| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID60961840 |
Structure
| InChI Key | SDLBIQNBDPOOPJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H8N3O4 |
| Molecular Weight | 185.04 |
| AlogP | -1.01 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 87.14 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 41613-26-7 |
| NORMAN SUSDAT | |
| PubChem | 96370 |
CONTENTS
