Molecule

ID:63133

General Information

Structure

MolImage

Molecular Formula

C₄H₁₀N₂

Molecular Mass

86.1356

Exact Mass

86.08439833

Charge

0

InChI

InChI=1S/C4H10N2/c1-6-2-4(5)3-6/h4H,2-3,5H2,1H3

InChIKey

BIWZYRJXBPPLLA-UHFFFAOYSA-N

Canonic Smiles

NC1CN(C1)C

Isomeric Smiles

C1C(CN1C)N

Calculated Properties

JChem

H Acceptors

2

H Donor

1

LogD (pH = 5.5)

-3.7106419

LogD (pH = 7.4)

-2.3506057

Log P

-0.7185722

Molar Refractivity

25.6391

Polarizability

10.427217

Polar Surface Area

29.26

Rotatable Bonds

0

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Registration numbers

Properties

Related Proteins

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Molecular Spectra

No Data Available

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Molecule Details

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References

Bioactivity