SMILES:
CC(C)Cn1c(=O)n(C)c(=O)c2c(C/C=C/CC(=O)O)n(Cc3cccc4ccccc34)cc21Molecular Processing
Molecular formula
C27H29N3O4
Molecular weight
459.55
Exact mass
459.2158
XLogP
3.93
TPSA
86.23
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
34
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.296
Molar refractivity
134.42
Supplementary Information
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