COC(=O)C(NC(=O)C1CCCS1)C(C)C
SMILES: COC(=O)C(NC(=O)C1CCCS1)C(C)C

Molecular Processing

Molecular formula
C11H19NO3S
Molecular weight
245.34
Exact mass
245.1086
XLogP
1.2
TPSA
55.4
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
16
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.818
Molar refractivity
64.26

Supplementary Information

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