SMILES:
CCCCCCCCC1COc2cscc2O1Molecular Processing
Molecular formula
C14H22O2S
Molecular weight
254.39
Exact mass
254.1341
XLogP
4.64
TPSA
18.46
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
72.22
Supplementary Information
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