| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID90171011 |
Structure
| InChI Key | ZDWPBMJZDNXTPG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H6N4 |
| Molecular Weight | 134.06 |
| AlogP | 0.54 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 67.59 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 18076-61-4 |
| NORMAN SUSDAT | |
| PubChem | 87446 |
| ChemSpider | 78880.0 |
CONTENTS
