SMILES:
COc1cccc(C(=O)NC(=S)Nc2ccc(Oc3ccnc4cc(OC)c(OC)cc34)cc2F)c1Molecular Processing
Molecular formula
C26H22FN3O5S
Molecular weight
507.54
Exact mass
507.1264
XLogP
5.32
TPSA
90.94
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
36
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.115
Molar refractivity
138
Supplementary Information
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