Structure-Activity Relationships of 3,3′-Phenylmethylene-bis-4-hydroxycoumarins: Selective and Potent Inhibitors of Gram-Positive Bacteria

Table 2

Binding energy of dicoumarols.

CID	Binding energy; (kcal/mole)
	Pose A	Pose B
1	−9.3	−9.3
2	nf	−8.9
3	−9.0	−8.8
4	−9.4	−9.6
5	−9.0	−8.7
6	−8.9	nf
7	−8.5	−8.5
8	−8.8	−8.8
9	−8.1	−9.5
10	−8.4	−8.5
11	−9.6	−9.3
12	−9.0	−8.8
13	nf	−8.6
14	−8.2	−8.2
15	−8.6	−8.5
16	nf	−8.4
17	nf	−8.5
18	−8.3	nf
19	−8.2	nf
20	−9.4	−9.6

Note: nf: not found.