O=C(Nc1ccc(C(F)(F)F)cc1)NC(c1ccccc1)C(NC(=O)NC12CC3CC(CC(C3)C1)C2)c1ccccc1
SMILES: O=C(Nc1ccc(C(F)(F)F)cc1)NC(c1ccccc1)C(NC(=O)NC12CC3CC(CC(C3)C1)C2)c1ccccc1

Molecular Processing

Molecular formula
C33H35F3N4O2
Molecular weight
576.66
Exact mass
576.2712
XLogP
7.58
TPSA
82.26
H-bond donors
4
H-bond acceptors
2
Rotatable bonds
7
Heavy atoms
42
Rings
7
Aromatic rings
3
Saturated rings
4
Aliphatic rings
4
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.394
Molar refractivity
154.53

Supplementary Information

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