Trade Names | |
Synonyms | |
Status | |
Molecule Category | Free-form |
ATC | R05CB01 S01XA08 V03AB23 |
UNII | WYQ7N0BPYC |
EPA CompTox | DTXSID5020021 |
InChI Key | PWKSKIMOESPYIA-BYPYZUCNSA-N | |
---|---|---|
Smiles | ||
InChI |
|
Property Name | Value | |
---|---|---|
Molecular Formula | C5H9NO3S | |
Molecular Weight | 163.2 | |
AlogP | -0.49 | |
Hydrogen Bond Acceptor | 3.0 | |
Hydrogen Bond Donor | 3.0 | |
Number of Rotational Bond | 3.0 | |
Polar Surface Area | 66.4 | |
Molecular species | ACID | |
Aromatic Rings | 0.0 | |
Heavy Atoms | 10.0 |
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
|
- | - | - | - | 82 | ||
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC22 family of organic cation and anion transporters
|
- | - | - | - | 16 |
Resources | Reference | |
---|---|---|
ChEBI | 28939 | |
ChEMBL | CHEMBL600 | |
DrugBank | DB06151 | |
DrugCentral | 66 | |
FDA SRS | WYQ7N0BPYC | |
Human Metabolome Database | HMDB0001890 | |
Guide to Pharmacology | 10945 | |
KEGG | C06809 | |
PDB | SC2 | |
PharmGKB | PA448033 | |
PubChem | 12035 | |
SureChEMBL | SCHEMBL5292 | |
ZINC | ZINC000003589203 |