SMILES:
Cc1cc(C(=O)O)c(Nc2ccc(I)cc2F)cn1Molecular Processing
Molecular formula
C13H10FIN2O2
Molecular weight
372.14
Exact mass
371.9771
XLogP
3.58
TPSA
62.22
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
19
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
0.077
Molar refractivity
78.33
Supplementary Information
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