| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | N1GY2UD3JX |
| EPA CompTox | DTXSID4057637 |
| InChI Key | ACFJNTXCEQCDBX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C11H13N1O3 |
| Molecular Weight | 207.09 |
| AlogP | 1.78 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 51.48 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 13338-63-1 |
| NORMAN SUSDAT | |
| FDA SRS | N1GY2UD3JX |
| PubChem | 25887 |
| ChemSpider | 24118.0 |