Bioactive Compound Details
| BioID | bio2330 |
|---|---|
| Name | PELECOPAN |
| ChEMBL ID | CHEMBL5314435 |
| Molecular Formula | C23H19FN2O4 |
| Molecular Weight | 406.41 |
| Molecular Weight (Monoisotopic) | 406.1329 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | PELECOPAN |
| Smiles | NCc1nccc(-c2cc(COc3ccccc3CC(=O)O)cc3ccoc23)c1F |
| Inchi | InChI=1S/C23H19FN2O4/c24-22-17(5-7-26-19(22)12-25)18-10-14(9-16-6-8-29-23(16)18)13-30-20-4-2-1-3-15(20)11-21(27)28/h1-10H,11-13,25H2,(H,27,28) |
| Inchi Key | AUARNXJEAZFQCQ-UHFFFAOYSA-N |
| Molecular Species | ACID |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -0.13 |
| Records Key | ['PELECOPAN'] |
| Records Name | ['PELECOPAN'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
