SMILES:
O=C=Nc1cccc2cnccc12Molecular Processing
Molecular formula
C10H6N2O
Molecular weight
170.17
Exact mass
170.048
XLogP
2.2
TPSA
42.32
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
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
49.52
Supplementary Information
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