| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 85WC99KMT2 |
| EPA CompTox | DTXSID9069267 |
| InChI Key | LOTWRKOXHCMWDB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C11H15N1O3 |
| Molecular Weight | 209.11 |
| AlogP | 0.11 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 60.77 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 58566-44-2 |
| NORMAN SUSDAT | |
| FDA SRS | 85WC99KMT2 |
| PubChem | 94109 |
| ChemSpider | 83574.0 |