| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 3MM3JQH7MX |
| EPA CompTox | DTXSID50196725 |
| InChI Key | BJJDXAFKCKSLTE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C6H9N3 |
| Molecular Weight | 123.08 |
| AlogP | 0.51 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 52.53 |
| Heavy Atoms | 9.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 461-98-3 |
| NORMAN SUSDAT | |
| FDA SRS | 3MM3JQH7MX |
| PubChem | 68039 |
| ChemSpider | 61354.0 |