Synonyms: | |
Status: | Approved (1945) |
Entry Type: | Small molecule |
Molecule Category: | Parent |
UNII: | G58F8OPL4I |
InChI Key | PBCZLFBEBARBBI-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C13H12N2O3S |
Molecular Weight | 276.32 |
AlogP | 1.39 |
Hydrogen Bond Acceptor | 4.0 |
Hydrogen Bond Donor | 2.0 |
Number of Rotational Bond | 3.0 |
Polar Surface Area | 89.26 |
Molecular species | ACID |
Aromatic Rings | 2.0 |
Heavy Atoms | 19.0 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 85 |
Resources | Reference |
---|---|
ChEBI | 94677 |
ChEMBL | CHEMBL1243 |
DrugBank | DB09355 |
DrugCentral | 3558 |
EPA CompTox | DTXSID7045287 |
FDA SRS | G58F8OPL4I |
PDB | BS4 |
PubChem | 5319 |
SureChEMBL | SCHEMBL93841 |
ZINC | ZINC000005421253 |