| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID8027791 |
Structure
| InChI Key | GDCJAPJJFZWILF-UHFFFAOYNA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H8N2 |
| Molecular Weight | 108.07 |
| AlogP | 1.45 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 47.58 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 17611-82-4 |
| NORMAN SUSDAT | |
| ChemSpider | 78101.0 |
CONTENTS
