Bioactive Compound Details
| BioID | bio2563 |
|---|---|
| Name | VENRITIDINE |
| ChEMBL ID | CHEMBL3989699 |
| Molecular Formula | C18H26N4O3S |
| Molecular Weight | 378.5 |
| Molecular Weight (Monoisotopic) | 378.1726 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | VENRITIDINA|VENRITIDINE |
| Smiles | CN/C(=C/[N+](=O)[O-])NCCSCc1ccc(CNC2C3CC4C(C3)C42)o1 |
| Inchi | InChI=1S/C18H26N4O3S/c1-19-16(9-22(23)24)20-4-5-26-10-13-3-2-12(25-13)8-21-18-11-6-14-15(7-11)17(14)18/h2-3,9,11,14-15,17-21H,4-8,10H2,1H3/b16-9- |
| Inchi Key | NIEBFIZWKXFMDD-SXGWCWSVSA-N |
| Molecular Species | BASE |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -0.56 |
| Records Key | ['VENRITIDINE'] |
| Records Name | ['VENRITIDINE'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
