SMILES:
CC(=O)c1ccc(Cn2ncc(NC(=O)c3ncoc3-c3cccc(OC(F)(F)F)c3)n2)o1Molecular Processing
Molecular formula
C20H14F3N5O5
Molecular weight
461.36
Exact mass
461.0947
XLogP
3.93
TPSA
125.28
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
33
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.15
Molar refractivity
104.41
Supplementary Information
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