Molecule

ID:105590

General Information
Structure
MolImage
Molecular Formula
H₁₅Na₂O₁₁P
Molecular Mass
268.065801
Exact Mass
268.01473649
Charge
0
InChI
InChI=1S/2Na.H3O4P.7H2O/c;;1-5(2,3)4;;;;;;;/h;;(H3,1,2,3,4);7*1H2/q2*+1;;;;;;;;/p-2
InChIKey
PYLIXCKOHOHGKQ-UHFFFAOYSA-L
Canonic Smiles
[O-]P(=O)(O)[O-].O.O.O.O.O.O.O.[Na+].[Na+]
Isomeric Smiles
O.O.O.O.O.O.O.[Na+].[Na+].OP(=O)([O-])[O-]
Calculated Properties
JChem
Acid pKa
1.7961261
H Acceptors
4
H Donor
1
LogD (pH = 5.5)
-3.3916447
LogD (pH = 7.4)
-3.9718332
Log P
-1.0201038
Molar Refractivity
12.4085
Polarizability
5.685633
Polar Surface Area
83.42
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
References
Bioactivity
Navigation