SMILES:
COc1ccc(NC2CC2)c(S(N)(=O)=O)c1Molecular Processing
Molecular formula
C10H14N2O3S
Molecular weight
242.3
Exact mass
242.0725
XLogP
0.92
TPSA
81.42
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
61.01
Supplementary Information
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