Molecule

ID:79049

General Information
Structure
MolImage
Molecular Formula
C₁₄H₁₀Cl₄S₂
Molecular Mass
384.1712
Exact Mass
381.89780304
Charge
0
InChI
InChI=1S/C14H10Cl4S2/c1-7-3-13(11(17)5-9(7)15)19-20-14-4-8(2)10(16)6-12(14)18/h3-6H,1-2H3
InChIKey
PJXJVCCMXWQPIM-UHFFFAOYSA-N
Canonic Smiles
Clc1cc(Cl)c(cc1SSc1cc(C)c(cc1Cl)Cl)C
Isomeric Smiles
S(c1c(cc(c(c1)C)Cl)Cl)Sc1cc(c(cc1Cl)Cl)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
8.016767
LogD (pH = 7.4)
8.016767
Log P
8.016767
Molar Refractivity
91.7618
Polarizability
37.10147
Polar Surface Area
0.0
Rotatable Bonds
3
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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