Molecule

ID:112145

General Information
Structure
MolImage
Molecular Formula
Gd₂O₉Ti₃
Molecular Mass
602.0956
Exact Mass
603.64627648
Charge
0
InChI
InChI=1S/2Gd.9O.3Ti/q2*+3;;;;6*-1;;;
InChIKey
HBJROTVMAWSTFL-UHFFFAOYSA-N
Canonic Smiles
[O-][Ti](=O)[O-].[O-][Ti](=O)[O-].[O-][Ti](=O)[O-].[Gd+3].[Gd+3]
Isomeric Smiles
[Ti](=O)([O-])[O-].[Gd+3].[Gd+3].[Ti](=O)([O-])[O-].[Ti](=O)([O-])[O-]
Calculated Properties
JChem
Acid pKa
13.013199
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
-1.4238
LogD (pH = 7.4)
-1.4238011
Log P
-1.4238
Molar Refractivity
4.3287
Polarizability
5.2817564
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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