COc1cccc([C@@H](Oc2ccc3c(cnn3-c3ccc(F)cc3)c2)[C@H](C)NC(=O)C(C)(F)F)c1
SMILES: COc1cccc([C@@H](Oc2ccc3c(cnn3-c3ccc(F)cc3)c2)[C@H](C)NC(=O)C(C)(F)F)c1

Molecular Processing

Molecular formula
C26H24F3N3O3
Molecular weight
483.49
Exact mass
483.177
XLogP
5.45
TPSA
65.38
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
35
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
0.231
Molar refractivity
125.62

Supplementary Information

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