SMILES:
COC(=O)[C@H]1CC[C@H](c2nsc(C)n2)CC1Molecular Processing
Molecular formula
C11H16N2O2S
Molecular weight
240.33
Exact mass
240.0932
XLogP
2.29
TPSA
52.08
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.727
Molar refractivity
61.36
Supplementary Information
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