Synonyms: | |
Status: | Approved (1990) |
Entry Type: | Small molecule |
Molecule Category: | Parent Prodrug |
ATC: | A07EC03 |
UNII: | ULS5I8J03O |
InChI Key | QQBDLJCYGRGAKP-FOCLMDBBSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C14H10N2O6 |
Molecular Weight | 302.24 |
AlogP | 2.91 |
Hydrogen Bond Acceptor | 6.0 |
Hydrogen Bond Donor | 4.0 |
Number of Rotational Bond | 4.0 |
Polar Surface Area | 139.78 |
Molecular species | ACID |
Aromatic Rings | 2.0 |
Heavy Atoms | 22.0 |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Spondylitis, Ankylosing | 2 | D013167 | ClinicalTrials |
Resources | Reference |
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CAS NUMBER | 15722-48-2 |
ChEMBL | CHEMBL425 |
DrugBank | DB01250 |
FDA SRS | ULS5I8J03O |
Human Metabolome Database | HMDB0015380 |
KEGG | C07323 |
SureChEMBL | SCHEMBL25118 |
ZINC | ZINC000003812865 |