SMILES:
O=C(O)c1cccc(CC2COc3ccc(OCc4nc5cc(F)ccc5s4)cc3C2O)c1Molecular Processing
Molecular formula
C25H20FNO5S
Molecular weight
465.5
Exact mass
465.1046
XLogP
5
TPSA
88.88
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
33
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
121.4
Supplementary Information
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