| Synonyms | |
| Status | |
| Molecule Category | Free-form |
| UNII | GSD5B9US0W |
| EPA CompTox | DTXSID4057635 |
Structure
| InChI Key | IZJRISIINLJVBU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H17NO3 |
| Molecular Weight | 223.27 |
| AlogP | 2.06 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 48.42 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 32322 |
| ChEMBL | CHEMBL2105161 |
| DrugBank | DB12911 |
| FDA SRS | GSD5B9US0W |
| KEGG | C13138 |
| PubChem | 14866 |
| SureChEMBL | SCHEMBL288321 |
| ZINC | ZINC000002020020 |
CONTENTS
