SMILES:
CC(C)(O)Cn1ccc(NC(=O)[C@H](CC2CCCCC2)N2CC(OCC3COc4ccccc4O3)=CC2=O)n1Molecular Processing
Molecular formula
C29H38N4O6
Molecular weight
538.65
Exact mass
538.2791
XLogP
3.51
TPSA
115.15
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
10
Heavy atoms
39
Rings
5
Aromatic rings
2
Saturated rings
1
Aliphatic rings
3
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.552
Molar refractivity
144.24
Supplementary Information
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