Molecule

ID:51664

General Information
Structure
MolImage
Molecular Formula
C₂₁H₃₃FN₂Si₂
Molecular Mass
388.6695232
Exact Mass
388.21663035
Charge
0
InChI
InChI=1S/C21H33FN2Si2/c1-15(2)26(16(3)4,17(5)6)24-12-10-19-18(11-13-25(7,8)9)20(22)14-23-21(19)24/h10,12,14-17H,1-9H3
InChIKey
DQSQFVRJMSFYEU-UHFFFAOYSA-N
Canonic Smiles
Fc1cnc2c(c1C#C[Si](C)(C)C)ccn2[Si](C(C)C)(C(C)C)C(C)C
Isomeric Smiles
c1(cnc2c(c1C#C[Si](C)(C)C)ccn2[Si](C(C)C)(C(C)C)C(C)C)F
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
6.634122
LogD (pH = 7.4)
6.634199
Log P
6.6342
Molar Refractivity
100.6796
Polarizability
44.173187
Polar Surface Area
17.82
Rotatable Bonds
6
Lipinski's Rule of Five
false
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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