Molecule

ID:77225

General Information
Structure
MolImage
Molecular Formula
C₄H₄INO
Molecular Mass
208.98513
Exact Mass
208.93376175
Charge
0
InChI
InChI=1S/C4H4INO/c1-3-4(5)2-6-7-3/h2H,1H3
InChIKey
NFLDXKDDDKVRSN-UHFFFAOYSA-N
Canonic Smiles
Ic1cnoc1C
Isomeric Smiles
n1cc(c(o1)C)I
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
1.4662961
LogD (pH = 7.4)
1.466297
Log P
1.466297
Molar Refractivity
36.0122
Polarizability
13.574103
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
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Molecule Details
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References
Bioactivity
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