SMILES:
COc1cc2ccc(=O)oc2cc1OCC(O)CN1CCC(c2ccccc2)CC1Molecular Processing
Molecular formula
C24H27NO5
Molecular weight
409.48
Exact mass
409.1889
XLogP
3.42
TPSA
72.14
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
115.39
Supplementary Information
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