Synonyms: | |
Status: | Approved (1993) |
Entry Type: | Small molecule |
Molecule Category: | Parent |
ATC: | C10AA04 |
UNII: | 4L066368AS |
InChI Key | FJLGEFLZQAZZCD-MCBHFWOFSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C24H26FNO4 |
Molecular Weight | 411.47 |
AlogP | 4.63 |
Hydrogen Bond Acceptor | 4.0 |
Hydrogen Bond Donor | 3.0 |
Number of Rotational Bond | 8.0 |
Polar Surface Area | 82.69 |
Molecular species | ACID |
Aromatic Rings | 3.0 |
Heavy Atoms | 30.0 |
Primary Target | |
---|---|
hydroxymethylglutaryl-CoA reductase |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
Oxidoreductase
|
- | 28 | - | - | - | |
Enzyme
Protease
Serine protease
Serine protease SC clan
Serine protease S9B subfamily
|
- | - | - | - | 8 | |
Transcription factor
Nuclear receptor
Nuclear hormone receptor subfamily 2
Nuclear hormone receptor subfamily 2 group B
Nuclear hormone receptor subfamily 2 group B member 1
|
- | - | 11040 | - | - | |
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 76 | |
Transporter
Primary active transporter
ATP-binding cassette
ABCB subfamily
|
- | 36100-36100 | - | - | - | |
Transporter
Primary active transporter
ATP-binding cassette
ABCC subfamily
|
- | 57000 | - | - | - |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Hypercholesterolemia | 3 | D006937 | ClinicalTrials |
Lipid Metabolism Disorders | 3 | D052439 | ClinicalTrials |
Erectile Dysfunction | 3 | D007172 | ClinicalTrials |
Nephritis, Hereditary | 2 | D009394 | ClinicalTrials |
Prostatic Neoplasms, Castration-Resistant | 2 | D064129 | ClinicalTrials |
Antiphospholipid Syndrome | 2 | D016736 | ClinicalTrials |
Hepatitis C | 2 | D006526 | ClinicalTrials |
Hepatitis C, Chronic | 2 | D019698 | ClinicalTrials |
Aortic Valve Stenosis | 2 | D001024 | ClinicalTrials |
Glioma | 1 | D005910 | ClinicalTrials |
Melanoma | 0 | D008545 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 93957-54-1 |
ChEBI | 38562 |
ChEMBL | CHEMBL2220442 |
DrugBank | DB01095 |
FDA SRS | 4L066368AS |
Guide to Pharmacology | 2951 |
PubChem | 1548972 |
SureChEMBL | SCHEMBL2848 |
ZINC | ZINC01886617 |