SMILES:
Cc1ccc(-c2cccc(-c3nc4c(ccc5cc(C(=O)N[C@@H](Cc6ccccc6)C(=O)O)cc(O)c54)[nH]3)c2)cc1CMolecular Processing
Molecular formula
C35H29N3O4
Molecular weight
555.63
Exact mass
555.2158
XLogP
6.8
TPSA
115.31
H-bond donors
4
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
42
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
0.114
Molar refractivity
164.65
Supplementary Information
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