Bioactive Compound Details
| BioID | bio197434 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL498661 |
| Molecular Formula | C16H16O2 |
| Molecular Weight | 240.3 |
| Molecular Weight (Monoisotopic) | 240.115 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 3-Methylbenzyl 2'-Methylbenzoate |
| Smiles | Cc1cccc(COC(=O)c2ccccc2C)c1 |
| Inchi | InChI=1S/C16H16O2/c1-12-6-5-8-14(10-12)11-18-16(17)15-9-4-3-7-13(15)2/h3-10H,11H2,1-2H3 |
| Inchi Key | XEKPWFXKVXSPHZ-UHFFFAOYSA-N |
| Molecular Species | None |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | -0.98 |
| Records Key | ['28'] |
| Records Name | [3-Methylbenzyl 2'-methylbenzoate"]" |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
