Molecule

ID:51553

General Information
Structure
MolImage
Molecular Formula
C₂₀H₃₁FN₂O₃Si
Molecular Mass
394.5556432
Exact Mass
394.20879761
Charge
0
InChI
InChI=1S/C20H31FN2O3Si/c1-20(2,3)27(5,6)26-14-15-11-12-23(13-15)17-9-7-16(19(21)22-17)8-10-18(24)25-4/h7-10,15H,11-14H2,1-6H3/b10-8+
InChIKey
GGMHRSYCQVVHIK-CSKARUKUSA-N
Canonic Smiles
COC(=O)/C=C/c1ccc(nc1F)N1CCC(C1)CO[Si](C(C)(C)C)(C)C
Isomeric Smiles
c1(c(nc(cc1)N1CCC(C1)CO[Si](C(C)(C)C)(C)C)F)/C=C/C(=O)OC
Calculated Properties
JChem
H Acceptors
4
H Donor
0
LogD (pH = 5.5)
5.5701976
LogD (pH = 7.4)
5.5702
Log P
5.5702
Molar Refractivity
105.3359
Polarizability
41.368843
Polar Surface Area
51.66
Rotatable Bonds
8
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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