Molecule

ID:51613

General Information
Structure
MolImage
Molecular Formula
C₁₆H₂₇FN₂OSi
Molecular Mass
310.4822832
Exact Mass
310.18766825
Charge
0
InChI
InChI=1S/C16H27FN2OSi/c1-16(2,3)21(4,5)20-12-13-9-10-19(11-13)15-8-6-7-14(17)18-15/h6-8,13H,9-12H2,1-5H3
InChIKey
OBODMQKCOATHFD-UHFFFAOYSA-N
Canonic Smiles
Fc1cccc(n1)N1CCC(C1)CO[Si](C(C)(C)C)(C)C
Isomeric Smiles
c1c(nc(cc1)N1CCC(C1)CO[Si](C(C)(C)C)(C)C)F
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
4.483996
LogD (pH = 7.4)
4.4839997
Log P
4.484
Molar Refractivity
83.5649
Polarizability
33.383717
Polar Surface Area
25.36
Rotatable Bonds
5
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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