SMILES:
CC(C)(C)OC(=O)NCCC(O)c1nccs1Molecular Processing
Molecular formula
C11H18N2O3S
Molecular weight
258.34
Exact mass
258.1038
XLogP
2.09
TPSA
71.45
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.636
Molar refractivity
65.93
Supplementary Information
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