Table 1.

$E_{int}$ ΔV $\Delta V^2$$S3K$ and $MIC$ values for fluoroquinolone derivatives.

Molecule	$E_{int}$ (kcal/atom)	$\Delta V$ (Å3)	$\Delta V^2$ (Å3)	$S3K$	$MIC$ (µg/mL)
1	-255.09	187.22	35051.33	4.535	–
2	-182.03	234.15	54826.22	4.679	–
3	-202.12	269.87	72829.82	5.11	–
4	-253.94	269.46	72608.69	5.11	–
5	-255.56	316.18	99969.79	5.273	–
6	-245.68	282.65	79891.02	5.273	–
7	-244.44	171.74	29494.63	4.56	–
8	-229.45	224.89	50575.51	4.685	–
9	-212.93	258.3	66718.89	5.124	–
10	-251.86	253.37	64196.36	5.124	0.39
11	-182.36	306.76	94101.70	5.272	–
12	-258.04	302.32	91397.38	5.272	–
13	-288.46	251.53	63267.34	5.101	1.56
14	-295.77	339.74	115423.27	6.167	1.56
15	-268.76	236.66	56007.96	4.865	0.78
16	-255.32	261.96	68623.04	5.327	0.78
17	-260.05	308.82	95369.79	5.356	1.56
18	-256.6	283.96	80633.28	5.324	1.56
19	-220.73	263.3	69326.89	5.069	0.78
TSF	-245.38	88.15	7770.42	3.369	0.1
CFX	-151.16	59.63	3555.74	2.822	0.5
TFX	-222.39	49.28	2428.52	2.84	0.125
GFX	-205.29	83.71	7007.36	3.05	0.25
LFX	-189.19	71.26	5077.99	2.747	0.125
MFX	-198.77	117.15	13724.12	3.161	0.6
LMF	-199.73	60.46	3655.41	3.026	0.2
NFX	-192.34	55.18	3044.83	2.843	0.39
PFX	-177.99	57.77	3337.37	3.071	0.5
SFX	-221.08	97.88	9580.49	3.23	0.125
SIT	-228.22	94.17	8867.99	2.787	0.5
TFX	-200.56	99.02	9804.96	3.008	0.6