| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 9VE2L03HB0 |
| EPA CompTox | DTXSID40168572 |
| InChI Key | LBUDLOYYNHQKQI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C6H7N3 |
| Molecular Weight | 121.06 |
| AlogP | 0.48 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 50.82 |
| Heavy Atoms | 9.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 16849-88-0 |
| NORMAN SUSDAT | |
| FDA SRS | 9VE2L03HB0 |
| PubChem | 28111 |
| ChemSpider | 26149.0 |