C[C@@H](n1nnn(-c2ccc(OCC(F)(F)C(F)(F)F)cc2)c1=O)[C@@]1(c2ccc(F)cc2F)CO1
SMILES: C[C@@H](n1nnn(-c2ccc(OCC(F)(F)C(F)(F)F)cc2)c1=O)[C@@]1(c2ccc(F)cc2F)CO1

Molecular Processing

Molecular formula
C20H15F7N4O3
Molecular weight
492.35
Exact mass
492.1032
XLogP
3.77
TPSA
74.47
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
34
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.35
Molar refractivity
100.82

Supplementary Information

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