SMILES:
CCc1ccc(Cc2ccc3sccc3c2)cc1Molecular Processing
Molecular formula
C17H16S
Molecular weight
252.38
Exact mass
252.0973
XLogP
5.05
TPSA
0
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
18
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.176
Molar refractivity
80.45
Supplementary Information
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