Nombre: Compound 30
SMILES:
COc1ccc(C(OC(c2ccccc2)C2CC(O)CN2CCCCCCNC(=O)OCc2ccccc2)c2ccc(OC)cc2)cc1Molecular Processing
Molecular formula
C40H48N2O6
Molecular weight
652.83
Exact mass
652.3512
XLogP
7.47
TPSA
89.49
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
17
Heavy atoms
48
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
187.18
Supplementary Information
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