SMILES:
Fc1ccc(-c2cc(N3CCC(c4ncc[nH]4)CC3)c3sccc3n2)cc1Molecular Processing
Molecular formula
C21H19FN4S
Molecular weight
378.48
Exact mass
378.1314
XLogP
5.21
TPSA
44.81
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
27
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.238
Molar refractivity
107.79
Supplementary Information
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