SMILES:
CCOc1cccc(C(O)c2ncccc2OC)c1Molecular Processing
Molecular formula
C15H17NO3
Molecular weight
259.3
Exact mass
259.1208
XLogP
2.57
TPSA
51.58
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
72.46
Supplementary Information
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