SMILES:
Nc1nc(NCCNc2ncc(NC(=O)c3ccccc3C(=O)O)c(-c3ccc(Cl)cc3Cl)n2)ccc1[N+](=O)[O-]Molecular Processing
Molecular formula
C25H20Cl2N8O5
Molecular weight
583.39
Exact mass
582.0934
XLogP
4.81
TPSA
198.29
H-bond donors
5
H-bond acceptors
10
Rotatable bonds
10
Heavy atoms
40
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.08
Molar refractivity
151.13
Supplementary Information
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