Trade Names: | |
Synonyms: | |
Status: | Approved (1959) |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
ATC: | S01EC05 |
UNII: | W733B0S9SD |
InChI Key | FLOSMHQXBMRNHR-QPJJXVBHSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C5H8N4O3S2 |
Molecular Weight | 236.28 |
AlogP | -1.42 |
Hydrogen Bond Acceptor | 6.0 |
Hydrogen Bond Donor | 1.0 |
Number of Rotational Bond | 1.0 |
Polar Surface Area | 107.41 |
Molecular species | NEUTRAL |
Aromatic Rings | 1.0 |
Heavy Atoms | 14.0 |
Primary Target | |
---|---|
carbonic anhydrase 7 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
Lyase
|
- | 5-21 | - | 9-14000 | - | |
Enzyme
|
- | 5-21 | - | 9-14000 | - | |
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 101 |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Uterine Cervical Neoplasms | 2 | D002583 | ClinicalTrials |
Altitude Sickness | 1 | D000532 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 554-57-4 |
ChEBI | 6822 |
ChEMBL | CHEMBL19 |
DrugBank | DB00703 |
FDA SRS | W733B0S9SD |
Guide to Pharmacology | 6828 |
KEGG | C07764 |
SureChEMBL | SCHEMBL24687 |
ZINC | ZINC000100019188 |