| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | SJ9ZA7F8TG |
| EPA CompTox | DTXSID60191781 |
| InChI Key | OYUKRQOCPFZNHR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H9N1O1 |
| Molecular Weight | 159.07 |
| AlogP | 2.25 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 33.12 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 3846-73-9 |
| NORMAN SUSDAT | |
| FDA SRS | SJ9ZA7F8TG |
| PubChem | 345169 |
| ChemSpider | 306115.0 |