COc1ccc(OC2=CC(=O)N([C@@H](CC(C)C)C(=O)Nc3ccn(C[C@@H](O)CO)n3)C2)cc1
SMILES: COc1ccc(OC2=CC(=O)N([C@@H](CC(C)C)C(=O)Nc3ccn(C[C@@H](O)CO)n3)C2)cc1

Molecular Processing

Molecular formula
C23H30N4O6
Molecular weight
458.52
Exact mass
458.2165
XLogP
1.4
TPSA
126.15
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
11
Heavy atoms
33
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
120.61

Supplementary Information

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