CLOFIBRATE

Search structure
Trade Names:
Synonyms:
Status: Approved (1967)
Entry Type: Small molecule
Molecule Category: Parent Prodrug
ATC: C10AB01
UNII: HPN91K7FU3

Structure
InChI Key KNHUKKLJHYUCFP-UHFFFAOYSA-N
Smile CCOC(=O)C(C)(C)Oc1ccc(Cl)cc1
InChI
InChI=1S/C12H15ClO3/c1-4-15-11(14)12(2,3)16-10-7-5-9(13)6-8-10/h5-8H,4H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H15ClO3
Molecular Weight 242.7
AlogP 3.06
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 4.0
Polar Surface Area 35.53
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 16.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Peroxisome proliferator-activated receptor alpha agonist ISBN
Primary Target
Peroxisome proliferator-activated receptor-α
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Auxiliary transport protein Fatty acid binding protein family
- - 6000-12000 6920 -
Enzyme Oxidoreductase
- - - - 18
Transcription factor Nuclear receptor Nuclear hormone receptor subfamily 1 Nuclear hormone receptor subfamily 1 group C Nuclear hormone receptor subfamily 1 group C member 1
55000-55000 - - - -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 115
Transporter Primary active transporter ATP-binding cassette ABCB subfamily
- 60000-71000 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Myocardial Infarction 3 D009203 ClinicalTrials
Myocardial Ischemia 3 D017202 ClinicalTrials

Related Entries

MCS

Cross References

Resources Reference
CAS NUMBER 637-07-0
ChEBI 3750
ChEMBL CHEMBL565
DrugBank DB00636
DrugCentral 694
EPA CompTox DTXSID3020336
FDA SRS HPN91K7FU3
Human Metabolome Database HMDB0014774
Guide to Pharmacology 2667
KEGG C06916
PharmGKB PA449045
PubChem 2796
SureChEMBL SCHEMBL2356
ZINC ZINC000000056648
CONTENTS