SMILES:
O=C([O-])N1CC2CC1CN2Molecular Processing
Molecular formula
C6H9N2O2-
Molecular weight
141.15
Exact mass
141.067
XLogP
-1.62
TPSA
55.4
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
10
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
-1
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
32.3
Supplementary Information
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