SMILES:
CC1(c2ccc(Cn3ncc([N+](=O)[O-])n3)o2)OCCO1Molecular Processing
Molecular formula
C11H12N4O5
Molecular weight
280.24
Exact mass
280.0808
XLogP
1.05
TPSA
105.45
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
63.74
Supplementary Information
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