Synonyms: | |
Status: | Approved (1995) |
Entry Type: | Small molecule |
Molecule Category: | UKNOWN |
UNII: | 3ST302B24A |
InChI Key | OXCMYAYHXIHQOA-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C22H22ClKN6O |
Molecular Weight | 461.01 |
AlogP | 4.27 |
Hydrogen Bond Acceptor | 6.0 |
Hydrogen Bond Donor | 2.0 |
Number of Rotational Bond | 8.0 |
Polar Surface Area | 92.51 |
Molecular species | ACID |
Aromatic Rings | 4.0 |
Heavy Atoms | 30.0 |
Action | Mechanism of Action | Reference |
---|---|---|
ANTAGONIST | Type-1 angiotensin II receptor antagonist | DailyMed |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
Phosphodiesterase
Phosphodiesterase 3
Phosphodiesterase 3A
|
- | 13000 | - | - | - | |
Enzyme
Phosphodiesterase
Phosphodiesterase 3
Phosphodiesterase 3B
|
- | 13000 | - | - | - | |
Membrane receptor
Family A G protein-coupled receptor
Peptide receptor (family A GPCR)
Short peptide receptor (family A GPCR)
Angiotensin receptor
|
- | 2-10 | - | 9-25 | 21-74 | |
Transporter
Primary active transporter
ATP-binding cassette
ABCB subfamily
|
- | 8530 | - | - | - | |
Transporter
Primary active transporter
ATP-binding cassette
ABCC subfamily
|
- | 34100 | - | - | - |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Proteinuria | 4 | D011507 | ClinicalTrials |
Kidney Diseases | 4 | D007674 | ClinicalTrials |
Essential Hypertension | 3 | D000075222 | ClinicalTrials |
Marfan Syndrome | 3 | D008382 | ClinicalTrials |
Hypertrophy, Left Ventricular | 3 | D017379 | ClinicalTrials |
Eosinophilic Esophagitis | 2 | D057765 | ClinicalTrials |
Carcinoma, Pancreatic Ductal | 2 | D021441 | ClinicalTrials |
Non-alcoholic Fatty Liver Disease | 2 | D065626 | ClinicalTrials |
Pancreatic Neoplasms | 1 | D010190 | ClinicalTrials |
Pre-Eclampsia | 0 | D011225 | ClinicalTrials |
Resources | Reference |
---|---|
ChEMBL | CHEMBL995 |
EPA CompTox | DTXSID3044209 |
FDA SRS | 3ST302B24A |
SureChEMBL | SCHEMBL42079 |