SMILES:
CO[C@H]1C[C@@H](c2n[nH]c(=O)[nH]2)C[C@@H]1O[N+](=O)[O-]Molecular Processing
Molecular formula
C8H12N4O5
Molecular weight
244.21
Exact mass
244.0808
XLogP
-0.43
TPSA
123.14
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
53.85
Supplementary Information
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