Bioactive Compound Details
| BioID | bio197327 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL195861 |
| Molecular Formula | C6H12O |
| Molecular Weight | 100.16 |
| Molecular Weight (Monoisotopic) | 100.0888 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | Hexan-2-one |
| Smiles | CCCCC(C)=O |
| Inchi | InChI=1S/C6H12O/c1-3-4-5-6(2)7/h3-5H2,1-2H3 |
| Inchi Key | QQZOPKMRPOGIEB-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | 0.61 |
| Records Key | ['2-Hexanone'] |
| Records Name | ['Hexan-2-one'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
