SMILES:
c1ccc2c(c1)[nH]c1cccc(OCC3CO3)c12Molecular Processing
Molecular formula
C15H13NO2
Molecular weight
239.27
Exact mass
239.0946
XLogP
3.1
TPSA
37.55
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
18
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
71.04
Supplementary Information
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