| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 8DGQ1B38R5 |
| EPA CompTox | DTXSID30170028 |
| InChI Key | IMLAIXAZMVDRGA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H11N1O1 |
| Molecular Weight | 137.08 |
| AlogP | 1.02 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 35.25 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 1758-46-9 |
| NORMAN SUSDAT | |
| FDA SRS | 8DGQ1B38R5 |
| PubChem | 15651 |
| ChemSpider | 14886.0 |