| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1983) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| ATC: | V04CK03 |
| UNII: | 239IF5W61J |
Structure
| InChI Key | SPPTWHFVYKCNNK-FQEVSTJZSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C23H20N2O5 |
| Molecular Weight | 404.42 |
| AlogP | 3.07 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 115.73 |
| Molecular species | ACID |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 30.0 |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 37106-97-1 |
| ChEBI | 31263 |
| ChEMBL | CHEMBL1200368 |
| DrugBank | DB00522 |
| DrugCentral | 316 |
| EPA CompTox | DTXSID2048377 |
| FDA SRS | 239IF5W61J |
| Human Metabolome Database | HMDB0014663 |
| PubChem | 6957673 |
| SureChEMBL | SCHEMBL151634 |
| ZINC | ZINC000000608204 |
CONTENTS