SMILES:
CCNC(=O)c1ccncc1Nc1ccc(I)cc1FMolecular Processing
Molecular formula
C14H13FIN3O
Molecular weight
385.18
Exact mass
385.0087
XLogP
3.32
TPSA
54.02
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
20
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
0.143
Molar refractivity
84.64
Supplementary Information
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