SMILES:
CC(=O)SCCS(=O)(=O)N1CCCC1C(=O)OMolecular Processing
Molecular formula
C9H15NO5S2
Molecular weight
281.35
Exact mass
281.0392
XLogP
0.14
TPSA
91.75
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
17
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
64.29
Supplementary Information
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