| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 9HN55RQ07B |
| EPA CompTox | DTXSID20187867 |
| InChI Key | IBKMZYWDWWIWEL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C6H8N2 |
| Molecular Weight | 108.07 |
| AlogP | 0.97 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 38.91 |
| Heavy Atoms | 8.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 3430-27-1 |
| NORMAN SUSDAT | |
| FDA SRS | 9HN55RQ07B |
| PubChem | 137935 |
| ChemSpider | 121583.0 |