CNC(=O)Nc1ccc(-c2nc(-c3ccc(NC(=O)Nc4cccc(C(N)=O)c4)cc3)nc(N3C(C)COCC3C)n2)cc1
SMILES: CNC(=O)Nc1ccc(-c2nc(-c3ccc(NC(=O)Nc4cccc(C(N)=O)c4)cc3)nc(N3C(C)COCC3C)n2)cc1

Molecular Processing

Molecular formula
C31H33N9O4
Molecular weight
595.66
Exact mass
595.2656
XLogP
4.31
TPSA
176.49
H-bond donors
5
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
44
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.226
Molar refractivity
168.6

Supplementary Information

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