| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID60180615 |
Structure
| InChI Key | STGZMDMCSWZWHU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H9N3O3 |
| Molecular Weight | 183.06 |
| AlogP | -0.18 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 91.52 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 25948-12-3 |
| NORMAN SUSDAT | |
| PubChem | 97005 |
| ChemSpider | 87573.0 |
CONTENTS
