| Synonyms: | |
| Status: | Approved |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | L7J6A1NE81 |
Structure
| InChI Key | ISAOCJYIOMOJEB-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H12O2 |
| Molecular Weight | 212.25 |
| AlogP | 2.6 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 37.3 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 16.0 |
Pharmacology
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 17682 |
| ChEMBL | CHEMBL190677 |
| DrugBank | DB14020 |
| DrugCentral | 4663 |
| EPA CompTox | DTXSID1020144 |
| FDA SRS | L7J6A1NE81 |
| Human Metabolome Database | HMDB0032039 |
| KEGG | C01408 |
| SureChEMBL | SCHEMBL145 |
CONTENTS