C[C@H](NC(=O)C(F)(F)F)[C@H](Oc1ccc2c(cnn2-c2ccc(CN(C)C)cc2)c1)c1ccccc1
SMILES: C[C@H](NC(=O)C(F)(F)F)[C@H](Oc1ccc2c(cnn2-c2ccc(CN(C)C)cc2)c1)c1ccccc1

Molecular Processing

Molecular formula
C27H27F3N4O2
Molecular weight
496.53
Exact mass
496.2086
XLogP
5.27
TPSA
59.39
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
36
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.259
Molar refractivity
131.93

Supplementary Information

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