CNS(=O)(=O)c1ccc(N2CCC(CO)C2)c(C(=O)O)c1
SMILES: CNS(=O)(=O)c1ccc(N2CCC(CO)C2)c(C(=O)O)c1

Molecular Processing

Molecular formula
C13H18N2O5S
Molecular weight
314.36
Exact mass
314.0936
XLogP
0.11
TPSA
106.94
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
77.05

Supplementary Information

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