Trade Names: | |
Synonyms: | |
Status: | Approved (1983) |
Entry Type: | Small molecule |
Molecule Category: | Parent |
ATC: | C03BA11 |
UNII: | F089I0511L |
InChI Key | NDDAHWYSQHTHNT-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C16H16ClN3O3S |
Molecular Weight | 365.84 |
AlogP | 2.08 |
Hydrogen Bond Acceptor | 4.0 |
Hydrogen Bond Donor | 2.0 |
Number of Rotational Bond | 3.0 |
Polar Surface Area | 92.5 |
Molecular species | NEUTRAL |
Aromatic Rings | 2.0 |
Heavy Atoms | 24.0 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
Lyase
|
- | - | 2-1800 | 0-0 | - | |
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 80 |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Diabetes Mellitus, Type 2 | 3 | D003924 | ClinicalTrials |
Kidney Calculi | 2 | D007669 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 26807-65-8 |
ChEBI | 5893 |
ChEMBL | CHEMBL406 |
DrugBank | DB00808 |
DrugCentral | 1433 |
EPA CompTox | DTXSID7044633 |
FDA SRS | F089I0511L |
Human Metabolome Database | HMDB0014946 |
Guide to Pharmacology | 7203 |
KEGG | D00345 |
PDB | BL1 |
PharmGKB | PA449975 |
PubChem | 3702 |
SureChEMBL | SCHEMBL41303 |
ZINC | ZINC00643114 |