| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 3QDD44YV7R |
| EPA CompTox | DTXSID3059478 |
Structure
| InChI Key | PSQZLWHRJMYZHD-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H5N3O3 |
| Molecular Weight | 143.03 |
| AlogP | -0.64 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 3.0 |
| Polar Surface Area | 108.27 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 118-78-5 |
| NORMAN SUSDAT | |
| FDA SRS | 3QDD44YV7R |
| PubChem | 67051 |
| ChemSpider | 60402.0 |
CONTENTS
