SMILES:
O=c1[nH][nH]c(=O)c2occc12Molecular Processing
Molecular formula
C6H4N2O3
Molecular weight
152.11
Exact mass
152.0222
XLogP
-0.19
TPSA
78.86
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
37.46
Supplementary Information
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