SMILES:
O=C1Oc2ccccc2CN1C1CCN(CC(O)c2ccc3c(c2)OCO3)CC1Molecular Processing
Molecular formula
C22H24N2O5
Molecular weight
396.44
Exact mass
396.1685
XLogP
2.93
TPSA
71.47
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
29
Rings
5
Aromatic rings
2
Saturated rings
1
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
105
Supplementary Information
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