SMILES:
Oc1ccc2cn[nH]c2c1Molecular Processing
Molecular formula
C7H6N2O
Molecular weight
134.14
Exact mass
134.048
XLogP
1.27
TPSA
48.91
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
10
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
37.76
Supplementary Information
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