| BioID | bio198987 |
|---|
| Name | 2-METHYLBUTANAL |
|---|
| ChEMBL ID | CHEMBL2270060 |
|---|
| Molecular Formula | C5H10O |
|---|
| Molecular Weight | 86.13 |
|---|
| Molecular Weight (Monoisotopic) | 86.0732 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | None |
|---|
| Smiles | CCC(C)C=O |
|---|
| Inchi | InChI=1S/C5H10O/c1-3-5(2)4-6/h4-5H,3H2,1-2H3 |
|---|
| Inchi Key | BYGQBDHUGHBGMD-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 8.0 |
|---|
| Bioactivities | 10.0 |
|---|
| Np Likeness Score | 1.88 |
|---|
| Records Key | ['2-methylbutanal', 'SID144213183', 'SID144208440'] |
|---|
| Records Name | ['2-methylbutanal', 'SID144213183', 'SID144208440'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
