Molecule

ID:136206

General Information
Structure
MolImage
Molecular Formula
C₁₈H₃₆S
Molecular Mass
284.54344
Exact Mass
284.25377215
Charge
0
InChI
InChI=1S/C18H36S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h9-10,19H,2-8,11-18H2,1H3/b10-9-
InChIKey
LJLJPBMSWIYGOA-KTKRTIGZSA-N
Canonic Smiles
CCCCCCCC/C=C\CCCCCCCCS
Isomeric Smiles
CCCCCCCC/C=C\CCCCCCCCS
Calculated Properties
JChem
Acid pKa
10.200824
H Acceptors
0
H Donor
1
LogD (pH = 5.5)
7.918723
LogD (pH = 7.4)
7.918094
Log P
7.918731
Molar Refractivity
93.6941
Polarizability
36.79313
Polar Surface Area
0.0
Rotatable Bonds
15
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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