SMILES:
CC(C)(C)c1ccc(-c2cccc(-c3nc4c(ccc5cc(C(=O)N[C@@H](Cc6ccccc6)C(=O)O)cc(O)c54)[nH]3)c2)cc1Molecular Processing
Molecular formula
C37H33N3O4
Molecular weight
583.69
Exact mass
583.2471
XLogP
7.48
TPSA
115.31
H-bond donors
4
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
44
Rings
6
Aromatic rings
6
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.162
Molar refractivity
173.87
Supplementary Information
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