Bioactive Compound Details
| BioID | bio2340 |
|---|---|
| Name | TRAXOPRODIL MESYLATE |
| ChEMBL ID | CHEMBL3989673 |
| Molecular Formula | C21H35NO9S |
| Molecular Weight | 477.58 |
| Molecular Weight (Monoisotopic) | 327.1834 |
| Type | Small molecule |
| Max Phase | Unknown |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | CP-101,606-27|CP-101606-27|TRAXOPRODIL MESILATE HYDRATE|TRAXOPRODIL MESILATE TRIHYDRATE|TRAXOPRODIL MESYLATE|TRAXOPRODIL MESYLATE TRIHYDRATE |
| Smiles | CS(=O)(=O)O.C[C@@H]([C@@H](O)c1ccc(O)cc1)N1CCC(O)(c2ccccc2)CC1.O.O.O |
| Inchi | InChI=1S/C20H25NO3.CH4O3S.3H2O/c1-15(19(23)16-7-9-18(22)10-8-16)21-13-11-20(24,12-14-21)17-5-3-2-4-6-17;1-5(2,3)4;;;/h2-10,15,19,22-24H,11-14H2,1H3;1H3,(H,2,3,4);3*1H2/t15-,19+;;;;/m0..../s1 |
| Inchi Key | LUILKELNVBKKTG-ZOZJKLBQSA-N |
| Molecular Species | BASE |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | 0.26 |
| Records Key | ['TRAXOPRODIL MESYLATE'] |
| Records Name | ['TRAXOPRODIL MESYLATE'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
