SMILES:
N#Cc1ccc(Cc2cc([C@@H]3O[C@H](COCc4ccccc4)[C@@H](OCc4ccccc4)[C@H](OCc4ccccc4)[C@H]3OCc3ccccc3)ccc2Cl)nn1Molecular Processing
Molecular formula
C46H42ClN3O5
Molecular weight
752.31
Exact mass
751.2813
XLogP
9.01
TPSA
95.72
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
16
Heavy atoms
55
Rings
7
Aromatic rings
6
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.239
Molar refractivity
209.77
Supplementary Information
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