| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | YBK38G2YXH |
| EPA CompTox | DTXSID2051552 |
Structure
| InChI Key | DGJMPUGMZIKDRO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H4N2O1 |
| Molecular Weight | 84.03 |
| AlogP | 0.44 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 67.87 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 107-91-5 |
| NORMAN SUSDAT | |
| FDA SRS | YBK38G2YXH |
| PubChem | 7898 |
| ChemSpider | 7610.0 |
CONTENTS
