SMILES:
Cl.c1ccc(CCOCCNCCOCc2ccc(-c3nc4ccccc4o3)cc2)cc1Molecular Processing
Molecular formula
C26H29ClN2O3
Molecular weight
452.98
Exact mass
452.1867
XLogP
5.28
TPSA
56.52
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
12
Heavy atoms
32
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.269
Molar refractivity
130.18
Supplementary Information
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