SMILES:
CNc1nc(Cl)ncc1[N+](=O)[O-]Molecular Processing
Molecular formula
C5H5ClN4O2
Molecular weight
188.57
Exact mass
188.0101
XLogP
1.08
TPSA
80.95
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
43.24
Supplementary Information
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