SMILES:
C#CCCn1nc2ccccc2n1Molecular Processing
Molecular formula
C10H9N3
Molecular weight
171.2
Exact mass
171.0796
XLogP
1.45
TPSA
30.71
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
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
0.2
Molar refractivity
50.98
Supplementary Information
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