| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID3065956 |
Structure
| InChI Key | VPNSJECDVDBDTA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H7N3O4 |
| Molecular Weight | 185.04 |
| AlogP | 0.4 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 87.38 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 15846-14-7 |
| NORMAN SUSDAT | |
| PubChem | 85139 |
| ChemSpider | 76787.0 |
CONTENTS
