Bioactive Compound Details
| BioID | bio197654 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL143339 |
| Molecular Formula | C15H22O2S |
| Molecular Weight | 266.41 |
| Molecular Weight (Monoisotopic) | 266.1341 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | Acetic Acid 2-Heptylsulfanyl-Phenyl Ester |
| Smiles | CCCCCCCSc1ccccc1OC(C)=O |
| Inchi | InChI=1S/C15H22O2S/c1-3-4-5-6-9-12-18-15-11-8-7-10-14(15)17-13(2)16/h7-8,10-11H,3-6,9,12H2,1-2H3 |
| Inchi Key | FBOXARNCZRHBOP-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | -0.4 |
| Records Key | ['46'] |
| Records Name | ['Acetic acid 2-heptylsulfanyl-phenyl ester'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
