Bioactive Compound Details
| BioID | bio197091 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL145364 |
| Molecular Formula | C9H10O2S |
| Molecular Weight | 182.24 |
| Molecular Weight (Monoisotopic) | 182.0402 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | Acetic Acid 2-Methylsulfanyl-Phenyl Ester |
| Smiles | CSc1ccccc1OC(C)=O |
| Inchi | InChI=1S/C9H10O2S/c1-7(10)11-8-5-3-4-6-9(8)12-2/h3-6H,1-2H3 |
| Inchi Key | AVQLMCFSPDGCKF-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | -0.46 |
| Records Key | ['36'] |
| Records Name | ['Acetic acid 2-methylsulfanyl-phenyl ester'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
