Molecule

ID:130637

General Information
Structure
MolImage
Molecular Formula
H₁₃NNaO₈P
Molecular Mass
209.068651
Exact Mass
209.02764729
Charge
0
InChI
InChI=1S/H3N.Na.H3O4P.4H2O/c;;1-5(2,3)4;;;;/h1H3;;(H3,1,2,3,4);4*1H2/q;+1;;;;;/p-1
InChIKey
IQTQISLCLWJRPM-UHFFFAOYSA-M
Canonic Smiles
[O-]P(=O)(O)O.N.O.O.O.O.[Na+]
Isomeric Smiles
N.O.O.O.O.OP(=O)(O)[O-].[Na+]
Calculated Properties
JChem
Acid pKa
1.7961261
H Acceptors
4
H Donor
2
LogD (pH = 5.5)
-3.3916447
LogD (pH = 7.4)
-3.9718332
Log P
-1.0201038
Molar Refractivity
13.5302
Polarizability
5.806723
Polar Surface Area
80.59
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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