SMILES:
COC(=O)C1(Oc2ccc(O)nc2)CC1Molecular Processing
Molecular formula
C10H11NO4
Molecular weight
209.2
Exact mass
209.0688
XLogP
0.87
TPSA
68.65
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
50.51
Supplementary Information
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