Synonyms: | |
Status: | Approved |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
ATC: | M01AC05 |
UNII: | ER09126G7A |
InChI Key | WLHQHAUOOXYABV-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C13H10ClN3O4S2 |
Molecular Weight | 371.83 |
AlogP | 2.3 |
Hydrogen Bond Acceptor | 6.0 |
Hydrogen Bond Donor | 2.0 |
Number of Rotational Bond | 2.0 |
Polar Surface Area | 99.6 |
Molecular species | ACID |
Aromatic Rings | 2.0 |
Heavy Atoms | 23.0 |
Action | Mechanism of Action | Reference |
---|---|---|
INHIBITOR | Cyclooxygenase inhibitor | Other |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Transporter
Primary active transporter
ATP-binding cassette
ABCB subfamily
|
- | 7560 | - | - | - |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Pain | 3 | D010146 | ClinicalTrials |
Alzheimer Disease | 2 | D000544 | ClinicalTrials |
Migraine Disorders | 2 | D008881 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 70374-39-9 |
ChEBI | 31783 |
ChEMBL | CHEMBL1569487 |
DrugBank | DB06725 |
DrugCentral | 1609 |
FDA SRS | ER09126G7A |
PubChem | 54690031 |
SureChEMBL | SCHEMBL35101 |
ZINC | ZINC000100015491 |