Molecule

ID:78250

General Information
Structure
MolImage
Molecular Formula
C₁₆H₄₀HfN₄
Molecular Mass
467.0056
Exact Mass
468.2718473
Charge
0
InChI
InChI=1S/4C4H10N.Hf/c4*1-3-5-4-2;/h4*3-4H2,1-2H3;/q4*-1;+4
InChIKey
VBCSQFQVDXIOJL-UHFFFAOYSA-N
Canonic Smiles
CCN([Hf](N(CC)CC)(N(CC)CC)N(CC)CC)CC
Isomeric Smiles
[Hf](N(CC)CC)(N(CC)CC)(N(CC)CC)N(CC)CC
Calculated Properties
JChem
H Acceptors
4
H Donor
0
LogD (pH = 5.5)
-3.4659846
LogD (pH = 7.4)
-1.7981569
Log P
1.8928
Molar Refractivity
93.5624
Polarizability
43.16742
Polar Surface Area
12.96
Rotatable Bonds
12
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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