| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | MK86FR3SN8 |
| EPA CompTox | DTXSID10161171 |
Structure
| InChI Key | HFWOSHMLDRSIDN-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H6N6O3 |
| Molecular Weight | 174.05 |
| AlogP | -0.18 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 98.01 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 13980-04-6 |
| NORMAN SUSDAT | |
| FDA SRS | MK86FR3SN8 |
| PubChem | 26368 |
| ChemSpider | 24566.0 |
CONTENTS
