| Synonyms: | |
| Status: | Approved |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| ATC: | J01MA03 |
| UNII: | 2H52Z9F2Q5 |
Structure
| InChI Key | FHFYDNQZQSQIAI-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C17H20FN3O3 |
| Molecular Weight | 333.36 |
| AlogP | 1.61 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 65.78 |
| Molecular species | ACID |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 24.0 |
Pharmacology
Indications
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 50199 |
| ChEMBL | CHEMBL267648 |
| DrugBank | DB00487 |
| DrugCentral | 2071 |
| EPA CompTox | DTXSID3048493 |
| FDA SRS | 2H52Z9F2Q5 |
| Human Metabolome Database | HMDB0014630 |
| PharmGKB | PA164742856 |
| PubChem | 51081 |
| SureChEMBL | SCHEMBL34292 |
| ZINC | ZINC000000001894 |
CONTENTS