CCc1cc2c(=O)n(-c3cnc4ccccc4c3)c(=O)n(Cc3ccc(-c4ccccc4-c4noc(=O)[nH]4)cc3)c2s1
SMILES: CCc1cc2c(=O)n(-c3cnc4ccccc4c3)c(=O)n(Cc3ccc(-c4ccccc4-c4noc(=O)[nH]4)cc3)c2s1

Molecular Processing

Molecular formula
C32H23N5O4S
Molecular weight
573.63
Exact mass
573.1471
XLogP
5.38
TPSA
115.78
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
42
Rings
7
Aromatic rings
7
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.094
Molar refractivity
163.46

Supplementary Information

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