| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 43A6JC4A3Z |
| EPA CompTox | DTXSID40219114 |
Structure
| InChI Key | YVVZUMUVGRLSRZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H6N4O |
| Molecular Weight | 114.05 |
| AlogP | -0.6 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 63.83 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 69048-98-2 |
| NORMAN SUSDAT | |
| FDA SRS | 43A6JC4A3Z |
CONTENTS
