| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID50188443 |
Structure
| InChI Key | UVLSCMIEPPWCHZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H17N3 |
| Molecular Weight | 143.14 |
| AlogP | -0.76 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 41.29 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 34885-02-4 |
| NORMAN SUSDAT | |
| PubChem | 118746 |
| ChemSpider | 106114.0 |
CONTENTS
