Bioactive Compound Details
| BioID | bio199878 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL467711 |
| Molecular Formula | C15H14O3S |
| Molecular Weight | 274.34 |
| Molecular Weight (Monoisotopic) | 274.0664 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | m-Tolyl 2-phenylethenesulfonate |
| Smiles | Cc1cccc(OS(=O)(=O)/C=C/c2ccccc2)c1 |
| Inchi | InChI=1S/C15H14O3S/c1-13-6-5-9-15(12-13)18-19(16,17)11-10-14-7-3-2-4-8-14/h2-12H,1H3/b11-10+ |
| Inchi Key | SEPMQFUPDKZGIH-ZHACJKMWSA-N |
| Molecular Species | None |
| Targets | 2.0 |
| Bioactivities | 4.0 |
| Np Likeness Score | -0.78 |
| Records Key | ['1d'] |
| Records Name | ['m-tolyl 2-phenylethenesulfonate'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
