| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 8BS3E41XVP |
| EPA CompTox | DTXSID1046398 |
Structure
| InChI Key | ACFHHZJOAUZSJU-XBXARRHUSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H7N3O4 |
| Molecular Weight | 197.04 |
| AlogP | 1.5 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 101.23 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 67-28-7 |
| NORMAN SUSDAT | |
| FDA SRS | 8BS3E41XVP |
| PubChem | 9561033 |
| ChemSpider | 7837254.0 |
CONTENTS
