| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID90240695 |
Structure
| InChI Key | CMIPWACBRYWGPN-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H7N3O1 |
| Molecular Weight | 113.06 |
| AlogP | -0.31 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 57.41 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 94134-02-8 |
| NORMAN SUSDAT | |
| PubChem | 2784771 |
| ChemSpider | 2064698.0 |
CONTENTS
