Bioactive Compound Details
| BioID | bio2339 |
|---|---|
| Name | OCTASTINE |
| ChEMBL ID | CHEMBL1742407 |
| Molecular Formula | C23H30ClNO |
| Molecular Weight | 371.95 |
| Molecular Weight (Monoisotopic) | 371.2016 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | OCTASTINA|OCTASTINE |
| Smiles | CC(OCCN1CCCCCCC1)(c1ccccc1)c1ccc(Cl)cc1 |
| Inchi | InChI=1S/C23H30ClNO/c1-23(20-10-6-5-7-11-20,21-12-14-22(24)15-13-21)26-19-18-25-16-8-3-2-4-9-17-25/h5-7,10-15H,2-4,8-9,16-19H2,1H3 |
| Inchi Key | UTJCUSNUTZBJBU-UHFFFAOYSA-N |
| Molecular Species | BASE |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -0.81 |
| Records Key | ['OCTASTINE'] |
| Records Name | ['OCTASTINE'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
