| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | W7N89V5FVH |
| EPA CompTox | DTXSID30178726 |
| InChI Key | IMRVVUQHPUZLSC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H9N1O2 |
| Molecular Weight | 163.06 |
| AlogP | 2.14 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 35.26 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 23999-64-6 |
| NORMAN SUSDAT | |
| FDA SRS | W7N89V5FVH |
| PubChem | 90329 |
| ChemSpider | 81365.0 |