| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID20180712 |
| InChI Key | RIZOSFDXIXBLIP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H13N1O2 |
| Molecular Weight | 203.09 |
| AlogP | 2.45 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 42.24 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 26078-24-0 |
| NORMAN SUSDAT | |
| PubChem | 33293 |
| ChemSpider | 30752.0 |