Bioactive Compound Details
| BioID | bio199768 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL145598 |
| Molecular Formula | C16H24O2 |
| Molecular Weight | 248.37 |
| Molecular Weight (Monoisotopic) | 248.1776 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | Acetic Acid 2-Octyl-Phenyl Ester |
| Smiles | CCCCCCCCc1ccccc1OC(C)=O |
| Inchi | InChI=1S/C16H24O2/c1-3-4-5-6-7-8-11-15-12-9-10-13-16(15)18-14(2)17/h9-10,12-13H,3-8,11H2,1-2H3 |
| Inchi Key | QIVYOZULGVIRKZ-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 0.33 |
| Records Key | ['116'] |
| Records Name | ['Acetic acid 2-octyl-phenyl ester'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
