SMILES:
C=CCN1CCC23c4c5ccc(O)c4OC2C(=O)CCC3(O)C1C5Molecular Processing
Molecular formula
C19H21NO4
Molecular weight
327.38
Exact mass
327.1471
XLogP
1.3
TPSA
70
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
24
Rings
5
Aromatic rings
1
Saturated rings
2
Aliphatic rings
4
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.526
Molar refractivity
87.27
Supplementary Information
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