SMILES:
O=C(OCc1ccccc1)N1CCC(c2ccc(O)cc2)C(O)C1Molecular Processing
Molecular formula
C19H21NO4
Molecular weight
327.38
Exact mass
327.1471
XLogP
2.88
TPSA
70
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
89.67
Supplementary Information
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