| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | YT3OF85P98 |
| EPA CompTox | DTXSID20197805 |
Structure
| InChI Key | DYPLDWLIOGXSSE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H11N1O2 |
| Molecular Weight | 141.08 |
| AlogP | 0.08 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 38.33 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 495-19-2 |
| NORMAN SUSDAT | |
| FDA SRS | YT3OF85P98 |
| PubChem | 160492 |
| ChemSpider | 141033.0 |
CONTENTS
