| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 49P95BAU4Z |
| EPA CompTox | DTXSID0062052 |
Structure
| InChI Key | MSSXOMSJDRHRMC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H6N6 |
| Molecular Weight | 150.07 |
| AlogP | -0.7 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 4.0 |
| Polar Surface Area | 107.23 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1904-98-9 |
| NORMAN SUSDAT | |
| FDA SRS | 49P95BAU4Z |
| PubChem | 30976 |
| ChemSpider | 28738.0 |
CONTENTS
