Molecule

ID:123417

General Information

Structure

MolImage

Molecular Formula

C₂H₆N₂S

Molecular Mass

90.14744

Exact Mass

90.0251692

Charge

0

InChI

InChI=1S/C2H6N2S/c1-5-2(3)4/h1H3,(H3,3,4)

InChIKey

SDDKIZNHOCEXTF-UHFFFAOYSA-N

Canonic Smiles

CSC(=N)N

Isomeric Smiles

C(=N)(SC)N

Calculated Properties

JChem

H Acceptors

2

H Donor

2

LogD (pH = 5.5)

-2.0011563

LogD (pH = 7.4)

-1.9397736

Log P

0.4134605

Molar Refractivity

34.9793

Polarizability

9.368552

Polar Surface Area

49.87

Rotatable Bonds

1

Lipinski's Rule of Five

true

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

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References

Bioactivity