SMILES:
CC(=O)Nc1ccc(OCCCN(CC(F)(F)F)c2ccc(C#N)c(C(F)(F)F)c2)cc1Molecular Processing
Molecular formula
C21H19F6N3O2
Molecular weight
459.39
Exact mass
459.1381
XLogP
5.37
TPSA
65.36
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
32
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
105.28
Supplementary Information
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