SMILES:
O=C1Nc2ccccc2C1=CNc1ccon1Molecular Processing
Molecular formula
C12H9N3O2
Molecular weight
227.22
Exact mass
227.0695
XLogP
2.08
TPSA
67.16
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
17
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
63.17
Supplementary Information
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