COc1cccc(CN(CC(O)C(Cc2cc(F)cc(F)c2)NC(=O)c2cc(C(=O)NC(C)c3ccc(F)cc3)cc(C(C)O)c2)C(=O)OC(C)(C)C)c1
SMILES: COc1cccc(CN(CC(O)C(Cc2cc(F)cc(F)c2)NC(=O)c2cc(C(=O)NC(C)c3ccc(F)cc3)cc(C(C)O)c2)C(=O)OC(C)(C)C)c1

Molecular Processing

Molecular formula
C41H46F3N3O7
Molecular weight
749.83
Exact mass
749.3288
XLogP
6.8
TPSA
137.43
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
14
Heavy atoms
54
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.341
Molar refractivity
196.32

Supplementary Information

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