Bioactive Compound Details
| BioID | bio1972 |
|---|---|
| Name | ANIZATRECTINIB |
| ChEMBL ID | CHEMBL5095088 |
| Molecular Formula | C29H32FN7O2 |
| Molecular Weight | 529.62 |
| Molecular Weight (Monoisotopic) | 529.2602 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | ANIZATRECTINIB|ANIZATRECTINIB |
| Smiles | COCCN1C[C@@H](NC(=O)Nc2c(C)c(-c3cnc(C)nc3)nn2-c2ccccc2)[C@H](c2cccc(F)c2)C1 |
| Inchi | InChI=1S/C29H32FN7O2/c1-19-27(22-15-31-20(2)32-16-22)35-37(24-10-5-4-6-11-24)28(19)34-29(38)33-26-18-36(12-13-39-3)17-25(26)21-8-7-9-23(30)14-21/h4-11,14-16,25-26H,12-13,17-18H2,1-3H3,(H2,33,34,38)/t25-,26+/m0/s1 |
| Inchi Key | BGKSBHPSVMJTFL-IZZNHLLZSA-N |
| Molecular Species | NEUTRAL |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -1.5 |
| Records Key | ['ANIZATRECTINIB'] |
| Records Name | ['ANIZATRECTINIB'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
