SMILES:
CC(O)(c1ccc(N2CCN(S(=O)(=O)c3cccs3)CC2CC(=O)O)cc1)C(F)(F)FMolecular Processing
Molecular formula
C19H21F3N2O5S2
Molecular weight
478.51
Exact mass
478.0844
XLogP
2.87
TPSA
98.15
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
31
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.421
Molar refractivity
108.53
Supplementary Information
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