Bioactive Compound Details
| BioID | bio200473 |
|---|---|
| Name | RINETERKIB |
| ChEMBL ID | CHEMBL3909517 |
| Molecular Formula | C26H27BrF3N5O2 |
| Molecular Weight | 578.43 |
| Molecular Weight (Monoisotopic) | 577.13 |
| Type | Small molecule |
| Max Phase | Phase 1 |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | RINETERKIB |
| Smiles | CNC[C@@H](NC(=O)c1ccc(-c2nc([C@H]3CC[C@H](O)[C@@H](F)C3)cnc2N)cc1F)c1cc(F)cc(Br)c1 |
| Inchi | InChI=1S/C26H27BrF3N5O2/c1-32-11-21(15-6-16(27)10-17(28)7-15)35-26(37)18-4-2-14(9-19(18)29)24-25(31)33-12-22(34-24)13-3-5-23(36)20(30)8-13/h2,4,6-7,9-10,12-13,20-21,23,32,36H,3,5,8,11H2,1H3,(H2,31,33)(H,35,37)/t13-,20-,21+,23-/m0/s1 |
| Inchi Key | YFCIFWOJYYFDQP-PTWZRHHISA-N |
| Molecular Species | BASE |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | -0.56 |
| Records Key | ['BDBM204474', 'RINETERKIB'] |
| Records Name | ['US9242996, 184', 'RINETERKIB'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
