SMILES:
O=C(NC1CCc2ccccc21)c1ccc2c(c1)OCO2Molecular Processing
Molecular formula
C17H15NO3
Molecular weight
281.31
Exact mass
281.1052
XLogP
2.83
TPSA
47.56
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
21
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
77.54
Supplementary Information
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