SMILES:
Fc1ccc(C2(C(F)(F)c3ccc(OC4CC4(F)F)cn3)CO2)c(F)c1Molecular Processing
Molecular formula
C17H11F6NO2
Molecular weight
375.27
Exact mass
375.0694
XLogP
4.16
TPSA
34.65
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
26
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.353
Molar refractivity
76.1
Supplementary Information
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