Bioactive Compound Details
| BioID | bio2327 |
|---|---|
| Name | LUROSETRON MESYLATE |
| ChEMBL ID | CHEMBL3989832 |
| Molecular Formula | C18H21FN4O4S |
| Molecular Weight | 408.46 |
| Molecular Weight (Monoisotopic) | 312.1386 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | GR 87442 N|GR-87442 N|GR-87442-N|LUROSETRON MESILATE|LUROSETRON MESYLATE |
| Smiles | CS(=O)(=O)O.Cc1[nH]cnc1CN1CCc2c(c3cccc(F)c3n2C)C1=O |
| Inchi | InChI=1S/C17H17FN4O.CH4O3S/c1-10-13(20-9-19-10)8-22-7-6-14-15(17(22)23)11-4-3-5-12(18)16(11)21(14)2;1-5(2,3)4/h3-5,9H,6-8H2,1-2H3,(H,19,20);1H3,(H,2,3,4) |
| Inchi Key | BJKXXMOJBNLJJY-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -1.04 |
| Records Key | ['LUROSETRON MESYLATE'] |
| Records Name | ['LUROSETRON MESYLATE'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
