Molecule

ID:107363

General Information

Structure

MolImage

Molecular Formula

C₁₅H₂₈O₂

Molecular Mass

240.38162

Exact Mass

240.20893014

Charge

0

InChI

InChI=1S/C15H28O2/c1-3-5-6-7-8-9-10-11-12-13-15(16)17-14-4-2/h4H,2-3,5-14H2,1H3

InChIKey

ZQMAPKVSTSACQB-UHFFFAOYSA-N

Canonic Smiles

CCCCCCCCCCCC(=O)OCC=C

Isomeric Smiles

CCCCCCCCCCCC(=O)OCC=C

Calculated Properties

JChem

H Acceptors

1

H Donor

0

LogD (pH = 5.5)

5.355452

LogD (pH = 7.4)

5.355452

Log P

5.355452

Molar Refractivity

72.6114

Polarizability

28.89051

Polar Surface Area

26.3

Rotatable Bonds

13

Lipinski's Rule of Five

false

Data Source

Names and Identifiers

Registration numbers

Properties

Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

References

Bioactivity