C#CCCn1nc2ccccn2c1=O
الاسم: 2-(but-3-ynyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
SMILES: C#CCCn1nc2ccccn2c1=O

Molecular Processing

Molecular formula
C10H9N3O
Molecular weight
187.2
Exact mass
187.0746
XLogP
0.52
TPSA
39.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
52.9

Supplementary Information

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