Bioactive Compound Details
| BioID | bio197676 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL144850 |
| Molecular Formula | C16H24O2S |
| Molecular Weight | 280.43 |
| Molecular Weight (Monoisotopic) | 280.1497 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | Acetic Acid 2-Octylsulfanyl-Phenyl Ester |
| Smiles | CCCCCCCCSc1ccccc1OC(C)=O |
| Inchi | InChI=1S/C16H24O2S/c1-3-4-5-6-7-10-13-19-16-12-9-8-11-15(16)18-14(2)17/h8-9,11-12H,3-7,10,13H2,1-2H3 |
| Inchi Key | SBJSBSXQBVJXCR-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | -0.38 |
| Records Key | ['47'] |
| Records Name | ['Acetic acid 2-octylsulfanyl-phenyl ester'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
