SMILES:
CC(CC(=O)O)C(=O)c1ccc(-n2cnc(CCCN3C(=O)c4ccccc4C3=O)c2)cc1Molecular Processing
Molecular formula
C25H23N3O5
Molecular weight
445.48
Exact mass
445.1638
XLogP
3.39
TPSA
109.57
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.24
Molar refractivity
119.44
Supplementary Information
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