SMILES:
Ic1cnc2[nH]ccc2c1Molecular Processing
Molecular formula
C7H5IN2
Molecular weight
244.04
Exact mass
243.9497
XLogP
2.17
TPSA
28.68
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
10
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
48.81
Supplementary Information
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