SMILES:
CNC(=O)c1c(-c2ccc(F)cc2)sc2ccc(-c3cccc(C(=O)O)c3)cc12Molecular Processing
Molecular formula
C23H16FNO3S
Molecular weight
405.45
Exact mass
405.0835
XLogP
5.43
TPSA
66.4
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
29
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.043
Molar refractivity
113
Supplementary Information
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