0 B22R3.3484142 Nc1[n]c[n]c2c1c(Br)c[n]2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O Amb22504261 [0,0,0,0,0,0|1,1,0]=2 1 B22R3.3484142 OC[C@H]1O[C@H]([C@H](C1O)O)n2cc(c3c2ncnc3N)I Amb17616146 [0,0,0,0,0,0|1,0,0]=1 2 B21R3.65411 Cc1[n]c[n]c2c1[n]c[n]2C3OC(CO)C(O)C3O Amb22733667 [1,0,0,0,0,0|3,0,0]=4 3 B21R3.65411 ClC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n2cnc3c2ncnc3N Amb16204106 [1,0,0,0,0,0|3,0,0]=4 4 B21R3.65411 IC[C@H]1O[C@H]([C@H](C1O)O)n2cnc3c2ncnc3N Amb17616113 [1,0,0,0,0,0|3,0,0]=4 5 B21R3.65411 Nc1[n]c[n]c2c1[n]c[n]2C3CC(CO)C(O)C3O Amb22730371 [1,0,0,0,0,0|3,0,0]=4 6 B21R3.65411 Nc1[n]c[n]c2c1[n]c[n]2C3OC(CO)C(O)C3O Amb22732262 [1,0,0,0,0,0|2,0,0]=3 7 B21R3.65411 Nc1[n]c[n]c2c1[n]c[n]2[C@@H]3O[C@@H](CO)[C@H](O)[C@@H]3O Amb22349825 [1,0,0,0,0,0|2,0,0]=3 8 B21R3.65411 Nc1[n]c[n]c2c1[n]c[n]2[C@@H]3O[C@H](CCl)[C@@H](O)[C@H]3O Amb22362619 [1,0,0,0,0,0|3,0,0]=4 9 B21R3.65411 Nc1[n]c[n]c2c1[n]c[n]2[C@@H]3O[C@H](CI)[C@H](O)C3O Amb22800707 [1,0,0,0,0,0|3,0,0]=4 10 B21R3.65411 Nc1[n]c[n]c2c1[n]c[n]2[C@@H]3O[C@H](CN)[C@@H](O)[C@H]3O Amb22746154 [1,0,0,0,0,0|3,0,0]=4 11 B21R3.65411 Nc1[n]c[n]c2c1[n]c[n]2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3F Amb22008567 [1,0,0,0,0,0|3,0,0]=4 12 B21R3.65411 Nc1[n]c[n]c2c1[n]c[n]2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3N Amb22745388 [1,0,0,0,0,0|3,0,0]=4 13 B21R3.65411 Nc1[n]c[n]c2c1cc[n]2[C@@H]3O[C@H](CO)C(O)C3O Amb24310275 [1,0,0,0,0,0|1,0,0]=2 14 B21R3.65411 Nc1[n]c[n]c2c1cc[n]2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O Amb22169760 [1,0,0,0,0,0|1,0,0]=2 15 B21R3.65411 Nc1[n]ccc2c1[n]c[n]2C3OC(CO)C(O)C3O Amb22734986 [1,0,0,0,0,0|3,0,0]=4 16 B21R3.65411 Nc1[n]ccc2c1[n]c[n]2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O Amb22350188 [1,0,0,0,0,0|3,0,0]=4 17 B21R3.65411 OCC1OC(C(C1F)O)n2cnc3c2ncnc3N Amb1159537 [1,0,0,0,0,0|3,0,0]=4 18 B21R3.65411 OCC1OC(C(C1O)O)c2n[nH]c3c2ncnc3N Amb16182800 [1,0,0,0,0,0|2,0,0]=3 19 B21R3.65411 OCC1OC(C(C1O)O)n2cnc3c2ncnc3N Amb1953569 [1,0,0,0,0,0|2,0,0]=3 20 B21R3.65411 OCC1OC(C(C1O)O)n2cnc3c2ncnc3O Amb1003323 [1,0,0,0,0,0|3,0,0]=4 21 B21R3.65411 OCC1OC(C(O)C1O)[n]2[n]cc3C(=O)N=CNc23 Amb22352350 [1,0,0,0,0,0|1,0,1]=3 22 B21R3.65411 OC[C@@H]1OC([C@@H](O)[C@H]1O)[n]2c[n]c3c(Cl)[n]c[n]c23 Amb22757261 [1,0,0,0,0,0|3,0,0]=4 23 B21R3.65411 OC[C@@H]1O[C@@H](C(O)[C@@H]1O)[n]2c[n]c3c(Cl)[n]c[n]c23 Amb19131249 [1,0,0,0,0,0|3,0,0]=4 24 B21R3.65411 OC[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)[n]2c[n]c3c(Cl)[n]c[n]c23 Amb24180946 [1,0,0,0,0,0|3,0,0]=4 25 B21R3.65411 OC[C@@H]1O[C@@H]([C@H](O)C1O)[n]2c[15n][13c]3c(O)[n]c[n][13c]23 Amb19132788 [1,0,0,0,0,0|3,0,0]=4 26 B21R3.65411 OC[C@@H]1O[C@@H]([C@H](O)C1O)[n]2ccc3c(Cl)[n]c[n]c23 Amb19131202 [1,0,0,0,0,0|2,0,0]=3 27 B21R3.65411 OC[C@@H]1O[C@H]([C@H](O)C1O)[n]2ccc3c(Cl)[n]c[n]c23 Amb19131203 [1,0,0,0,0,0|2,0,0]=3 28 B21R3.65411 OC[C@H]1O[C@H](C(C1O)O)n2cnc3c2ncnc3O Amb10241347 [1,0,0,0,0,0|3,0,0]=4 29 B21R3.65411 OC[C@H]1O[C@H]([C@H](C1O)O)n2cnc3c2ccnc3N Amb17611608 [1,0,0,0,0,0|3,0,0]=4 30 B21R3.65411 OC[C@H]1O[C@H]([C@H](C1O)O)n2cnc3c2ncnc3N Amb17607716 [1,0,0,0,0,0|2,0,0]=3 31 B21R3.65411 OC[C@H]1O[C@H]([C@H](C1O)O)n2cnc3c2ncnc3O Amb17616088 [1,0,0,0,0,0|3,0,0]=4 32 B21R3.65411 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)[n]2ccc3c(Cl)[n]c[n]c23 Amb22886170 [1,0,0,0,0,0|2,0,0]=3 33 B21R3.65411 OC[C@H]1O[C@H]([C@H]([C@@H]1O)O)n2cnc3c2ncnc3N Amb13889604 [1,0,0,0,0,0|2,0,0]=3 34 B21R3.65411 O[13CH2][13C@H]1O[13C@H]([13C@H]([13CH]1O)O)n2cnc3c2ncnc3N Amb17607717 [1,0,0,0,0,0|2,0,0]=3 35 B21R3.2674068 Nc1[n]c[n]c2c1c(I)c[n]2[C@@H]3C[C@@H](O)[C@H](CO)O3 Amb22757235 [1,0,0,0,0,0|1,0,0]=2 36 B21R3.2674068 O[C@@H]1C[C@H](O[C@H]1CO)[n]2cc(I)c3c2[n]c[n]c3Cl Amb22899970 [1,0,0,0,0,0|2,0,0]=3 37 B21R3.2692493 OCC1OC(C(C1O)O)n2nc(c3c2nccc3)N Amb2389976 [1,0,0,0,0,0|2,0,0]=3 38 B21R3.6748382 Nc1[n]c[n]c2c1c(I)c[n]2[C@@H]3C[C@H](N)[C@@H](O)[C@H]3O Amb22352863 [1,0,0,0,0,0|3,0,0]=4 39 B23R3.4661730 Nc1[n]c[n]c2c1c(c[n]2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C#N Amb23438766 [0,1,0,0,0,0|2,0,0]=3 40 B20R3.3189 OC[C@@H]1O[C@@H](C(O)[C@@H]1O)[n]2c[n]c3c[n]c[n]c23 Amb19133390 [2,0,0,0,0,0|2,0,0]=4 41 B20R3.3189 OC[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)[n]2c[n]c3c[n]c[n]c23 Amb22801007 [2,0,0,0,0,0|2,0,0]=4 42 B20R3.38975 Nc1[n]c[n]c2c1[n]c[n]2[C@@H]3C[C@H](O)[C@@H](CO)O3 Amb22752773 [2,0,0,0,0,0|2,0,0]=4 43 B20R3.38975 Nc1[n]c[n]c2c1c[n][n]2[C@@H]3C[C@H](O)[C@@H](CO)O3 Amb22747943 [2,0,0,0,0,0|0,0,0]=2 44 B20R3.38975 Nc1[n]c[n]c2c1cc[n]2[C@@H]3C[C@H](O)[C@@H](CO)O3 Amb22757267 [2,0,0,0,0,0|1,0,0]=3 45 B20R3.38975 OC[C@@H]1O[C@@H](CC1O)n2cnc3c2ncnc3N Amb17611813 [2,0,0,0,0,0|2,0,0]=4 46 B20R3.432739 OC[C@@H]1CC([C@@H](O1)n2cnc3c2ncnc3N)O Amb17611314 [2,0,0,0,0,0|2,0,0]=4 47 B20R3.432739 O[13CH2][13C@@H]1[13CH2][13C@@H]([13C@@H](O1)n2cnc3c2ncnc3N)O Amb17611315 [2,0,0,0,0,0|2,0,0]=4 48 B20R3.4392588 C[C@@H]1O[C@@H](C(O)C1O)[n]2c[n]c3c(N)[n]c[n]c23 Amb22800801 [2,0,0,0,0,0|2,0,0]=4 49 B22R3.3477171 Nc1[n]c[n]c2c1[n]c[n]2[C@@H]3O[C@H](CO)[C@@](N)(O)[C@H]3O Amb24095924 [1,1,0,0,0,0|2,0,0]=4 50 B22R3.3484523 Nc1[n]c[n]c2c1[n]c(S)[n]2[C@@H]3O[C@H](CO)[C@H](O)[C@H]3O Amb24184181 [1,1,0,0,0,0|2,0,0]=4 51 B22R3.3484523 OCC1OC(C(C1O)O)n2c(Br)nc3c2ncnc3N Amb2221700 [1,1,0,0,0,0|2,0,0]=4 52 B22R3.3484523 OC[C@H]1O[C@H](C([C@H]1O)O)n2c(N)nc3c2ncnc3N Amb17607871 [1,1,0,0,0,0|2,0,0]=4 53 B22R3.3484523 OC[C@H]1O[C@H]([C@H](C1O)O)n2c(Br)nc3c2ncnc3N Amb17609916 [1,1,0,0,0,0|2,0,0]=4 54 B22R3.3484664 Nc1[n]c(Br)[n]c2c1[n]c[n]2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O Amb24080062 [1,1,0,0,0,0|2,0,0]=4 55 B22R3.3484664 Nc1[n]c(Cl)[n]c2c1[n]c[n]2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O Amb22347799 [1,1,0,0,0,0|2,0,0]=4 56 B22R3.3484664 Nc1[n]c(F)[n]c2c1[n]c[n]2C3OC(CO)C(O)C3O Amb19515868 [1,1,0,0,0,0|2,0,0]=4 57 B22R3.3484664 Nc1[n]c(I)[n]c2c1[n]c[n@@]2C3O[C@H](CO)[C@@H](O)[C@H]3O Amb22737289 [1,1,0,0,0,0|2,0,0]=4 58 B22R3.3484664 Nc1[n]c(O)[n]c2c1[n]c[n]2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O Amb22746155 [1,1,0,0,0,0|2,0,0]=4 59 B22R3.3484664 OCC1OC(C(C1O)O)n2cnc3c2nc(N)nc3N Amb1001785 [1,1,0,0,0,0|2,0,0]=4 60 B22R3.3484664 OC[C@H]1O[C@@H]([C@H]([C@H]1O)O)n2cnc3c2nc(F)nc3N Amb10838091 [1,1,0,0,0,0|2,0,0]=4 61 B22R3.3484664 OC[C@H]1O[C@H](C([C@H]1O)O)n2cnc3c2nc(I)nc3N Amb17616105 [1,1,0,0,0,0|2,0,0]=4 62 B22R3.3484664 OC[C@H]1O[C@H](C([C@H]1O)O)n2cnc3c2nc(N)nc3N Amb17607870 [1,1,0,0,0,0|2,0,0]=4 63 B22R3.3484664 OC[C@H]1O[C@H]([C@@H](C1O)O)n2cnc3c2[15n][13c](F)[15n]c3N Amb17614350 [1,1,0,0,0,0|2,0,0]=4 64 B22R3.3484664 OC[C@H]1O[C@H]([C@@H](C1O)O)n2cnc3c2nc(F)nc3N Amb17614349 [1,1,0,0,0,0|2,0,0]=4 65 B22R3.3484664 OC[C@H]1O[C@H]([C@H](C1O)O)n2cnc3c2nc(Cl)nc3N Amb17610801 [1,1,0,0,0,0|2,0,0]=4 66 B22R3.19077080 COC1[C@@H](CO)O[C@H](C1O)[n]2c[n]c3c2[n]c[n]c3N Amb22799446 [1,1,0,0,0,0|2,0,0]=4 67 B22R3.19077556 COC1C(O)C(OC1n2cnc3c2ncnc3N)CO Amb17617138 [1,1,0,0,0,0|2,0,0]=4 68 B22R3.19077556 CO[C@@H]1[C@H](O[C@@H](CO)[C@@H]1O)[n]2c[n]c3c2[n]c[n]c3N Amb22745387 [1,1,0,0,0,0|2,0,0]=4 69 B22R3.19077712 C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n2cnc3c(N)ncnc23 Amb17678744 [1,1,0,0,0,0|2,0,0]=4 70 B22R3.19077712 C[C@@]1(O)[C@H](O[C@@H](CO)[C@@H]1O)[n]2ccc3c(N)[n]c[n]c23 Amb22745484 [1,1,0,0,0,0|1,0,0]=3 71 B22R3.19077712 Nc1[n]c[n]c2c1[n]c[n]2[C@@H]3O[C@H](CO)[C@@H](O)[C@@]3(N)O Amb24093836 [1,1,0,0,0,0|2,0,0]=4 72 B22R3.19077712 OC[C@H]1O[C@H]([C@]([C@@H]1O)(C)O)n2ccc3c2ncnc3N Amb13883756 [1,1,0,0,0,0|1,0,0]=3 73 B22R3.110937703 OCC1OC(C(C1O)O)n2cnc3c2ncnc3NN Amb1282488 [1,1,0,0,0,0|2,0,0]=4 74 B22R3.27046250 Nc1[n]c2c(c(Cl)[n]1)c(I)c[n]2[C@@H]3C[C@@H](O)[C@H](CO)O3 Amb22899971 [1,1,0,0,0,0|2,0,0]=4 75 B24R3.6322439 Nc1[n]c[n]c2c1c(c[n]2C3O[C@H](CO)[C@@H](O)[C@H]3O)C(N)=O Amb22482433 [0,2,0,0,0,0|2,0,0]=4 76 B24R3.6322439 Nc1[n]c[n]c2c1c(c[n]2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C(N)=O Amb19930606 [0,2,0,0,0,0|2,0,0]=4 77 B24R3.6322439 Nc1[n]c[n]c2c1c(c[n]2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C(N)=O Amb22349708 [0,2,0,0,0,0|2,0,0]=4 78 B24R3.6322439 OCC1OC(C(C1O)O)n2cc(c3c2ncnc3N)C(=O)N Amb16182821 [0,2,0,0,0,0|2,0,0]=4