0 B14R2.28472 CN1CC2=C(C=CC=C2Br)NC1=O H-8171 [0,0,0,0,0,0|4,0,0]=4 1 B14R2.28472 O=C1NC2=C(NC1=O)C(O)=CC=C2 O29383 [0,0,0,0,0,0|2,0,0]=2 2 B13R2.162 BrC1=CC=C2N=CC=C(Br)C2=N1 G-6357 [1,0,0,0,0,0|2,0,1]=4 3 B13R2.162 NC1=CC=C2N=CC=C(Br)C2=C1 O31563 [1,0,0,0,0,0|3,0,0]=4 4 B13R2.162 O=C1CNC2=NC=NC(Cl)=C2N1 O29355 [1,0,0,0,0,0|1,1,1]=4 5 B13R2.369 CC1=CC2=CC=CC=C2NC1=O H-8558 [1,0,0,0,0,0|3,0,0]=4 6 B13R2.369 CC1NC2=CC=CC=C2NC1=O C-2873 [1,0,0,0,0,0|2,0,1]=4 7 B13R2.369 O=C1NC2=CC=CC=C2C=C1Br N25822 [1,0,0,0,0,0|3,0,0]=4 8 B13R2.5179 BrC1=CC2=NC=CC(Br)=C2N=C1 I-9727 [1,0,0,0,0,0|2,0,1]=4 9 B13R2.5179 O=C1C=CC2=C(C=CC=C2Br)N1 O30380 [1,0,0,0,0,0|2,0,0]=3 10 B13R2.5179 O=C1CCC2=C(C=CC=C2Br)N1 O30080 [1,0,0,0,0,0|2,0,1]=4 11 B13R2.5179 O=C1CCC2=C(N=CC=C2F)N1 L14994 [1,0,0,0,0,0|1,1,1]=4 12 B13R2.4825 CN1C(=O)CC2=C1N=CC=C2Br Q54324 [0,0,0,0,1,0|3,0,0]=4 13 B13R2.4825 O=C1NC2=C(C=CC=C2I)C1=O O32269 [0,0,0,0,1,0|1,1,0]=3 14 B13R2.4856 CC1C(=O)NC2=C1C(Br)=CC=N2 Q54323 [0,0,0,0,1,0|1,0,1]=3 15 B13R2.4856 CC1C(=O)NC2=C1C(Cl)=CC=N2 L21359 [0,0,0,0,1,0|1,1,1]=4 16 B13R2.4856 O=C1NC2=C(C1=O)C(F)=CC=C2 O30726 [0,0,0,0,1,0|1,1,0]=3 17 B12R1.43 O=C(O)C(=O)CC1=CC=CC=N1 Q58255 [1,0,1,0,0,0|2,0,0]=4 18 B12R1.43 O=C(O)C(=O)NC1=CN=CC=C1 L18737 [1,0,1,0,0,0|1,0,0]=3 19 B12R2.24 O=C1C=CC2=C(N=CC=C2)N1 C-3537 [2,0,0,0,0,0|1,0,0]=3 20 B12R2.24 O=C1CCC2=CC=CN=C2N1 C-3538 [2,0,0,0,0,0|1,0,1]=4 21 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 O34499 [2,0,0,0,0,0|1,0,1]=4 22 B12R2.24 O=C1COC2=NC=CC=C2N1 Q70041 [2,0,0,0,0,0|1,0,1]=4 23 B12R2.24 O=C1CSC2=NC=CC=C2N1 L19465 [2,0,0,0,0,0|1,0,1]=4 24 B12R2.1081 BrC1=CC=NC2=NC=CC=C12 A-958 [2,0,0,0,0,0|1,0,1]=4 25 B14R2.8188 CN1C(=O)C(=O)NC2=C1N=CC=C2 L19305 [1,1,0,0,0,0|0,0,0]=2 26 B14R2.8188 CN1C(=O)C(Cl)=NC2=C1N=CC=C2 L19117 [1,1,0,0,0,0|1,0,1]=4 27 B14R2.8239 CC1=CC=C2NC(=O)C(=O)NC2=N1 L19334 [1,1,0,0,0,0|0,0,0]=2 28 B14R2.8239 NC1=CC2=C(C=C1)NC(=O)C(=O)N2 M15624 [1,1,0,0,0,0|1,0,0]=3 29 B14R2.8737 O=C1NC2=C(C=CC(Br)=C2F)C1=O L18389 [0,1,0,0,1,0|1,1,0]=4 30 B14R2.9184 O=C1NC2=C(C=C(F)C=C2Cl)C1=O Q52478 [0,1,0,0,1,0|1,1,0]=4 31 B14R2.19007 N\N=C1\C(=O)NC2=C1C(Br)=CC=C2 P43228 [0,1,0,0,1,0|2,0,0]=4 32 B14R2.27750 CC1C(=O)NC2=C1C(Br)=CC(Cl)=N2 Q54326 [0,1,0,0,1,0|1,0,1]=4 33 B14R2.27750 O=C1NC2=C(C1=O)C(F)=CC(F)=C2 P51311 [0,1,0,0,1,0|1,1,0]=4 34 B14R2.27750 O=C1NC2=CC(F)=CC(Cl)=C2C1=O Q61055 [0,1,0,0,1,0|1,1,0]=4 35 B14R2.7969 O=C(O)C1=CC2=C(Br)C=CN=C2N1 P49244 [0,0,1,1,0,0|2,0,0]=4 36 B12R1.225 O=C(O)C(=O)C1=CC=CC(Br)=C1 P36439 [0,0,1,0,1,0|2,0,0]=4 37 B12R1.124 O=C(O)C(=O)C1=CC=CC=C1Br P39207 [0,0,1,0,1,0|2,0,0]=4 38 B12R2.202 CC1=C2CC(=O)NC2=NC=C1 Q55135 [1,0,0,0,1,0|2,0,0]=4 39 B12R2.202 CC1=CC2=C(N1)C(Cl)=CC=N2 P49031 [1,0,0,0,1,0|1,1,0]=4 40 B12R2.202 CC1=CC2=C(N=CC=C2Br)N1 I-9347 [1,0,0,0,1,0|2,0,0]=4 41 B12R2.202 CC1=CC=NC2=C1NC(=O)C2 Q54343 [1,0,0,0,1,0|1,0,1]=4 42 B12R2.202 CC1=NC2=C(Br)C=CN=C2N1 Q64408 [1,0,0,0,1,0|1,0,1]=4 43 B12R2.202 ClC1=C2NC(I)=CC2=NC=C1 O33108 [1,0,0,0,1,0|1,1,0]=4 44 B12R2.202 O=C1CC2=C(Br)C=CN=C2N1 L13524 [1,0,0,0,1,0|1,0,0]=3 45 B12R2.202 O=C1CC2=C(C=CC=C2Br)N1 S86334 [1,0,0,0,1,0|2,0,0]=4 46 B12R2.202 O=C1CC2=C(Cl)C=CN=C2N1 C-2374 [1,0,0,0,1,0|1,1,0]=4 47 B12R2.202 O=C1CC2=C(F)C=CN=C2N1 C-2427 [1,0,0,0,1,0|1,1,0]=4 48 B12R2.202 O=C1CC2=C(I)C=CN=C2N1 L21518 [1,0,0,0,1,0|1,1,0]=4 49 B12R2.202 O=C1CC2=C(N1)C(Br)=CC=N2 Q54336 [1,0,0,0,1,0|0,0,1]=3 50 B12R2.202 O=C1CC2=C(N1)C(Cl)=CC=N2 Q54334 [1,0,0,0,1,0|0,1,1]=4 51 B12R2.203 BrC1=C2C(I)=CNC2=NC=C1 L14033 [1,0,0,0,1,0|1,0,0]=3 52 B12R2.203 BrC1=CNC2=NC=CC(Br)=C12 P50034 [1,0,0,0,1,0|1,0,0]=3 53 B12R2.203 CC1=C2C(Br)=CNC2=NC=C1 M15002 [1,0,0,0,1,0|2,0,0]=4 54 B12R2.203 CC1=C2C(I)=CNC2=NC=C1 P49581 [1,0,0,0,1,0|2,0,0]=4 55 B12R2.203 CC1=C2C(N)=CNC2=NC=C1 P49544 [1,0,0,0,1,0|2,0,0]=4 56 B12R2.203 CC1=CNC2=C1C(Br)=CC=N2 G-7809 [1,0,0,0,1,0|1,0,0]=3 57 B12R2.203 CC1=CNC2=C1C(Cl)=CC=N2 M15255 [1,0,0,0,1,0|1,1,0]=4 58 B12R2.203 CC1=CNC2=CC=CC(Br)=C12 L13715 [1,0,0,0,1,0|2,0,0]=4 59 B12R2.203 CC1=CNC2=NC=CC(I)=C12 P47684 [1,0,0,0,1,0|1,1,0]=4 60 B12R2.203 CC1=CNC2=NC=CC(N)=C12 P43951 [1,0,0,0,1,0|2,0,0]=4 61 B12R2.203 CC1=CNC2=NC=CC(O)=C12 P47606 [1,0,0,0,1,0|2,0,0]=4 62 B12R2.203 CC1=NNC2=C1C(Br)=CC=N2 P47683 [1,0,0,0,1,0|2,0,0]=4 63 B12R2.203 ClC1=C2C(I)=CNC2=NC=C1 A-820 [1,0,0,0,1,0|1,1,0]=4 64 B12R2.203 ClC1=CC=NC2=C1C(Br)=CN2 A-821 [1,0,0,0,1,0|1,1,0]=4 65 B12R2.203 ClC1=CC=NC2=C1C(Cl)=CN2 P48985 [1,0,0,0,1,0|1,1,0]=4 66 B12R2.203 ClC1=CNC2=NC=CC(Br)=C12 M15010 [1,0,0,0,1,0|1,0,0]=3 67 B12R2.203 ClC1=CNC2=NC=CC(I)=C12 P49582 [1,0,0,0,1,0|1,1,0]=4 68 B12R2.203 FC1=C2C(Br)=CNC2=NC=C1 O32904 [1,0,0,0,1,0|1,1,0]=4 69 B12R2.203 FC1=C2C(I)=CNC2=NC=C1 O33460 [1,0,0,0,1,0|1,1,0]=4 70 B12R2.203 FC1=CNC2=C1C(Br)=CC=C2 K16149 [1,0,0,0,1,0|2,0,0]=4 71 B12R2.203 FC1=CNC2=C1C(Cl)=CC=N2 L14914 [1,0,0,0,1,0|1,1,0]=4 72 B12R2.203 FC1=CNC2=NC=CC(Br)=C12 L14539 [1,0,0,0,1,0|1,0,0]=3 73 B12R2.203 NC1=C2C(Br)=CNC2=NC=C1 L14868 [1,0,0,0,1,0|2,0,0]=4 74 B12R2.203 NC1=C2C(Cl)=CNC2=NC=C1 P49564 [1,0,0,0,1,0|2,0,0]=4 75 B12R2.203 NC1=C2C(F)=CNC2=NC=C1 P48664 [1,0,0,0,1,0|2,0,0]=4 76 B12R2.203 NC1=C2C(I)=CNC2=NC=C1 P49467 [1,0,0,0,1,0|2,0,0]=4 77 B12R2.203 NC1=CNC2=C1C(Cl)=CC=N2 P50548 [1,0,0,0,1,0|1,1,0]=4 78 B12R2.203 NC1=CNC2=NC=CC(Br)=C12 P44768 [1,0,0,0,1,0|1,0,0]=3 79 B12R2.203 NC1=CNC2=NC=CC(Cl)=C12 L14233 [1,0,0,0,1,0|1,1,0]=4 80 B12R2.203 OC1=C2C(Br)=CNC2=NC=C1 P49463 [1,0,0,0,1,0|2,0,0]=4 81 B12R2.203 OC1=C2C(I)=CNC2=NC=C1 P49575 [1,0,0,0,1,0|2,0,0]=4 82 B12R2.18 C=C1C(=O)NC2=C1C=CC=N2 Q55064 [1,0,0,0,1,0|1,0,0]=3 83 B12R2.18 CC1=C(Br)C2=C(C=CC=N2)N1 P50153 [1,0,0,0,1,0|2,0,0]=4 84 B12R2.18 CC1=C(Br)C2=CC=CN=C2N1 G-6841 [1,0,0,0,1,0|2,0,0]=4 85 B12R2.18 CC1=C(Cl)NC2=NC=CC=C21 P44218 [1,0,0,0,1,0|2,0,0]=4 86 B12R2.18 CC1=C(I)C2=C(N=CC=C2)N1 G-5978 [1,0,0,0,1,0|2,0,0]=4 87 B12R2.18 CC1=C(I)NC2=NC=CC=C21 P47592 [1,0,0,0,1,0|2,0,0]=4 88 B12R2.18 CC1=C(N)C2=CC=CN=C2N1 P44793 [1,0,0,0,1,0|2,0,0]=4 89 B12R2.18 CC1C(=O)NC2=NC=CC=C21 L21552 [1,0,0,0,1,0|1,0,1]=4 90 B12R2.18 C[C@@H]1C(=O)NC2=NC=CC=C21 Q63901 [1,0,0,0,1,0|1,0,1]=4 91 B12R2.18 C[C@H]1C(=O)NC2=NC=CC=C21 Q63900 [1,0,0,0,1,0|1,0,1]=4 92 B12R2.18 O=C1NC2=C(C=CC=N2)C1=O P45467 [1,0,0,0,1,0|0,0,0]=2 93 B12R2.18 O=C1NC2=C(N=CC=C2)C1=O Q52820 [1,0,0,0,1,0|0,0,0]=2 94 B12R2.196 CC1=CNC2=C(Cl)C=CN=C12 P48103 [1,0,0,0,1,0|1,1,0]=4 95 B12R2.196 CC1=CNC2=C1C=CC=C2Br O30302 [1,0,0,0,1,0|2,0,0]=4 96 B12R2.196 ClC1=C2NC=C(I)C2=NC=C1 P49526 [1,0,0,0,1,0|1,1,0]=4 97 B12R2.196 ClC1=CC=NC2=C1NC=C2Br P44291 [1,0,0,0,1,0|1,1,0]=4 98 B12R2.196 NC1=CNC2=C(Cl)C=CN=C12 P49778 [1,0,0,0,1,0|1,1,0]=4