cc1 |
| Inchi | InChI=1S/C30H28FN7O3.C7H8O3S/c1-30(2,3)26-17-27(38(37-26)19-7-9-23-18(14-19)6-5-12-33-23)36-29(40)35-24-10-8-20(15-22(24)31)41-21-11-13-34-25(16-21)28(39)32-4;1-6-2-4-7(5-3-6)11(8,9)10/h5-17H,1-4H3,(H,32,39)(H2,35,36,40);2-5H,1H3,(H,8,9,10) |
| Inchi Key | ARPBZBAWXAVDCE-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -1.85 |
| Records Key | ['REBASTINIB TOSYLATE'] |
| Records Name | ['REBASTINIB TOSYLATE'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
