SMILES:
CCOC(=O)c1cc2cc(N)ccc2o1Molecular Processing
Molecular formula
C11H11NO3
Molecular weight
205.21
Exact mass
205.0739
XLogP
2.19
TPSA
65.46
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
56.58
Supplementary Information
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