Bioactive Compound Details
| BioID | bio199254 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL43487 |
| Molecular Formula | C5H10O3S |
| Molecular Weight | 150.2 |
| Molecular Weight (Monoisotopic) | 150.0351 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | Acetic Acid 2-Methanesulfinyl-Ethyl Ester |
| Smiles | CC(=O)OCC[S+](C)[O-] |
| Inchi | InChI=1S/C5H10O3S/c1-5(6)8-3-4-9(2)7/h3-4H2,1-2H3 |
| Inchi Key | PCVRIGJDAJCDGW-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 4.0 |
| Np Likeness Score | 0.74 |
| Records Key | ['IVA'] |
| Records Name | ['Acetic acid 2-methanesulfinyl-ethyl ester'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
