Molecule

ID:16204

General Information
Structure
MolImage
Molecular Formula
C₁₂H₁₉NOSi
Molecular Mass
221.37086
Exact Mass
221.12359077
Charge
0
InChI
InChI=1S/C12H19NOSi/c1-15(2,3)11-5-4-8-13-12(11)14-9-10-6-7-10/h4-5,8,10H,6-7,9H2,1-3H3
InChIKey
SWMZBIJARDLLKV-UHFFFAOYSA-N
Canonic Smiles
C[Si](c1cccnc1OCC1CC1)(C)C
Isomeric Smiles
c1(c(cccn1)[Si](C)(C)C)OCC1CC1
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
3.473903
LogD (pH = 7.4)
3.475085
Log P
3.4751
Molar Refractivity
58.6834
Polarizability
25.204094
Polar Surface Area
22.12
Rotatable Bonds
4
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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