Bioactive Compound Details
| BioID | bio197774 |
|---|---|
| Name | PHENYLASPIRINATE |
| ChEMBL ID | CHEMBL163612 |
| Molecular Formula | C15H12O4 |
| Molecular Weight | 256.26 |
| Molecular Weight (Monoisotopic) | 256.0736 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-Acetoxy-Benzoic Acid Phenyl Ester|Phenylaspirinate |
| Smiles | CC(=O)Oc1ccccc1C(=O)Oc1ccccc1 |
| Inchi | InChI=1S/C15H12O4/c1-11(16)18-14-10-6-5-9-13(14)15(17)19-12-7-3-2-4-8-12/h2-10H,1H3 |
| Inchi Key | PSBAIJVSCTZDDB-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 4.0 |
| Bioactivities | 7.0 |
| Np Likeness Score | -0.35 |
| Records Key | ['6', '15'] |
| Records Name | ['phenylaspirinate', '2-Acetoxy-benzoic acid phenyl ester'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
