SMILES:
Cc1nc[nH]c1C=C1C(=O)Nc2ccc(F)c(I)c21Molecular Processing
Molecular formula
C13H9FIN3O
Molecular weight
369.14
Exact mass
368.9774
XLogP
2.95
TPSA
57.78
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
78.94
Supplementary Information
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