SMILES:
c1cnc2cc(OCCCNCC3COc4cc5c(cc4O3)OCO5)ccc2c1Molecular Processing
Molecular formula
C22H22N2O5
Molecular weight
394.43
Exact mass
394.1529
XLogP
3.16
TPSA
71.07
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
29
Rings
5
Aromatic rings
3
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.318
Molar refractivity
107.2
Supplementary Information
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