Molecule

ID:110231

General Information
Structure
MolImage
Molecular Formula
H₆Mg₂O₁₀P₂
Molecular Mass
276.599162
Exact Mass
275.91370305
Charge
0
InChI
InChI=1S/2Mg.H4O7P2.3H2O/c;;1-8(2,3)7-9(4,5)6;;;/h;;(H2,1,2,3)(H2,4,5,6);3*1H2/q2*+2;;;;/p-4
InChIKey
XWHWRJHBMHTBFR-UHFFFAOYSA-J
Canonic Smiles
[O-]P(=O)(OP(=O)([O-])[O-])[O-].O.O.O.[Mg+2].[Mg+2]
Isomeric Smiles
O.O.O.[Mg+2].[Mg+2].[O-]P(=O)([O-])OP(=O)([O-])[O-]
Calculated Properties
JChem
Acid pKa
1.7026764
H Acceptors
6
H Donor
0
LogD (pH = 5.5)
-5.945248
LogD (pH = 7.4)
-6.9029593
Log P
-1.4419023
Molar Refractivity
21.038
Polarizability
10.301113
Polar Surface Area
135.61
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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