| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | D6ZP6F2ECK |
| EPA CompTox | DTXSID3061394 |
Structure
| InChI Key | JTTIOYHBNXDJOD-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H7N5 |
| Molecular Weight | 125.07 |
| AlogP | -1.12 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 5.0 |
| Polar Surface Area | 105.3 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1004-38-2 |
| NORMAN SUSDAT | |
| FDA SRS | D6ZP6F2ECK |
| PubChem | 13863 |
| ChemSpider | 13263.0 |
CONTENTS
