Molecule

ID:90306

General Information
Structure
MolImage
Molecular Formula
C₃H₅KOS₂
Molecular Mass
160.2995
Exact Mass
159.94188846
Charge
0
InChI
InChI=1S/C3H6OS2.K/c1-2-4-3(5)6;/h2H2,1H3,(H,5,6);/q;+1/p-1
InChIKey
JCBJVAJGLKENNC-UHFFFAOYSA-M
Canonic Smiles
CCOC(=S)S[K]
Isomeric Smiles
S(C(=S)OCC)[K]
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
0.4886
LogD (pH = 7.4)
0.4886
Log P
0.4886
Molar Refractivity
32.5225
Polarizability
15.668784
Polar Surface Area
9.23
Rotatable Bonds
3
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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