SMILES:
COc1ccc(S(=O)(=O)C2CCNCC2)cc1Molecular Processing
Molecular formula
C12H17NO3S
Molecular weight
255.34
Exact mass
255.0929
XLogP
1.22
TPSA
55.4
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
66.07
Supplementary Information
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