Molecule

ID:23703

General Information
Structure
MolImage
Molecular Formula
C₁₄H₂₀N₂OSi
Molecular Mass
260.4069
Exact Mass
260.1344898
Charge
0
InChI
InChI=1S/C14H20N2OSi/c1-18(2,3)12-6-13-5-4-7-15-14(13)16-8-10-17-11-9-16/h4-5,7H,8-11H2,1-3H3
InChIKey
JZOKINPFTYKOIY-UHFFFAOYSA-N
Canonic Smiles
C[Si](C#Cc1cccnc1N1CCOCC1)(C)C
Isomeric Smiles
c1cnc(c(c1)C#C[Si](C)(C)C)N1CCOCC1
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
3.027072
LogD (pH = 7.4)
3.3480897
Log P
3.3543
Molar Refractivity
67.9543
Polarizability
28.931576
Polar Surface Area
25.36
Rotatable Bonds
3
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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