| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | I96A01798W |
| EPA CompTox | DTXSID2059695 |
| InChI Key | KVEDKKLZCJBVNP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H12N2O2 |
| Molecular Weight | 192.09 |
| AlogP | 2.9 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 65.18 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 140-50-1 |
| NORMAN SUSDAT | |
| FDA SRS | I96A01798W |
| PubChem | 67324 |
| ChemSpider | 60655.0 |