SMILES:
COc1cccc(NC(=O)c2cccs2)c1Molecular Processing
Molecular formula
C12H11NO2S
Molecular weight
233.29
Exact mass
233.051
XLogP
3.01
TPSA
38.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
65.27
Supplementary Information
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