SMILES:
Nc1c(Oc2ccc(S(=O)(=O)F)cc2)cc(O)c2c1C(=O)c1ccccc1C2=OMolecular Processing
Molecular formula
C20H12FNO6S
Molecular weight
413.38
Exact mass
413.0369
XLogP
3.2
TPSA
123.76
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
29
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0
Molar refractivity
100.64
Supplementary Information
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