| BioID | bio198785 |
|---|
| Name | BUTANONE |
|---|
| ChEMBL ID | CHEMBL15849 |
|---|
| Molecular Formula | C4H8O |
|---|
| Molecular Weight | 72.11 |
|---|
| Molecular Weight (Monoisotopic) | 72.0575 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | Butan-2-One|Butanone |
|---|
| Smiles | CCC(C)=O |
|---|
| Inchi | InChI=1S/C4H8O/c1-3-4(2)5/h3H2,1-2H3 |
|---|
| Inchi Key | ZWEHNKRNPOVVGH-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 5.0 |
|---|
| Bioactivities | 17.0 |
|---|
| Np Likeness Score | 0.16 |
|---|
| Records Key | ['Butanone', '2-Butanone', '38', '20', '2-Butanone', 'SID17389672', '36', 'butazone', 'Butanone', 'SID144207239', '2-Butanone'] |
|---|
| Records Name | ['Butan-2-one', 'Butan-2-one', 'Butan-2-one', 'Butan-2-one', '2-Butanone', 'SID17389672', 'Butan-2-one', 'Butan-2-one', 'Butanone', 'SID144207239', '2-Butanone'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
