Molecule

ID:74015

General Information
Structure
MolImage
Molecular Formula
C₂₀H₃₄OSn
Molecular Mass
409.18436
Exact Mass
410.16315971
Charge
0
InChI
InChI=1S/C8H7O.3C4H9.Sn/c1-2-4-8-7(3-1)5-6-9-8;3*1-3-4-2;/h2-4H,5-6H2;3*1,3-4H2,2H3;
InChIKey
JNVDHTDXUJFBEJ-UHFFFAOYSA-N
Canonic Smiles
CCCC[Sn](c1ccc2c(c1)CCO2)(CCCC)CCCC
Isomeric Smiles
O1c2c(cc(cc2)[Sn](CCCC)(CCCC)CCCC)CC1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
4.8599
LogD (pH = 7.4)
4.8599
Log P
4.8599
Molar Refractivity
93.6628
Polarizability
41.285294
Polar Surface Area
9.23
Rotatable Bonds
10
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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