SMILES:
CCOc1c(Nc2ccccc2O)c(=O)c1=OMolecular Processing
Molecular formula
C12H11NO4
Molecular weight
233.22
Exact mass
233.0688
XLogP
1.13
TPSA
75.63
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
63.91
Supplementary Information
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