SMILES:
CC(C)(C)OC(=O)N1CCC(c2ccc(OCCOc3ccccc3)cc2)C(O)C1Molecular Processing
Molecular formula
C24H31NO5
Molecular weight
413.51
Exact mass
413.2202
XLogP
4.23
TPSA
68.23
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
30
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.458
Molar refractivity
115.05
Supplementary Information
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