| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | ES73FRK6MY |
| EPA CompTox | DTXSID80198510 |
Structure
| InChI Key | XFTQRUTUGRCSGO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H5N3 |
| Molecular Weight | 95.05 |
| AlogP | 0.06 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 51.8 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 5049-61-6 |
| NORMAN SUSDAT | |
| FDA SRS | ES73FRK6MY |
| PubChem | 78747 |
| ChemSpider | 71088.0 |
CONTENTS
