Name: product
SMILES:
COc1ccc(CS[C@H]2CO[C@@H](CO)[C@@H]2O)cc1Molecular Processing
Molecular formula
C13H18O4S
Molecular weight
270.35
Exact mass
270.0926
XLogP
1.05
TPSA
58.92
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
70.91
Supplementary Information
Details werden geladen…
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