| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 3S34EVC8A5 |
| EPA CompTox | DTXSID30158048 |
Structure
| InChI Key | XJBNELXWSXDUFP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H10N2O4 |
| Molecular Weight | 150.06 |
| AlogP | -1.95 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 96.52 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 13329-70-9 |
| NORMAN SUSDAT | |
| FDA SRS | 3S34EVC8A5 |
| PubChem | 83348 |
| ChemSpider | 75207.0 |
CONTENTS
