SMILES:
COc1cc2c(cc1[N+](=O)[O-])NCC2Molecular Processing
Molecular formula
C9H10N2O3
Molecular weight
194.19
Exact mass
194.0691
XLogP
1.57
TPSA
64.4
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
51.84
Supplementary Information
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