Bioactive Compound Details
| BioID | bio3193 |
|---|---|
| Name | ZALUNFIBAN ACETATE |
| ChEMBL ID | CHEMBL4802247 |
| Molecular Formula | C18H22N8O4S |
| Molecular Weight | 446.49 |
| Molecular Weight (Monoisotopic) | 386.1273 |
| Type | Small molecule |
| Max Phase | Phase 1 |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | RUC-4 acetate|ZALUNFIBAN ACETATE |
| Smiles | CC(=O)O.NCC(=O)Nc1cncc(-c2nn3c(=O)cc(N4CCNCC4)nc3s2)c1 |
| Inchi | InChI=1S/C16H18N8O2S.C2H4O2/c17-7-13(25)20-11-5-10(8-19-9-11)15-22-24-14(26)6-12(21-16(24)27-15)23-3-1-18-2-4-23;1-2(3)4/h5-6,8-9,18H,1-4,7,17H2,(H,20,25);1H3,(H,3,4) |
| Inchi Key | UJGNATZMWUYIRZ-UHFFFAOYSA-N |
| Molecular Species | BASE |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -2.3 |
| Records Key | ['ZALUNFIBAN ACETATE'] |
| Records Name | ['ZALUNFIBAN ACETATE'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
