| Synonyms: | |
| Status: | Approved |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | Z4XE6IBF3V |
Structure
| InChI Key | QBPFLULOKWLNNW-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H8O4 |
| Molecular Weight | 240.21 |
| AlogP | 1.87 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 0.0 |
| Polar Surface Area | 74.6 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 18.0 |
Pharmacology
Indications
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 3682 |
| ChEMBL | CHEMBL53418 |
| DrugBank | DB04816 |
| DrugCentral | 3125 |
| EPA CompTox | DTXSID9020328 |
| FDA SRS | Z4XE6IBF3V |
| Human Metabolome Database | HMDB0029752 |
| KEGG | C10312 |
| PDB | CHZ |
| PubChem | 2950 |
| SureChEMBL | SCHEMBL83688 |
| ZINC | ZINC000003860369 |
CONTENTS