SMILES:
NS(=O)(=O)c1cc(C(=O)O)c(NCc2ccco2)cc1ClMolecular Processing
Molecular formula
C12H11ClN2O5S
Molecular weight
330.75
Exact mass
330.0077
XLogP
1.89
TPSA
122.63
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
75.82
Supplementary Information
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