| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 77OXT3492A |
| EPA CompTox | DTXSID20180671 |
| InChI Key | HWWIVWKTKZAORO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H9N1O2 |
| Molecular Weight | 151.06 |
| AlogP | 1.2 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 41.49 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 26021-57-8 |
| NORMAN SUSDAT | |
| FDA SRS | 77OXT3492A |
| PubChem | 117709 |
| ChemSpider | 105189.0 |