Molecule

ID:112429

General Information
Structure
MolImage
Molecular Formula
C₃₆H₃₀OSn₂
Molecular Mass
716.0248
Exact Mass
718.03405358
Charge
0
InChI
InChI=1S/6C6H5.O.2Sn/c6*1-2-4-6-5-3-1;;;/h6*1-5H;;;
InChIKey
MUHFQLVFMFDJOK-UHFFFAOYSA-N
Canonic Smiles
c1ccc(cc1)[Sn](c1ccccc1)(c1ccccc1)O[Sn](c1ccccc1)(c1ccccc1)c1ccccc1
Isomeric Smiles
O([Sn](c1ccccc1)(c1ccccc1)c1ccccc1)[Sn](c1ccccc1)(c1ccccc1)c1ccccc1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
6.5644
LogD (pH = 7.4)
6.5644
Log P
6.5644
Molar Refractivity
154.196
Polarizability
69.57726
Polar Surface Area
9.23
Rotatable Bonds
8
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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