Molecule

ID:104272

General Information
Structure
MolImage
Molecular Formula
H₁₂MgO₉S₂
Molecular Mass
244.52488
Exact Mass
243.97731566
Charge
0
InChI
InChI=1S/Mg.H2O3S2.6H2O/c;1-5(2,3)4;;;;;;/h;(H2,1,2,3,4);6*1H2/q+2;;;;;;;/p-2
InChIKey
CQDMJJVHDPDPHO-UHFFFAOYSA-L
Canonic Smiles
[O-]S(=S)(=O)[O-].O.O.O.O.O.O.[Mg+2]
Isomeric Smiles
O.O.O.O.O.O.[Mg+2].[O-]S(=O)(=S)[O-]
Calculated Properties
JChem
Acid pKa
2.69897
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
-2.1907825
LogD (pH = 7.4)
-2.3771908
Log P
0.048317563
Molar Refractivity
19.5183
Polarizability
9.065478
Polar Surface Area
63.19
Rotatable Bonds
0
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
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