CNC(=O)N1CCN(S(=O)(=O)c2ccc(OCc3cc(F)ccc3C)cc2)C(C(=O)O)C1C
SMILES: CNC(=O)N1CCN(S(=O)(=O)c2ccc(OCc3cc(F)ccc3C)cc2)C(C(=O)O)C1C

Molecular Processing

Molecular formula
C22H26FN3O6S
Molecular weight
479.53
Exact mass
479.1526
XLogP
2.2
TPSA
116.25
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
33
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
117.85

Supplementary Information

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