| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | SXK3ZE3U4Q |
| EPA CompTox | DTXSID8020838 |
| InChI Key | LVTFSVIRYMXRSR-WUKNDPDISA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C15H17N3 |
| Molecular Weight | 239.14 |
| AlogP | 4.48 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 27.96 |
| Heavy Atoms | 18.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 55-80-1 |
| NORMAN SUSDAT | |
| FDA SRS | SXK3ZE3U4Q |
| ChemSpider | 5721.0 |