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. 2020 Jul 28;295(39):13516–13531. doi: 10.1074/jbc.RA120.014905

Table 2.

Analogs of compound 1 tested by STD and TROSY NMRa

Compound Inline graphic
STD TROSY
R1 R2 R3 R4 X
1 Cl Cl Me H N + +
2 Me Me Me H N +
3 F F Me H N ±
4 H CN Me H N
5 Cl Cl OH H N ±
6 Cl Cl H H N + +
7 Cl H Me H N
8 Cl Cl Et H N + +
9 Cl Cl Me Et N+-Et ±
10 Cl Cl Me Me N + +
11 Br Cl H H N + ±
12 Br Br H H N + ±
13 Cl Cl CH2OH H CH + ±
14 Cl Cl H H CH + ±
15 Cl Br H H CH + ±
16 Cl OMe H H CH ±
17 OMe Cl H H CH
18 Cl F H H CH
19 F Cl H H CH ±
20 Br Cl H H CH + ±

a Analogs of 1 were initially tested by STD NMR, and positive STD hits were assayed by TROSY. + indicates positive STD or TROSY signal; − indicates no STD or TROSY signal; ± indicates borderline positive signal. Blank cells indicate that the analog was not tested. All spectra were assessed by visual inspection.