| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 7FA66ND35G |
| EPA CompTox | DTXSID101019003 |
| InChI Key | DSQHQLPYWULAMJ-IHWYPQMZSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C6H8N2O4 |
| Molecular Weight | 172.05 |
| AlogP | 0.16 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 102.97 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 105-63-5 |
| NORMAN SUSDAT | |
| FDA SRS | 7FA66ND35G |
| PubChem | 5355030 |