BEMPEDOIC ACID

Search structure
Synonyms:
Status: Approved (2020)
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: C10AX15
UNII: 1EJ6Z6Q368

Structure
InChI Key HYHMLYSLQUKXKP-UHFFFAOYSA-N
Smile CC(C)(CCCCCC(O)CCCCCC(C)(C)C(=O)O)C(=O)O
InChI
InChI=1S/C19H36O5/c1-18(2,16(21)22)13-9-5-7-11-15(20)12-8-6-10-14-19(3,4)17(23)24/h15,20H,5-14H2,1-4H3,(H,21,22)(H,23,24)

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H36O5
Molecular Weight 344.49
AlogP 4.47
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 14.0
Polar Surface Area 94.83
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 24.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR ATP-citrate synthase inhibitor FDA

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Cardiovascular Diseases 4 D002318 ClinicalTrials
Hyperlipoproteinemia Type II 4 D006938 FDA
Coronary Artery Disease 4 D003324 FDA
Hyperlipidemias 3 D006949 ClinicalTrials
Diabetes Mellitus, Type 2 2 D003924 ClinicalTrials
Hypercholesterolemia 2 D006937 ClinicalTrials
Lipid Metabolism Disorders 2 D052439 ClinicalTrials

Related Entries

MCS

Cross References

Resources Reference
CAS NUMBER 738606-46-7
ChEBI 149601
ChEMBL CHEMBL3545313
DrugBank DB11936
DrugCentral 5382
FDA SRS 1EJ6Z6Q368
Guide to Pharmacology 8321
PubChem 10472693
SureChEMBL SCHEMBL185768
ZINC ZINC000003948738
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