Molecule

ID:112821

General Information

Structure

MolImage

Molecular Formula

C₁₁H₂₀

Molecular Mass

152.2765

Exact Mass

152.15650064

Charge

0

InChI

InChI=1S/C11H20/c1-3-5-7-9-11-10-8-6-4-2/h3-9H2,1-2H3

InChIKey

VRQLDBSWBBKOCR-UHFFFAOYSA-N

Canonic Smiles

CCCCCC#CCCCC

Isomeric Smiles

CCCCCC#CCCCC

Calculated Properties

JChem

H Acceptors

0

H Donor

0

LogD (pH = 5.5)

4.938688

LogD (pH = 7.4)

4.938688

Log P

4.938688

Molar Refractivity

51.774597

Polarizability

19.95288

Polar Surface Area

0.0

Rotatable Bonds

7

Lipinski's Rule of Five

true

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