Molecule

ID:32535

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₄N₂OSi
Molecular Mass
206.31646
Exact Mass
206.08753961
Charge
0
InChI
InChI=1S/C10H14N2OSi/c1-13-9-7-12-6-8(5-11)10(9)14(2,3)4/h6-7H,1-4H3
InChIKey
ZCNLVKRBBKJZFI-UHFFFAOYSA-N
Canonic Smiles
COc1cncc(c1[Si](C)(C)C)C#N
Isomeric Smiles
c1(cncc(c1[Si](C)(C)C)C#N)OC
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
1.8815861
LogD (pH = 7.4)
1.8815998
Log P
1.8816
Molar Refractivity
52.1495
Polarizability
22.23904
Polar Surface Area
45.91
Rotatable Bonds
2
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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