Trade Names: | |
Synonyms: | |
Status: | Approved (1973) |
Entry Type: | Small molecule |
Molecule Category: | Parent |
ATC: | C02DA01 |
UNII: | O5CB12L4FN |
InChI Key | GDLBFKVLRPITMI-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C8H7ClN2O2S |
Molecular Weight | 230.68 |
AlogP | 1.87 |
Hydrogen Bond Acceptor | 3.0 |
Hydrogen Bond Donor | 1.0 |
Number of Rotational Bond | 0.0 |
Polar Surface Area | 58.53 |
Molecular species | NEUTRAL |
Aromatic Rings | 1.0 |
Heavy Atoms | 14.0 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Ion channel
Voltage-gated ion channel
Potassium channels
Inwardly rectifying potassium channel
|
8800-33000 | - | - | - | - | |
Ion channel
Voltage-gated ion channel
Voltage-gated sodium channel
|
- | - | - | - | 13 | |
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 92 | |
Transporter
Primary active transporter
ATP-binding cassette
ABCC subfamily
|
8800-33000 | - | - | - | - |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Obesity | 3 | D009765 | ClinicalTrials |
Diabetes Mellitus, Type 2 | 2 | D003924 | ClinicalTrials |
Depressive Disorder | 1 | D003866 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 364-98-7 |
ChEBI | 4495 |
ChEMBL | CHEMBL181 |
DrugBank | DB01119 |
DrugCentral | 854 |
EPA CompTox | DTXSID7022914 |
FDA SRS | O5CB12L4FN |
Human Metabolome Database | HMDB0015251 |
Guide to Pharmacology | 2409 |
KEGG | C06949 |
PDB | 20J |
PharmGKB | PA449285 |
PubChem | 3019 |
SureChEMBL | SCHEMBL41254 |
ZINC | ZINC000003872277 |