SMILES:
Fc1c(F)c(F)c(CSc2nnc(-c3ccc4[nH]cnc4c3)o2)c(F)c1FMolecular Processing
Molecular formula
C16H7F5N4OS
Molecular weight
398.32
Exact mass
398.0261
XLogP
4.6
TPSA
67.6
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
27
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
85.18
Supplementary Information
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