Molecule

ID:1869

General Information

Structure

Molecular Formula

C₂H₆N₂

Molecular Mass

58.08244

Exact Mass

58.0530982

Charge

0

InChI

InChI=1S/C2H6N2/c3-1-2-4/h1,3H,2,4H2

InChIKey

AXQVKDQRBAXYBP-UHFFFAOYSA-N

Canonic Smiles

NCC=N

Isomeric Smiles

NCC=N

Calculated Properties

JChem

H Acceptors

2

H Donor

2

LogD (pH = 5.5)

-5.2279673

LogD (pH = 7.4)

-3.9545991

Log P

-1.2934303

Molar Refractivity

27.55

Polarizability

6.666726

Polar Surface Area

49.87

Rotatable Bonds

1

Lipinski's Rule of Five

true

ALOGPS 2.1

Log P

-2.14

LOG S

-0.71

Solubility (Water)

1.14e+01 g/l

Data Source

Names and Identifiers

Registration numbers

Properties

No Data Available

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Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

References

Bioactivity