| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 7I8G7Q77YM |
| EPA CompTox | DTXSID9060231 |
| InChI Key | QSNMFWFDOFQASV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H13N1 |
| Molecular Weight | 135.1 |
| AlogP | 2.42 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 12.89 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 539-32-2 |
| NORMAN SUSDAT | |
| FDA SRS | 7I8G7Q77YM |
| PubChem | 10874 |
| ChemSpider | 10414.0 |