SMILES:
NC(=O)c1ccncc1Nc1ccc(I)cc1FMolecular Processing
Molecular formula
C12H9FIN3O
Molecular weight
357.13
Exact mass
356.9774
XLogP
2.67
TPSA
68.01
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
75.15
Supplementary Information
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