Molecule

ID:70587

General Information
Structure
MolImage
Molecular Formula
C₄H₃IS
Molecular Mass
210.03609
Exact Mass
209.9000191
Charge
0
InChI
InChI=1S/C4H3IS/c5-4-1-2-6-3-4/h1-3H
InChIKey
WGKRMQIQXMJVFZ-UHFFFAOYSA-N
Canonic Smiles
Ic1cscc1
Isomeric Smiles
c1c(ccs1)I
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.6826322
LogD (pH = 7.4)
2.6826322
Log P
2.6826322
Molar Refractivity
36.5263
Polarizability
14.320378
Polar Surface Area
0.0
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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