Molecule

ID:135403

General Information
Structure
MolImage
Molecular Formula
C₄H₁₀S
Molecular Mass
90.1872
Exact Mass
90.05032132
Charge
0
InChI
InChI=1S/C4H10S/c1-3-4(2)5/h4-5H,3H2,1-2H3
InChIKey
LOCHFZBWPCLPAN-UHFFFAOYSA-N
Canonic Smiles
CCC(S)C
Isomeric Smiles
CCC(C)S
Calculated Properties
JChem
Acid pKa
10.09715
H Acceptors
0
H Donor
1
LogD (pH = 5.5)
1.9249096
LogD (pH = 7.4)
1.9241111
Log P
1.9249197
Molar Refractivity
28.0305
Polarizability
11.168704
Polar Surface Area
0.0
Rotatable Bonds
1
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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