Bioactive Compound Details
| BioID | bio198889 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL574459 |
| Molecular Formula | C13H18O3 |
| Molecular Weight | 222.28 |
| Molecular Weight (Monoisotopic) | 222.1256 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 4-(2-Butoxyethoxy)Benzaldehyde |
| Smiles | CCCCOCCOc1ccc(C=O)cc1 |
| Inchi | InChI=1S/C13H18O3/c1-2-3-8-15-9-10-16-13-6-4-12(11-14)5-7-13/h4-7,11H,2-3,8-10H2,1H3 |
| Inchi Key | LXFUAPGMBNAONH-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | -0.53 |
| Records Key | ['2a'] |
| Records Name | ['4-(2-Butoxyethoxy)benzaldehyde'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
