SMILES:
CC(=O)Nc1nc(C)c(-c2cnc(Cl)c(NC(=O)Nc3ccc(F)cc3F)c2)s1Molecular Processing
Molecular formula
C18H14ClF2N5O2S
Molecular weight
437.86
Exact mass
437.0525
XLogP
5.05
TPSA
96.01
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
108.4
Supplementary Information
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