Molecule

ID:129505

General Information
Structure
MolImage
Molecular Formula
AlH₃NaO₈S₂
Molecular Mass
245.120328
Exact Mass
244.89824197
Charge
0
InChI
InChI=1S/Al.Na.2H2O4S/c;;2*1-5(2,3)4/h;;2*(H2,1,2,3,4)/q+3;+1;;/p-4
InChIKey
GJPYYNMJTJNYTO-UHFFFAOYSA-J
Canonic Smiles
[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Na+].[AlH3+3]
Isomeric Smiles
[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Na+].[AlH3+3]
Calculated Properties
JChem
Acid pKa
-3.034349
H Acceptors
4
H Donor
0
LogD (pH = 5.5)
-5.569452
LogD (pH = 7.4)
-5.594027
Log P
-0.841552
Molar Refractivity
11.5274
Polarizability
6.037845
Polar Surface Area
80.26
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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