Nombre: compound C
SMILES:
COC(=O)c1ccccc1-c1nc2cc(C)ccc2o1Molecular Processing
Molecular formula
C16H13NO3
Molecular weight
267.28
Exact mass
267.0895
XLogP
3.59
TPSA
52.33
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
20
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
75.52
Supplementary Information
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