| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 2L5TW6M6R6 |
| EPA CompTox | DTXSID5066950 |
| InChI Key | SESYNEDUKZDRJL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H9N3 |
| Molecular Weight | 135.08 |
| AlogP | 1.11 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 41.61 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 23996-55-6 |
| NORMAN SUSDAT | |
| FDA SRS | 2L5TW6M6R6 |
| PubChem | 90328 |
| ChemSpider | 81549.0 |