SMILES:
NCC[C@@H](O)c1ccc(OCC2CCCCC2)s1Molecular Processing
Molecular formula
C14H23NO2S
Molecular weight
269.41
Exact mass
269.1449
XLogP
3.09
TPSA
55.48
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
75.02
Supplementary Information
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