Bioactive Compound Details
| BioID | bio2458 |
|---|---|
| Name | RICASETRON |
| ChEMBL ID | CHEMBL2105377 |
| Molecular Formula | C19H27N3O |
| Molecular Weight | 313.44 |
| Molecular Weight (Monoisotopic) | 313.2154 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | BRL-46470|RICASETRON |
| Smiles | CN1[C@@H]2CC[C@H]1C[C@@H](NC(=O)N1CC(C)(C)c3ccccc31)C2 |
| Inchi | InChI=1S/C19H27N3O/c1-19(2)12-22(17-7-5-4-6-16(17)19)18(23)20-13-10-14-8-9-15(11-13)21(14)3/h4-7,13-15H,8-12H2,1-3H3,(H,20,23)/t13-,14+,15- |
| Inchi Key | ILXWRFDRNAKTDD-QDMKHBRRSA-N |
| Molecular Species | BASE |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -0.33 |
| Records Key | ['RICASETRON'] |
| Records Name | ['RICASETRON'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
