SMILES:
NC1C=Cn2cccc21Molecular Processing
Molecular formula
C7H8N2
Molecular weight
120.15
Exact mass
120.0687
XLogP
0.97
TPSA
30.95
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
9
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
36.69
Supplementary Information
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