| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 9FLY8GU8UR |
| EPA CompTox | DTXSID40200941 |
Structure
| InChI Key | SCZGZDLUGUYLRV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H10N2 |
| Molecular Weight | 122.08 |
| AlogP | 1.28 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 38.05 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 529-27-1 |
| NORMAN SUSDAT | |
| FDA SRS | 9FLY8GU8UR |
| PubChem | 68256 |
| ChemSpider | 61554.0 |
CONTENTS
