Molecule

ID:129658

General Information
Structure
MolImage
Molecular Formula
C₄H₈Cl₂S
Molecular Mass
159.07732
Exact Mass
157.97237662
Charge
0
InChI
InChI=1S/C4H8Cl2S/c5-1-3-7-4-2-6/h1-4H2
InChIKey
QKSKPIVNLNLAAV-UHFFFAOYSA-N
Canonic Smiles
ClCCSCCCl
Isomeric Smiles
ClCCSCCCl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.0331883
LogD (pH = 7.4)
2.0331883
Log P
2.0331883
Molar Refractivity
37.9847
Polarizability
14.857155
Polar Surface Area
0.0
Rotatable Bonds
4
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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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
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Bioactivity
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