| BioID | bio197281 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL45345 |
|---|
| Molecular Formula | C5H10O |
|---|
| Molecular Weight | 86.13 |
|---|
| Molecular Weight (Monoisotopic) | 86.0732 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | Pentan-2-one |
|---|
| Smiles | CCCC(C)=O |
|---|
| Inchi | InChI=1S/C5H10O/c1-3-4-5(2)6/h3-4H2,1-2H3 |
|---|
| Inchi Key | XNLICIUVMPYHGG-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 2.0 |
|---|
| Bioactivities | 2.0 |
|---|
| Np Likeness Score | 0.38 |
|---|
| Records Key | ['39', 'SID144208868', '2-Pentanone', 'SID144213333'] |
|---|
| Records Name | ['Pentan-2-one', 'SID144208868', 'Pentan-2-one', 'SID144213333'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
