Molecule

ID:112503

General Information
Structure
MolImage
Molecular Formula
C₂₄H₅₀S₂
Molecular Mass
402.7838
Exact Mass
402.3353936
Charge
0
InChI
InChI=1S/C24H50S2/c1-7-9-11-13-15-17-19-21-23(3,4)25-26-24(5,6)22-20-18-16-14-12-10-8-2/h7-22H2,1-6H3
InChIKey
LEDIWWJKWAMGLD-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCC(SSC(CCCCCCCCC)(C)C)(C)C
Isomeric Smiles
CCCCCCCCCC(C)(C)SSC(C)(C)CCCCCCCCC
Calculated Properties
JChem
LogD (pH = 7.4)
10.57
LogD (pH = 5.5)
10.57
Log P
10.57
Rotatable Bonds
19
H Donor
0
H Acceptors
0
Lipinski's Rule of Five
false
Polar Surface Area
0.00
Polarizability
53.70
Molar Refractivity
128.05
LOG S
-12.52
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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