Mathematical Analysis of a Series of 4-Acetylamino-2-(3,5-dimethylpyrazol-1-yl)-6-pyridylpyrimidines: A Simple Way to Relate Quantum Similarity to Local Chemical Reactivity Using the Gaussian Orbitals Localized Theory

Table 2

Molecular Quantum Similarity matrix using the overlap operator.

C^a	1	2	3	4	5	6	7	8	9
1	1.0000
2	0.9904	1.0000
3	0.8560	0.8568	1.0000
4	0.8194	0.7941	0.9402	1.0000
5	0.6262	0.6291	0.7392	0.6939	1.0000
6	0.7880	0.7699	0.8979	0.9526	0.6582	1.0000
7	0.8160	0.8267	0.9307	0.8858	0.6909	0.9340	1.0000
8	0.8299	0.8414	0.9516	0.9011	0.7029	0.9207	0.9828	1.0000
9	0.7592	0.7683	0.8721	0.8230	0.6417	0.8812	0.9398	0.9133	1.0000

^aC: compound (Table 1).