| BioID | bio199891 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL165235 |
|---|
| Molecular Formula | C11H12O6S |
|---|
| Molecular Weight | 272.28 |
|---|
| Molecular Weight (Monoisotopic) | 272.0355 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-Acetoxy-Benzoic Acid Methanesulfonylmethyl Ester |
|---|
| Smiles | CC(=O)Oc1ccccc1C(=O)OCS(C)(=O)=O |
|---|
| Inchi | InChI=1S/C11H12O6S/c1-8(12)17-10-6-4-3-5-9(10)11(13)16-7-18(2,14)15/h3-6H,7H2,1-2H3 |
|---|
| Inchi Key | PTLSEGBRIAKFIJ-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 8.0 |
|---|
| Np Likeness Score | -0.35 |
|---|
| Records Key | ['20'] |
|---|
| Records Name | ['2-Acetoxy-benzoic acid methanesulfonylmethyl ester'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
