| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 465N7P5U85 |
| EPA CompTox | DTXSID8046402 |
Structure
| InChI Key | PTBKFATYSVLSSD-ZZXKWVIFSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H4N2O4 |
| Molecular Weight | 156.02 |
| AlogP | 1.0 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 88.87 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 6236-05-1 |
| NORMAN SUSDAT | |
| FDA SRS | 465N7P5U85 |
CONTENTS
