SMILES:
O=C1CCC[C@@H]2CC[C@@H](c3c(F)cc(F)cc3F)N12Molecular Processing
Molecular formula
C14H14F3NO
Molecular weight
269.27
Exact mass
269.1027
XLogP
3.32
TPSA
20.31
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
62.78
Supplementary Information
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