SMILES:
Cc1cccc(-c2sc(C)nc2C(=O)O)c1Molecular Processing
Molecular formula
C12H11NO2S
Molecular weight
233.29
Exact mass
233.051
XLogP
3.13
TPSA
50.19
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
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
0.167
Molar refractivity
63.98
Supplementary Information
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