SMILES:
CC(SC(=S)Cc1ccccc1)C(=O)OMolecular Processing
Molecular formula
C11H12O2S2
Molecular weight
240.35
Exact mass
240.0279
XLogP
2.76
TPSA
37.3
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
67.43
Supplementary Information
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