| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID8068092 |
Structure
| InChI Key | JGGFDEJXWLAQKR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C1H7N5 |
| Molecular Weight | 89.07 |
| AlogP | -2.15 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 5.0 |
| Polar Surface Area | 99.95 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 38360-74-6 |
| NORMAN SUSDAT | |
| ChemSpider | 148693.0 |
CONTENTS
