Molecule

ID:136351

General Information
Structure
MolImage
Molecular Formula
C₂H₄INO
Molecular Mass
186.94903968
Exact Mass
186.94047143
Charge
0
InChI
InChI=1S/C2H4INO/c3-1-2(4)5/h1H2,(H2,4,5)/i1+1,2+1
InChIKey
PGLTVOMIXTUURA-ZDOIIHCHSA-N
Canonic Smiles
N[13C](=O)[13CH2]I
Isomeric Smiles
[13CH2]([13C](=O)N)I
Calculated Properties
JChem
Acid pKa
13.59649
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-0.08472746
LogD (pH = 7.4)
-0.08472721
Log P
-0.08472746
Molar Refractivity
27.5497
Polarizability
11.059936
Polar Surface Area
43.09
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
References
Bioactivity
Navigation