SMILES:
Nc1c([N+](=O)[O-])ccc2ncccc12Molecular Processing
Molecular formula
C9H7N3O2
Molecular weight
189.17
Exact mass
189.0538
XLogP
1.73
TPSA
82.05
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
14
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
52.81
Supplementary Information
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