SMILES:
Ic1cccc2c1CNC2Molecular Processing
Molecular formula
C8H8IN
Molecular weight
245.06
Exact mass
244.9701
XLogP
1.89
TPSA
12.03
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
10
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
49.7
Supplementary Information
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