Molecule

ID:127161

General Information
Structure
MolImage
Molecular Formula
H₂O₇S₂
Molecular Mass
178.14168
Exact Mass
177.9241944
Charge
0
InChI
InChI=1S/H2O7S2/c1-8(2,3)7-9(4,5)6/h(H,1,2,3)(H,4,5,6)
InChIKey
VFNGKCDDZUSWLR-UHFFFAOYSA-N
Canonic Smiles
OS(=O)(=O)OS(=O)(=O)O
Isomeric Smiles
OS(=O)(=O)OS(=O)(=O)O
Calculated Properties
JChem
LogD (pH = 7.4)
-5.84
LogD (pH = 5.5)
-5.84
Log P
-1.08
Rotatable Bonds
2
H Donor
2
H Acceptors
6
Lipinski's Rule of Five
true
Acid pKa
-3.44
Polar Surface Area
117.97
Polarizability
11.66
Molar Refractivity
23.76
LOG S
0.63
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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