Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: A03AX08
UNII: 46TIR1560O

Structure

InChI Key ZPFXAOWNKLFJDN-UHFFFAOYSA-N
Smile CCN(CCCc1ccccc1)CCCc1ccccc1
InChI
InChI=1S/C20H27N/c1-2-21(17-9-15-19-11-5-3-6-12-19)18-10-16-20-13-7-4-8-14-20/h3-8,11-14H,2,9-10,15-18H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H27N
Molecular Weight 281.44
AlogP 4.57
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 9.0
Polar Surface Area 3.24
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 21.0

Pharmacology

Action Mechanism of Action Reference
ACTIVATOR Hepatocyte nuclear factor 4-alpha activator PubMed PubMed PubMed PubMed PubMed PubMed PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 518413
ChEMBL CHEMBL253371
DrugBank DB01616
DrugCentral 142
EPA CompTox DTXSID0048557
FDA SRS 46TIR1560O
Human Metabolome Database HMDB0015554
PharmGKB PA164764505
PubChem 3678
SureChEMBL SCHEMBL83067
ZINC ZINC000001481966