Molecule

ID:134872

General Information
Structure
MolImage
Molecular Formula
C₅H₁₀OS
Molecular Mass
118.1973
Exact Mass
118.04523594
Charge
0
InChI
InChI=1S/C5H10OS/c1-4-5(7)2-3-6-4/h4-5,7H,2-3H2,1H3
InChIKey
DBPHPBLAKVZXOY-UHFFFAOYSA-N
Canonic Smiles
SC1CCOC1C
Isomeric Smiles
CC1C(CCO1)S
Calculated Properties
JChem
Acid pKa
9.787928
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
0.86884123
LogD (pH = 7.4)
0.8672158
Log P
0.86886203
Molar Refractivity
32.445
Polarizability
12.960278
Polar Surface Area
9.23
Rotatable Bonds
0
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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