SMILES:
CS(=O)c1cccc2c(-c3ccncn3)c(-c3ccc(F)cc3)nn12Molecular Processing
Molecular formula
C18H13FN4OS
Molecular weight
352.39
Exact mass
352.0794
XLogP
3.33
TPSA
60.15
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
25
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.056
Molar refractivity
93.94
Supplementary Information
Details werden geladen…
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