| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | MD53YTF87S |
| EPA CompTox | DTXSID5058771 |
| InChI Key | VSMXLKGFTKFOSB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H11N1O1 |
| Molecular Weight | 161.08 |
| AlogP | 1.6 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 20.31 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 61-28-9 |
| NORMAN SUSDAT | |
| FDA SRS | MD53YTF87S |
| PubChem | 66135 |
| ChemSpider | 59523.0 |