Molecule

ID:108880

General Information
Structure
MolImage
Molecular Formula
C₆Nd₂O₁₈Pr₂
Molecular Mass
930.3487
Exact Mass
925.53921316
Charge
0
InChI
InChI=1S/6CH2O3.2Nd.2Pr/c6*2-1(3)4;;;;/h6*(H2,2,3,4);;;;/q;;;;;;4*+3/p-12
InChIKey
IJSJWQMRIKFYLC-UHFFFAOYSA-B
Canonic Smiles
[O-]C(=O)[O-].[O-]C(=O)[O-].[O-]C(=O)[O-].[O-]C(=O)[O-].[O-]C(=O)[O-].[O-]C(=O)[O-].[Pr+3].[Pr+3].[Nd+3].[Nd+3]
Isomeric Smiles
[Pr+3].[Pr+3].[Nd+3].[Nd+3].[O-]C(=O)[O-].[O-]C(=O)[O-].[O-]C(=O)[O-].[O-]C(=O)[O-].[O-]C(=O)[O-].[O-]C(=O)[O-]
Calculated Properties
JChem
Acid pKa
6.0525417
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
0.142811
LogD (pH = 7.4)
-1.1138874
Log P
0.25005138
Molar Refractivity
31.1724
Polarizability
3.6386902
Polar Surface Area
63.19
Rotatable Bonds
0
Lipinski's Rule of Five
false
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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