SMILES:
CC(=O)Nc1cccc(S(N)(=O)=O)c1Molecular Processing
Molecular formula
C8H10N2O3S
Molecular weight
214.25
Exact mass
214.0412
XLogP
0.29
TPSA
89.26
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
52.12
Supplementary Information
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