Molecule

ID:67065

General Information
Structure
MolImage
Molecular Formula
C₃H₂INO
Molecular Mass
194.95855
Exact Mass
194.91811169
Charge
0
InChI
InChI=1S/C3H2INO/c4-3-1-5-6-2-3/h1-2H
InChIKey
BKACOOKVHZFHEW-UHFFFAOYSA-N
Canonic Smiles
Ic1conc1
Isomeric Smiles
o1ncc(c1)I
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
1.2667357
LogD (pH = 7.4)
1.2667357
Log P
1.2667357
Molar Refractivity
30.8625
Polarizability
11.88367
Polar Surface Area
26.03
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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