SMILES:
NNc1ccc(I)cc1Molecular Processing
Molecular formula
C6H7IN2
Molecular weight
234.04
Exact mass
233.9654
XLogP
1.58
TPSA
38.05
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
9
Rings
1
Aromatic rings
1
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
46.97
Supplementary Information
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