CSCC(S)C(=O)N1CCC[C@H]1C(=O)O
SMILES: CSCC(S)C(=O)N1CCC[C@H]1C(=O)O

Molecular Processing

Molecular formula
C9H15NO3S2
Molecular weight
249.36
Exact mass
249.0493
XLogP
0.72
TPSA
57.61
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
15
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
63.53

Supplementary Information

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