| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | V82SCC5X3Q |
| EPA CompTox | DTXSID9024855 |
| InChI Key | ONADZNBSLRAJFW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H11N1O1 |
| Molecular Weight | 137.08 |
| AlogP | 1.59 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 35.25 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 16452-01-0 |
| NORMAN SUSDAT | |
| FDA SRS | V82SCC5X3Q |
| PubChem | 27882 |
| ChemSpider | 14566.0 |