| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | JUJ5NAX6AB |
| EPA CompTox | DTXSID90184186 |
Structure
| InChI Key | SPMMZKAWNAKPJM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H12N2 |
| Molecular Weight | 112.1 |
| AlogP | 0.9 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 35.82 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 3010-04-6 |
| NORMAN SUSDAT | |
| FDA SRS | JUJ5NAX6AB |
| PubChem | 76373 |
| ChemSpider | 68850.0 |
CONTENTS
