Molecule

ID:92028

General Information
Structure
MolImage
Molecular Formula
C₄H₁₀O₂S₃
Molecular Mass
186.316
Exact Mass
185.98429256
Charge
0
InChI
InChI=1S/C4H10O2S3/c5-9(6,3-1-7)4-2-8/h7-8H,1-4H2
InChIKey
YWXCBLUCVBSYNJ-UHFFFAOYSA-N
Canonic Smiles
SCCS(=O)(=O)CCS
Isomeric Smiles
SCCS(=O)(=O)CCS
Calculated Properties
JChem
Acid pKa
9.741186
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-0.18589659
LogD (pH = 7.4)
-0.18770848
Log P
-0.18587346
Molar Refractivity
44.4896
Polarizability
18.425219
Polar Surface Area
34.14
Rotatable Bonds
4
Lipinski's Rule of Five
true
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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