Molecule

ID:89615

General Information
Structure
MolImage
Molecular Formula
C₂₄H₄₃NSn
Molecular Mass
464.30592
Exact Mass
465.24174438
Charge
0
InChI
InChI=1S/C12H16N.3C4H9.Sn/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;3*1-3-4-2;/h3-4,7-8H,2,5-6,9-11H2;3*1,3-4H2,2H3;
InChIKey
SUFFWOBYJVBIKI-UHFFFAOYSA-N
Canonic Smiles
CCCC[Sn](c1ccc(cc1)CN1CCCCC1)(CCCC)CCCC
Isomeric Smiles
[Sn](c1ccc(cc1)CN1CCCCC1)(CCCC)(CCCC)CCCC
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
3.8815193
LogD (pH = 7.4)
5.4597616
Log P
5.7397
Molar Refractivity
114.5747
Polarizability
49.544235
Polar Surface Area
3.24
Rotatable Bonds
12
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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