Bioactive Compound Details
| BioID | bio2660 |
|---|---|
| Name | PERASTINE |
| ChEMBL ID | CHEMBL1742412 |
| Molecular Formula | C20H25NO |
| Molecular Weight | 295.43 |
| Molecular Weight (Monoisotopic) | 295.1936 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | PERASTINA|PERASTINE |
| Smiles | c1ccc(C(OCCN2CCCCC2)c2ccccc2)cc1 |
| Inchi | InChI=1S/C20H25NO/c1-4-10-18(11-5-1)20(19-12-6-2-7-13-19)22-17-16-21-14-8-3-9-15-21/h1-2,4-7,10-13,20H,3,8-9,14-17H2 |
| Inchi Key | ZVWXNGJQZCPYLK-UHFFFAOYSA-N |
| Molecular Species | BASE |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | -0.71 |
| Records Key | ['PERASTINE', '47'] |
| Records Name | ['PERASTINE', 'Erastin'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
