| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | H33TY2BZE4 |
| EPA CompTox | DTXSID90159632 |
| InChI Key | CYWIZMOZBTXFIL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H9N1O2 |
| Molecular Weight | 151.06 |
| AlogP | 1.18 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 39.19 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 13602-11-4 |
| NORMAN SUSDAT | |
| FDA SRS | H33TY2BZE4 |
| PubChem | 73022 |
| ChemSpider | 65824.0 |