SMILES:
COc1cccc(OC2COc3ccc(OCc4ccccn4)cc3C2O)c1Molecular Processing
Molecular formula
C22H21NO5
Molecular weight
379.41
Exact mass
379.142
XLogP
3.54
TPSA
70.04
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.227
Molar refractivity
102.88
Supplementary Information
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