Molecule

ID:71233

General Information
Structure
Molecular Formula
C₁₈H₃₇NSSiSn
Molecular Mass
446.34458
Exact Mass
447.14379172
Charge
0
InChI
InChI=1S/C6H10NSSi.3C4H9.Sn/c1-9(2,3)6-7-4-5-8-6;3*1-3-4-2;/h5H,1-3H3;3*1,3-4H2,2H3;
InChIKey
WNNGESKFUIMQQE-UHFFFAOYSA-N
Canonic Smiles
CCCC[Sn](c1csc(n1)[Si](C)(C)C)(CCCC)CCCC
Isomeric Smiles
C[Si](C)(C)c1nc(cs1)[Sn](CCCC)(CCCC)CCCC
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
6.664715
LogD (pH = 7.4)
6.6737833
Log P
6.6739
Molar Refractivity
94.9488
Polarizability
44.00778
Polar Surface Area
12.89
Rotatable Bonds
11
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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