| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 397W61ZHWY |
| EPA CompTox | DTXSID5049318 |
Structure
| InChI Key | UUWJNBOCAPUTBK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H7N5O1 |
| Molecular Weight | 165.07 |
| AlogP | -0.52 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 3.0 |
| Polar Surface Area | 90.58 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 5502-78-3 |
| NORMAN SUSDAT | |
| FDA SRS | 397W61ZHWY |
| PubChem | 79639 |
| ChemSpider | 71942.0 |
CONTENTS
