| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | RJ5OZG6I4A |
| EPA CompTox | DTXSID60865258 |
Structure
| InChI Key | LMDZBCPBFSXMTL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H17N3 |
| Molecular Weight | 155.14 |
| AlogP | 1.13 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 27.96 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1892-57-5 |
| NORMAN SUSDAT | |
| FDA SRS | RJ5OZG6I4A |
| PubChem | 15908 |
| ChemSpider | 15119.0 |
CONTENTS
