Bioactive Compound Details
| BioID | bio2087 |
|---|---|
| Name | SUFOTIDINE |
| ChEMBL ID | CHEMBL2105496 |
| Molecular Formula | C20H31N5O3S |
| Molecular Weight | 421.57 |
| Molecular Weight (Monoisotopic) | 421.2148 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | AH 25352X|AH-25352X|SUFOTIDINA|SUFOTIDINE |
| Smiles | Cn1nc(CS(C)(=O)=O)nc1NCCCOc1cccc(CN2CCCCC2)c1 |
| Inchi | InChI=1S/C20H31N5O3S/c1-24-20(22-19(23-24)16-29(2,26)27)21-10-7-13-28-18-9-6-8-17(14-18)15-25-11-4-3-5-12-25/h6,8-9,14H,3-5,7,10-13,15-16H2,1-2H3,(H,21,22,23) |
| Inchi Key | JEYKZWRXDALMNG-UHFFFAOYSA-N |
| Molecular Species | BASE |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -1.59 |
| Records Key | ['SUFOTIDINE'] |
| Records Name | ['SUFOTIDINE'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
