SMILES:
COC1CNC2C(O)COC12Molecular Processing
Molecular formula
C7H13NO3
Molecular weight
159.18
Exact mass
159.0895
XLogP
-1.27
TPSA
50.72
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
11
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
1
Molar refractivity
38.33
Supplementary Information
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