Molecule

ID:110577

General Information

Structure

Molecular Formula

C₁₇H₃₄O

Molecular Mass

254.45126

Exact Mass

254.26096571

Charge

0

InChI

InChI=1S/C17H34O/c1-3-5-7-9-10-11-12-14-16-17(18)15-13-8-6-4-2/h3-16H2,1-2H3

InChIKey

NFRKSAMCQGIGRC-UHFFFAOYSA-N

Canonic Smiles

CCCCCCCCCCC(=O)CCCCCC

Isomeric Smiles

CCCCCCCCCCC(=O)CCCCCC

Calculated Properties

JChem

H Acceptors

1

H Donor

0

LogD (pH = 5.5)

6.8421755

LogD (pH = 7.4)

6.8421755

Log P

6.8421755

Molar Refractivity

80.6606

Polarizability

32.15646

Polar Surface Area

17.07

Rotatable Bonds

14

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