| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | E54CTM794Y |
| EPA CompTox | DTXSID30912041 |
| InChI Key | LHQIJBMDNUYRAM-DZSWIPIPSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H11N5O3 |
| Molecular Weight | 237.09 |
| AlogP | -1.05 |
| Hydrogen Bond Acceptor | 7.0 |
| Hydrogen Bond Donor | 5.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 139.0 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 22150-76-1 |
| NORMAN SUSDAT | |
| FDA SRS | E54CTM794Y |
| PubChem | 2380 |
| ChemSpider | 392795.0 |