Bioactive Compound Details
| BioID | bio198619 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL506779 |
| Molecular Formula | C16H16O3 |
| Molecular Weight | 256.3 |
| Molecular Weight (Monoisotopic) | 256.1099 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 3-Methylbenzyl 2'-Methoxybenzoate |
| Smiles | COc1ccccc1C(=O)OCc1cccc(C)c1 |
| Inchi | InChI=1S/C16H16O3/c1-12-6-5-7-13(10-12)11-19-16(17)14-8-3-4-9-15(14)18-2/h3-10H,11H2,1-2H3 |
| Inchi Key | XVFIGGCUVDQCRE-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | -0.8 |
| Records Key | ['31'] |
| Records Name | [3-Methylbenzyl 2'-methoxybenzoate"]" |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
