| BioID | bio200281 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL163172 |
|---|
| Molecular Formula | C11H12O4S |
|---|
| Molecular Weight | 240.28 |
|---|
| Molecular Weight (Monoisotopic) | 240.0456 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | Acrylic Acid 2-Benzenesulfonyl-Ethyl Ester |
|---|
| Smiles | C=CC(=O)OCCS(=O)(=O)c1ccccc1 |
|---|
| Inchi | InChI=1S/C11H12O4S/c1-2-11(12)15-8-9-16(13,14)10-6-4-3-5-7-10/h2-7H,1,8-9H2 |
|---|
| Inchi Key | AUKCYWLEGLBNMB-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 1.0 |
|---|
| Bioactivities | 1.0 |
|---|
| Np Likeness Score | -0.86 |
|---|
| Records Key | ['14'] |
|---|
| Records Name | ['Acrylic acid 2-benzenesulfonyl-ethyl ester'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
