SMILES:
CCOC(=O)C(N)CCSCMolecular Processing
Molecular formula
C7H15NO2S
Molecular weight
177.27
Exact mass
177.0823
XLogP
0.63
TPSA
52.32
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
11
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.857
Molar refractivity
47.61
Supplementary Information
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