SMILES:
CCCCC[C@@H](O)C#CCN(CCCCCCC(=O)O)S(C)(=O)=OMolecular Processing
Molecular formula
C17H31NO5S
Molecular weight
361.5
Exact mass
361.1923
XLogP
2.23
TPSA
94.91
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
13
Heavy atoms
24
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.824
Molar refractivity
95.06
Supplementary Information
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