| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 56Y8G819O3 |
| EPA CompTox | DTXSID1041479 |
Structure
| InChI Key | GFZWHAAOIVMHOI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H7N1O2 |
| Molecular Weight | 101.05 |
| AlogP | -0.71 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 49.33 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 36476-78-5 |
| NORMAN SUSDAT | |
| FDA SRS | 56Y8G819O3 |
CONTENTS
