Table 1.

The docking scores and drug-likeness model scores of selected activators for AMPK (α1β1γ1 and α2β1γ1).

Isoforms	Compound No.	Total-Score	Crash	Polar	Similarity	Number of HBA/HBD	MolLog P	Drug-Likeness Model Score
AMPK (α1β1γ1) activators	F064-1335	10.50	−2.35	3.54	0.44	6/1	3.79	−0.16
	M5653-1884	10.24	−1.43	2.90	0.50	5/1	6.07	0.22
	D454-0135	10.20	−1.58	3.41	0.44	6/2	4.03	−0.31
	M8006-4303	10.07	−1.83	4.29	0.58	6/1	1.01	1.02
	F264-3019	9.93	−1.39	3.19	0.46	6/1	5.44	1.00
	F377-1213	10.03	−1.43	1.32	0.44	6/1	4.12	0.16
	PF-06409577	7.29	−0.07	3.08	0.93	3/3	3.80	0.71
AMPK (α2β1γ1) activators	L267-1138	10.96	−2.46	2.78	0.52	4/1	6.05	−0.08
	F684-0053	10.60	−2.77	4.31	0.54	7/3	2.04	0.54
	C804-0412	10.15	−3.27	3.39	0.54	5/2	2.53	1.00
	M5976-1661	9.46	−0.92	1.32	0.46	6/0	4.84	0.62
	M039-0295	9.35	−1.61	1.48	0.50	6/1	2.66	−0.20
	M5050-0116	9.27	−1.35	2.82	0.49	7/2	5.13	0.38
	A-769662	7.44	−1.46	1.26	0.93	5/3	3.46	0.30
	991	8.38	−0.96	4.08	0.73	4/2	5.38	0.41