SMILES:
C[C@@H](O)[C@@H]1CCC(c2cc(F)c(F)c(F)c2)N1Molecular Processing
Molecular formula
C12H14F3NO
Molecular weight
245.24
Exact mass
245.1027
XLogP
2.28
TPSA
32.26
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
56.9
Supplementary Information
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