| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 9AP4G7UGQZ |
| EPA CompTox | DTXSID80909724 |
| InChI Key | QDSPSYXUNKKWMN-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C5H8N2 |
| Molecular Weight | 96.07 |
| AlogP | 0.17 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 24.39 |
| Heavy Atoms | 7.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 10577-96-5 |
| NORMAN SUSDAT | |
| FDA SRS | 9AP4G7UGQZ |
| PubChem | 82736 |