| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | HP2SB4W7TB |
| EPA CompTox | DTXSID50157472 |
Structure
| InChI Key | FRPCZQWGVIAXPC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H9N3O2 |
| Molecular Weight | 167.07 |
| AlogP | 1.29 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 60.96 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 13230-43-8 |
| NORMAN SUSDAT | |
| FDA SRS | HP2SB4W7TB |
| PubChem | 83250 |
| ChemSpider | 75115.0 |
CONTENTS
