SMILES:
COc1cccc(NC(=O)OCC2CCC(CN(Cc3ccccc3)S(=O)(=O)NC(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)c1Molecular Processing
Molecular formula
C32H33F6N3O6S
Molecular weight
701.69
Exact mass
701.1994
XLogP
7.26
TPSA
114.04
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
48
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
16
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
163.1
Supplementary Information
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