SMILES:
Fc1ccc(SC2CC2)cc1Molecular Processing
Molecular formula
C9H9FS
Molecular weight
168.24
Exact mass
168.0409
XLogP
3.08
TPSA
0
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
11
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
45.28
Supplementary Information
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