Trade Names | |
Synonyms | |
Status | |
Molecule Category | UNKNOWN |
ATC | A07EC01 |
UNII | 3XC8GUZ6CB |
EPA CompTox | DTXSID0021256 |
InChI Key | NCEXYHBECQHGNR-QZQOTICOSA-N |
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Smiles | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C18H14N4O5S |
Molecular Weight | 398.4 |
AlogP | 3.7 |
Hydrogen Bond Acceptor | 7.0 |
Hydrogen Bond Donor | 3.0 |
Number of Rotational Bond | 6.0 |
Polar Surface Area | 141.31 |
Molecular species | ACID |
Aromatic Rings | 3.0 |
Heavy Atoms | 28.0 |
Mechanism of Action | Action | Reference |
---|---|---|
Arachidonate 5-lipoxygenase inhibitor | INHIBITOR | PubMed PubMed PubMed |
Protein: Arachidonate 5-lipoxygenase Description: Polyunsaturated fatty acid 5-lipoxygenase Organism : Homo sapiens P09917 ENSG00000012779 |
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Protein: Cyclooxygenase Description: Prostaglandin G/H synthase 1 Organism : Homo sapiens P23219 ENSG00000095303 |
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Protein: Cyclooxygenase Description: Prostaglandin G/H synthase 2 Organism : Homo sapiens P35354 ENSG00000073756 |
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Resources | Reference |
---|---|
ChEBI | 9334 |
ChEMBL | CHEMBL421 |
DrugBank | DB00795 |
DrugCentral | 2525 |
FDA SRS | 3XC8GUZ6CB |
Human Metabolome Database | HMDB0014933 |
Guide to Pharmacology | 4840 |
KEGG | C07316 |
PDB | SAS |
SureChEMBL | SCHEMBL4515 |
ZINC | ZINC000003831490 |