SMILES:
O=S(=O)(C1CC1)N1CCC(Nc2nccc(-c3c(-c4ccc(F)c(O)c4)nc4sccn34)n2)CC1Molecular Processing
Molecular formula
C23H23FN6O3S2
Molecular weight
514.61
Exact mass
514.1257
XLogP
3.73
TPSA
112.72
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
35
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
131.31
Supplementary Information
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