| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | QW8X937AJ3 |
| EPA CompTox | DTXSID70160448 |
Structure
| InChI Key | WHNSJMMQNFSFBX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H7N3O3 |
| Molecular Weight | 133.05 |
| AlogP | -1.26 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 110.64 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 138-07-8 |
| NORMAN SUSDAT | |
| FDA SRS | QW8X937AJ3 |
| PubChem | 67308 |
| ChemSpider | 60640.0 |
CONTENTS
