0 B12R1.32 CCOC(=O)CC1=NC=NC=C1 87620 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.32 CCOC(=O)C[N+]1=CC=CC=C1 C73314 [0,0,0,0,0,0|1,0,0]=1 2 B12R1.32 CCOC(=O)NC1=CC=NC=C1 F21286 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.32 COCC(=O)OC1=CC=CC=C1 AC8183 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 AB9579 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 AB9580 [0,0,0,0,0,0|3,0,1]=4 6 B12R1.32 O=C(CCBr)NC1=CC=CC=C1 W16421 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.28 BrCCSCC1=CC=CC=C1 D80856 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.28 CCCCCC1=CC=CN=C1 O11045 [1,0,0,0,0,0|2,0,1]=4 9 B11R1.28 CCCCCC1=CC=NC=C1 T70725 [1,0,0,0,0,0|2,0,1]=4 10 B11R1.28 CCCCCC1=NC=CC=C1 D70816 [1,0,0,0,0,0|2,0,1]=4 11 B11R1.28 CNCCCC1=CC=CC=C1 AR3929 [1,0,0,0,0,0|2,0,1]=4 12 B11R1.28 ICCOCC1=CC=CC=C1 70075 [1,0,0,0,0,0|3,0,0]=4 13 B11R1.40 CNC(=O)CC1=CN=CC=C1 C71252 [1,0,0,0,0,0|2,0,0]=3 14 B11R1.40 CNC(=O)OC1=CC=CC=C1 C10489 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.40 COC(=O)CC1=CN=CC=C1 31754 [1,0,0,0,0,0|1,0,0]=2 16 B11R1.40 COC(=O)CC1=NC=NC=C1 P11690 [1,0,0,0,0,0|2,0,0]=3 17 B11R1.40 NCC(=O)CC1=CC=CC=C1 A10565 [1,0,0,0,0,0|1,0,0]=2 18 B11R1.40 NCC(=O)NC1=CC=CC=C1 AB22065 [1,0,0,0,0,0|2,0,0]=3 19 B11R1.40 NCC(=O)NC1=CC=CC=C1 AB22066 [1,0,0,0,0,0|2,0,0]=3 20 B11R1.40 NNC(=O)CC1=CC=NC=C1 25064 [1,0,0,0,0,0|3,0,0]=4 21 B11R1.40 NNC(=O)OC1=CC=CC=C1 Y11606 [1,0,0,0,0,0|3,0,0]=4 22 B11R1.40 N\C(CC1=CC=CC=C1)=N/O W18702 [1,0,0,0,0,0|3,0,0]=4 23 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Y10931 [1,0,0,0,0,0|1,0,0]=2 24 B11R1.40 O=C(CO)NC1=CC=CC=C1 C77599 [1,0,0,0,0,0|2,0,0]=3 25 B11R1.40 OC[C@@H](Br)CC1=CC=CC=C1 D80460 [1,0,0,0,0,0|2,0,1]=4 26 B13R1.19 CCNC(=O)NC1=CC=C(Br)C=C1 C12551 [0,1,0,0,0,0|2,0,0]=3 27 B13R1.19 CCOC(=O)CC1=CN=C(Br)C=N1 P20825 [0,1,0,0,0,0|2,0,0]=3 28 B13R1.19 CCOC(=O)CC1=CN=C(Cl)N=C1 P12370 [0,1,0,0,0,0|2,0,0]=3 29 B13R1.19 CCOC(=O)CC1=CN=C(N)C=C1 C10026 [0,1,0,0,0,0|1,0,0]=2 30 B13R1.19 CCOC(=O)CC1=CN=C(O)C=C1 D80218 [0,1,0,0,0,0|1,0,0]=2 31 B13R1.19 CCOC(=O)CC1=NC=C(C)C=C1 12065 [0,1,0,0,0,0|1,0,0]=2 32 B13R1.19 CCOC(=O)CC1=NC=C(Cl)C=C1 89137 [0,1,0,0,0,0|1,0,0]=2 33 B13R1.19 CCOC(=O)CC1=NC=C(F)C=C1 52927 [0,1,0,0,0,0|1,0,0]=2 34 B13R1.19 CCOC(=O)CC1=NC=C(I)C=C1 P13442 [0,1,0,0,0,0|1,0,0]=2 35 B13R1.19 CCOC(=O)CC1=NC=C(N)C=C1 P12845 [0,1,0,0,0,0|1,0,0]=2 36 B13R1.19 CCOC(=O)CC1=NC=C(N)C=N1 AC2279 [0,1,0,0,0,0|2,0,0]=3 37 B13R1.19 CCOC(=O)CC1=NC=C(O)C=C1 37596 [0,1,0,0,0,0|1,0,0]=2 38 B13R1.19 CCOC(=O)CC1=NN=C(Cl)C=C1 P10834 [0,1,0,0,0,0|2,0,0]=3 39 B13R1.19 CCOC(=O)CC1=NNC(=O)C=C1 D86639 [0,1,0,0,0,0|2,0,0]=3 40 B13R1.19 CCOC(=O)NC1=CC=C(N)C=C1 D96066 [0,1,0,0,0,0|1,0,0]=2 41 B13R1.20 CCNC(=O)NC1=NC=CC(Br)=C1 W17774 [0,1,0,0,0,0|3,0,0]=4 42 B13R1.20 CCOC(=O)CC1=CC(Br)=CN=C1 69675 [0,1,0,0,0,0|1,0,0]=2 43 B13R1.20 CCOC(=O)CC1=CC(F)=CN=C1 39150 [0,1,0,0,0,0|1,0,0]=2 44 B13R1.20 CCOC(=O)CC1=CC=CC(Br)=N1 C77298 [0,1,0,0,0,0|1,0,0]=2 45 B13R1.20 CCOC(=O)CC1=CN=CC(Cl)=N1 AT19767 [0,1,0,0,0,0|2,0,0]=3 46 B13R1.20 CCOC(=O)CC1=NC(N)=CC=C1 24693 [0,1,0,0,0,0|1,0,0]=2 47 B13R1.20 CCOC(=O)CC1=NC(N)=NC=C1 82815 [0,1,0,0,0,0|2,0,0]=3 48 B13R1.20 CCOC(=O)CC1=NC=CC(Br)=C1 F31216 [0,1,0,0,0,0|1,0,0]=2 49 B13R1.20 O=C(CCCl)NC1=CC(O)=CC=C1 29982 [0,1,0,0,0,0|3,0,0]=4 50 B13R1.44 CCCOC(=O)CC1=CC=CC=C1 A12538 [0,1,0,0,0,0|0,0,0]=1 51 B13R1.47 CCOC(=O)C(=O)C1=CN=CC=C1 25920 [0,1,0,0,0,0|1,0,1]=3 52 B13R1.47 CCOC(=O)[C@H](Br)C1=NC=CC=C1 93370 [0,1,0,0,0,0|1,0,0]=2 53 B13R1.47 CCOC(=O)[C@H](C)C1=CC=CC=C1 F13478 [0,1,0,0,0,0|0,0,0]=1 54 B13R1.47 CCOC(=O)[C@H](N)C1=CC=NC=C1 32467 [0,1,0,0,0,0|1,0,0]=2 55 B13R1.47 CCOC(=O)[C@H](N)C1=CN=CC=C1 F14058 [0,1,0,0,0,0|1,0,0]=2 56 B13R1.47 CCOC(=O)[C@H](N)C1=NC=CC=C1 32465 [0,1,0,0,0,0|1,0,0]=2 57 B13R1.47 CCOC(=O)[C@H](N)C1=NC=CC=C1 61481 [0,1,0,0,0,0|1,0,0]=2 58 B13R1.47 CCOC(=O)[C@H](N)C1=NC=CN=C1 66424 [0,1,0,0,0,0|2,0,0]=3 59 B13R1.135 C=C(CC1=CC=CC=C1)C(=O)OC 75430 [0,1,0,0,0,0|3,0,0]=4 60 B13R1.348 CC(=O)CC(=O)CC1=CC=CC=C1 27901 [0,1,0,0,0,0|1,0,1]=3 61 B13R1.348 CC(C)=CC(=O)NC1=CC=CC=C1 C91653 [0,1,0,0,0,0|2,0,1]=4 62 B13R1.348 C[C@H](Cl)OC(=O)OC1=CC=CC=C1 A12584 [0,1,0,0,0,0|1,0,0]=2 63 B13R1.470 CCOC(=O)CC1=C(Br)C=CC=N1 CK2612 [0,1,0,0,0,0|1,0,0]=2 64 B13R1.470 CCOC(=O)CC1=C(Br)C=NC=C1 98391 [0,1,0,0,0,0|1,0,0]=2 65 B13R1.470 CCOC(=O)CC1=C(Br)C=NC=N1 D82269 [0,1,0,0,0,0|2,0,0]=3 66 B13R1.470 CCOC(=O)CC1=C(I)C=CC=N1 D93367 [0,1,0,0,0,0|1,0,0]=2 67 B13R1.470 CCOC(=O)CC1=C(N)C=CC=C1 AB11211 [0,1,0,0,0,0|0,0,0]=1 68 B13R1.470 CCOC(=O)CC1=C(N)C=CC=C1 AB21211 [0,1,0,0,0,0|0,0,0]=1 69 B13R1.470 CCOC(=O)CC1=CC=CN=C1Cl 37575 [0,1,0,0,0,0|1,0,0]=2 70 B13R1.470 CCOC(=O)CC1=NC=CC=C1N F18231 [0,1,0,0,0,0|1,0,0]=2 71 B13R1.470 CCOC(=O)CC1=NC=CN=C1Cl AC7235 [0,1,0,0,0,0|2,0,0]=3 72 B13R2.15 NC1CCCC1C2=CC=CC=C2 C76071 [0,0,0,1,0,0|2,0,1]=4 73 B13R2.15 O=C1NCCN1C2=CC=CC=C2 78651 [0,0,0,1,0,0|2,0,0]=3 74 B13R2.15 O=C1NCC[C@@H]1C2=CC=CC=C2 P19899 [0,0,0,1,0,0|1,0,0]=2 75 B13R2.15 OC1CCCC1C2=CC=CC=C2 78687 [0,0,0,1,0,0|1,0,2]=4 76 B13R2.26 CCSC1=NC2=C(C=CC=C2)N1 60969 [0,0,0,1,0,0|2,1,0]=4 77 B13R2.64 C1=CC=C(C[C@H]2CCCN2)C=C1 83644 [0,0,0,1,0,0|2,0,1]=4 78 B13R2.135 CCN1C(Cl)=NC2=C1C=CC=C2 C75739 [0,0,0,1,0,0|3,0,0]=4 79 B13R2.135 O=C1SC2=C(C=CC=C2)N1CO 73810 [0,0,0,1,0,0|3,0,0]=4 80 B13R2.163 O=C1CCCC2=CC=CN=C2N1 C76110 [0,0,0,1,0,0|3,0,0]=4 81 B13R2.163 O=C1CCOC2=C(C=CC=C2)C1 P11804 [0,0,0,1,0,0|2,0,0]=3 82 B13R2.163 O=C1NCCC2=C(C=CC=C2)N1 F21129 [0,0,0,1,0,0|2,0,0]=3 83 B13R2.328 C=C1OC(=O)NC2=C1C=CC=C2 A10123 [0,0,0,1,0,0|1,0,2]=4 84 B13R2.328 CC1=CC(=O)OC2=C1C=CC=C2 63779 [0,0,0,1,0,0|2,0,1]=4 85 B13R2.328 CN1CC(=O)NC2=C1C=CC=C2 87043 [0,0,0,1,0,0|3,0,0]=4 86 B13R2.328 O=C1CC2=C(C=CC=C2)C(=O)N1 Y10382 [0,0,0,1,0,0|2,0,1]=4 87 B11R1.16 CCCC(=O)C1=CN=CC=C1 N12405 [0,0,0,0,1,0|2,0,0]=3 88 B11R1.16 CCCC(=O)C1=NC=CC=C1 55420 [0,0,0,0,1,0|2,0,0]=3 89 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 Y10270 [0,0,0,0,1,0|2,0,1]=4 90 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 Y11637 [0,0,0,0,1,0|2,0,1]=4 91 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 Y11944 [0,0,0,0,1,0|2,0,1]=4 92 B11R1.16 CCOC(=O)C1=NN=CC=N1 67096 [0,0,0,0,1,0|3,0,0]=4 93 B11R1.16 CONC(=O)C1=CC=CC=C1 W17974 [0,0,0,0,1,0|2,0,0]=3 94 B11R1.16 O=C(CCO)C1=CC=CC=C1 A11168 [0,0,0,0,1,0|2,0,0]=3 95 B11R1.30 CCNC(=O)CN1C=CC=N1 31676 [0,0,0,0,1,0|3,0,0]=4 96 B11R1.30 CCOC(=O)CC1=CSC=N1 31608 [0,0,0,0,1,0|2,0,0]=3 97 B11R1.30 CCOC(=O)CC1=NC=NN1 F52963 [0,0,0,0,1,0|3,0,0]=4 98 B11R1.30 CCOC(=O)CC1=NN=CO1 72043 [0,0,0,0,1,0|3,0,0]=4 99 B11R1.30 CCOC(=O)CC1=NNC=C1 F12966 [0,0,0,0,1,0|2,0,0]=3 100 B11R1.30 CCOC(=O)CN1C=CC=N1 W10260 [0,0,0,0,1,0|2,0,0]=3 101 B13R1.42 CCOC(=O)C#CC1=CN=CC=C1 AC6430 [0,0,0,0,0,1|1,0,1]=3 102 B13R1.42 CCOC(=O)CCC1=NC=CC=C1 AC2306 [0,0,0,0,0,1|1,0,0]=2 103 B13R1.42 N#CNC(=O)OCC1=CC=CC=C1 70457 [0,0,0,0,0,1|2,0,1]=4 104 B10R1.17 CCCCC1=CC=NC=C1 BL000376 [2,0,0,0,0,0|1,0,1]=4 105 B10R1.17 CCCOC1=CC=CC=C1 C75927 [2,0,0,0,0,0|1,0,1]=4 106 B10R1.17 CCNCC1=CC=CC=C1 D77748 [2,0,0,0,0,0|1,0,0]=3 107 B10R1.17 CNNCC1=CC=CC=C1 30192 [2,0,0,0,0,0|2,0,0]=4 108 B10R1.17 ICCCC1=CC=CC=C1 AC6098 [2,0,0,0,0,0|1,0,1]=4 109 B10R1.18 CC(=O)CC1=CN=CC=C1 28512 [2,0,0,0,0,0|1,0,0]=3 110 B10R1.18 CC(=O)NC1=CC=CC=C1 D72485 [2,0,0,0,0,0|1,0,0]=3 111 B10R1.18 N=C(N)CC1=CC=CC=C1 F19863 [2,0,0,0,0,0|2,0,0]=4 112 B10R1.18 NC(=S)CC1=CC=CC=C1 71029 [2,0,0,0,0,0|1,1,0]=4 113 B10R1.18 O=C(O)CC1=CN=CN=C1 24619 [2,0,0,0,0,0|2,0,0]=4 114 B12R1.1 CCCCCC1=CC=C(F)C=C1 A11207 [1,1,0,0,0,0|1,0,1]=4 115 B12R1.8 CCCCCNC1=CC=CC=C1 T72196 [1,1,0,0,0,0|1,0,1]=4 116 B12R1.8 NCCCOCC1=CC=CC=C1 C73224 [1,1,0,0,0,0|2,0,0]=4 117 B12R1.27 CCC(=O)NCC1=CC=CC=C1 Y13566 [1,1,0,0,0,0|2,0,0]=4 118 B12R1.28 CCCCCC1=CC=CC(F)=C1 36943 [1,1,0,0,0,0|1,0,1]=4 119 B12R1.34 CCC(C)C(N)C1=CC=CC=C1 FD10503 [1,1,0,0,0,0|1,0,1]=4 120 B12R1.34 CCC(C)[C@H](N)C1=CC=CC=C1 F31005 [1,1,0,0,0,0|1,0,1]=4 121 B12R1.34 CNC(=O)[C@H](N)C1=CC=CC=C1 AB10122 [1,1,0,0,0,0|1,0,0]=3 122 B12R1.34 CNC(=O)[C@H](O)C1=CC=CC=C1 D83930 [1,1,0,0,0,0|1,0,0]=3 123 B12R1.34 COC(=O)[C@H](C)C1=CC=CC=C1 W18371 [1,1,0,0,0,0|0,0,0]=2 124 B12R1.34 COC(=O)[C@H](F)C1=CC=CC=C1 O11875 [1,1,0,0,0,0|0,0,0]=2 125 B12R1.34 COC(=O)[C@H](N)C1=CC=NC=C1 31581 [1,1,0,0,0,0|1,0,0]=3 126 B12R1.43 CN(C)C(=O)NC1=CC=CC=C1 F10253 [1,1,0,0,0,0|2,0,0]=4 127 B12R1.43 C[C@H](N)C(=O)CC1=CC=CC=C1 D80885 [1,1,0,0,0,0|0,0,0]=2 128 B12R1.49 CC1=CC=C(CC(=O)NN)C=C1 W18215 [1,1,0,0,0,0|2,0,0]=4 129 B12R1.49 CCC(=O)CC1=CC=C(Br)C=C1 79685 [1,1,0,0,0,0|0,0,0]=2 130 B12R1.49 CCC(=O)CC1=CC=C(C)C=C1 N12572 [1,1,0,0,0,0|0,0,0]=2 131 B12R1.49 CCC(=O)CC1=CC=C(F)C=C1 N14142 [1,1,0,0,0,0|0,0,0]=2 132 B12R1.49 CCC(=O)OC1=CC=C(O)C=C1 C11963 [1,1,0,0,0,0|1,0,0]=3 133 B12R1.49 COC(=O)CC1=CN=C(Br)C=C1 AB22708 [1,1,0,0,0,0|1,0,0]=3 134 B12R1.49 COC(=O)CC1=CN=C(C)C=C1 74980 [1,1,0,0,0,0|1,0,0]=3 135 B12R1.49 COC(=O)CC1=NC=C(Br)C=C1 P11352 [1,1,0,0,0,0|1,0,0]=3 136 B12R1.49 COC(=O)CC1=NC=C(F)C=N1 C72405 [1,1,0,0,0,0|2,0,0]=4 137 B12R1.49 NCC(=O)NC1=CC=C(F)C=C1 F20087 [1,1,0,0,0,0|2,0,0]=4 138 B12R1.49 O=C(CCl)NC1=CC=C(O)C=C1 69837 [1,1,0,0,0,0|2,0,0]=4 139 B12R1.50 CCC(=O)CC1=CC(C)=CC=C1 N14166 [1,1,0,0,0,0|0,0,0]=2 140 B12R1.50 CCC(=O)CC1=CC=CC(Cl)=C1 N14150 [1,1,0,0,0,0|0,0,0]=2 141 B12R1.50 COC(=O)CC1=CC(Br)=CN=C1 69168 [1,1,0,0,0,0|1,0,0]=3 142 B12R1.50 COC(=O)CC1=CC(Br)=NC=C1 AC2372 [1,1,0,0,0,0|1,0,0]=3 143 B12R1.50 COC(=O)CC1=CC=CC(Cl)=N1 C73088 [1,1,0,0,0,0|1,0,0]=3 144 B12R1.50 COC(=O)CC1=CN=CC(C)=C1 P15504 [1,1,0,0,0,0|1,0,0]=3 145 B12R1.50 COC(=O)CC1=NC=CC(Br)=C1 57353 [1,1,0,0,0,0|1,0,0]=3 146 B12R1.50 COC(=O)NC1=CC=CC(Br)=C1 74407 [1,1,0,0,0,0|1,0,0]=3 147 B12R1.50 NCC(=O)NC1=CC=CC(Cl)=C1 D84555 [1,1,0,0,0,0|2,0,0]=4 148 B12R1.50 NNC(=O)CC1=CC=CC(Cl)=C1 C78389 [1,1,0,0,0,0|2,0,0]=4 149 B12R1.371 CCC(=O)CC1=C(F)C=CC=C1 N14134 [1,1,0,0,0,0|0,0,0]=2 150 B12R1.371 CCC(=O)NC1=C(N)C=CC=C1 D93364 [1,1,0,0,0,0|1,0,0]=3 151 B12R1.371 CNC(=O)CC1=C(Cl)C=CC=C1 W10824 [1,1,0,0,0,0|1,0,0]=3 152 B12R1.371 COC(=O)CC1=C(Br)C=NC=C1 D72052 [1,1,0,0,0,0|1,0,0]=3 153 B12R1.371 COC(=O)CC1=C(I)C=CC=C1 D93618 [1,1,0,0,0,0|0,0,0]=2 154 B12R1.371 COC(=O)CC1=C(N)C=CC=C1 26282 [1,1,0,0,0,0|0,0,0]=2 155 B12R1.371 COC(=O)CC1=C(N)C=CC=C1 35782 [1,1,0,0,0,0|0,0,0]=2 156 B12R1.371 COC(=O)NC1=C(C)C=CN=C1 12221 [1,1,0,0,0,0|2,0,0]=4 157 B12R1.371 NNC(=O)CC1=C(Br)C=CC=C1 AB10425 [1,1,0,0,0,0|2,0,0]=4 158 B12R1.16 CC1=CC=C(C(=O)CCCl)C=C1 D77805 [0,1,0,0,1,0|2,0,0]=4 159 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 N13972 [0,1,0,0,1,0|1,0,0]=3 160 B12R1.16 CCCC(=O)C1=CN=C(Cl)C=C1 N14275 [0,1,0,0,1,0|2,0,0]=4 161 B12R1.16 CCOC(=O)C1=CC=C(I)C=C1 D77688 [0,1,0,0,1,0|0,0,0]=2 162 B12R1.16 CCOC(=O)C1=CC=[N+]([O-])C=C1 AB21610 [0,1,0,0,1,0|1,0,0]=3 163 B12R1.16 CCOC(=O)C1=CN=C(Cl)C=N1 RB3338 [0,1,0,0,1,0|2,0,0]=4 164 B12R1.16 CCOC(=O)C1=CN=C(F)C=C1 88966 [0,1,0,0,1,0|1,0,0]=3 165 B12R1.16 CCOC(=O)C1=NC=C(Cl)C=C1 C72155 [0,1,0,0,1,0|1,0,0]=3 166 B12R1.16 CCOC(=O)C1=NC=C(F)C=N1 P17719 [0,1,0,0,1,0|2,0,0]=4 167 B12R1.16 CCOC(=O)C1=NC=C(N)C=C1 D86980 [0,1,0,0,1,0|1,0,0]=3 168 B12R1.16 CCOC(=O)C1=NN=C(Cl)C=C1 26720 [0,1,0,0,1,0|2,0,0]=4 169 B12R1.16 CCOC(=O)C1=NN=C(S)C=C1 D80571 [0,1,0,0,1,0|2,0,0]=4 170 B12R1.17 CCCC(=O)C1=CC=CC(Br)=C1 N13963 [0,1,0,0,1,0|1,0,0]=3 171 B12R1.17 CCOC(=O)C1=CC(=O)C=CO1 C72931 [0,1,0,0,1,0|1,0,0]=3 172 B12R1.17 CCOC(=O)C1=CC(=O)NC=C1 72628 [0,1,0,0,1,0|1,0,0]=3 173 B12R1.17 CCOC(=O)C1=CC(C)=CC=C1 S12346 [0,1,0,0,1,0|0,0,0]=2 174 B12R1.17 CCOC(=O)C1=CC(C)=NC=C1 90616 [0,1,0,0,1,0|1,0,0]=3 175 B12R1.17 CCOC(=O)C1=CC(F)=NC=C1 91499 [0,1,0,0,1,0|1,0,0]=3 176 B12R1.17 CCOC(=O)C1=CC=NC(Br)=N1 C71724 [0,1,0,0,1,0|2,0,0]=4 177 B12R1.17 CCOC(=O)C1=CN=CC(Cl)=N1 90138 [0,1,0,0,1,0|2,0,0]=4 178 B12R1.17 CCOC(=O)C1=NC(C)=CC=C1 D84508 [0,1,0,0,1,0|1,0,0]=3 179 B12R1.17 CCOC(=O)C1=NC(N)=NC=C1 F11923 [0,1,0,0,1,0|2,0,0]=4 180 B12R1.17 CCOC(=O)C1=NC=CC(F)=C1 AB10269 [0,1,0,0,1,0|1,0,0]=3 181 B12R1.308 CCOC(=O)C1=C(Br)C=NC=N1 67175 [0,1,0,0,1,0|2,0,0]=4 182 B12R1.308 CCOC(=O)C1=C(C)C=CN=C1 72062 [0,1,0,0,1,0|1,0,0]=3 183 B12R1.308 CCOC(=O)C1=C(C)C=NN=C1 P12076 [0,1,0,0,1,0|2,0,0]=4 184 B12R1.308 CCOC(=O)C1=C(C)N=CN=C1 29844 [0,1,0,0,1,0|2,0,0]=4 185 B12R1.308 CCOC(=O)C1=C(C)N=NC=C1 P11140 [0,1,0,0,1,0|2,0,0]=4 186 B12R1.308 CCOC(=O)C1=C(Cl)C=CC=N1 W18461 [0,1,0,0,1,0|1,0,0]=3 187 B12R1.308 CCOC(=O)C1=C(N)C=CN=C1 A12134 [0,1,0,0,1,0|1,0,0]=3 188 B12R1.308 CCOC(=O)C1=C(N)N=NC=C1 31637 [0,1,0,0,1,0|2,0,0]=4 189 B12R1.308 CCOC(=O)C1=C(O)C=NC=C1 BL009831 [0,1,0,0,1,0|1,0,0]=3 190 B12R1.308 CCOC(=O)C1=CC=CN=C1Br 24958 [0,1,0,0,1,0|1,0,0]=3 191 B12R1.308 CCOC(=O)C1=CN=CN=C1Cl 84692 [0,1,0,0,1,0|2,0,0]=4 192 B12R1.308 CCOC(=O)C1=NC=CC=C1C 30595 [0,1,0,0,1,0|1,0,0]=3 193 B12R1.308 CCOC(=O)C1=NC=CN=C1Cl I10105 [0,1,0,0,1,0|2,0,0]=4 194 B12R1.308 CCOC(=O)C1=NC=CN=C1N 89343 [0,1,0,0,1,0|2,0,0]=4 195 B12R1.308 CONC(=O)C1=C(N)C=CC=C1 W13132 [0,1,0,0,1,0|2,0,0]=4 196 B12R1.308 O=C(CCCl)C1=C(F)C=CC=C1 AC7173 [0,1,0,0,1,0|2,0,0]=4 197 B12R1.31 CCOC(=O)CC1=CN(C)C=N1 O11740 [0,1,0,0,1,0|2,0,0]=4 198 B12R1.31 CCOC(=O)CC1=CN=C(N)S1 SC1731 [0,1,0,0,1,0|2,0,0]=4 199 B12R1.31 CCOC(=O)CC1=COC(C)=N1 AC7209 [0,1,0,0,1,0|2,0,0]=4 200 B12R1.31 CCOC(=O)CC1=CSC(Br)=N1 F12295 [0,1,0,0,1,0|2,0,0]=4 201 B12R1.31 CCOC(=O)CC1=NC=C(Br)S1 95230 [0,1,0,0,1,0|2,0,0]=4 202 B12R1.31 CCOC(=O)CN1C=C(Br)C=N1 F16290 [0,1,0,0,1,0|2,0,0]=4 203 B12R1.31 CCOC(=O)\C=C1/C=CC(=O)O1 W19643 [0,1,0,0,1,0|1,0,1]=4 204 B12R1.55 CCOC(=O)C(=O)C1=CNC=C1 W15904 [0,1,0,0,1,0|1,0,1]=4 205 B12R1.318 CCOC(=O)CN1C=CN=C1C AC2271 [0,1,0,0,1,0|2,0,0]=4 206 B14R1.29 CCOC(=O)CC(=O)C1=NC=CN=C1 29911 [0,1,0,0,0,1|2,0,0]=4 207 B14R1.29 CCOC(=O)CN(C)C1=NC=CC=C1 AC3365 [0,1,0,0,0,1|1,0,0]=3 208 B14R1.29 CCOC(=O)C[C@H](N)C1=CN=CC=C1 46245 [0,1,0,0,0,1|1,0,0]=3 209 B14R1.29 CCOC(=O)C[C@H](N)C1=CN=CC=C1 46247 [0,1,0,0,0,1|1,0,0]=3 210 B14R1.32 CCNC(=O)\C=C\C1=CC=CC(Br)=C1 A12667 [0,1,0,0,0,1|1,0,1]=4 211 B14R1.32 CCOC(=O)CCC1=CC(C)=CC=C1 C11585 [0,1,0,0,0,1|0,0,0]=2 212 B14R1.32 CCOC(=O)CCC1=CC=CC(Br)=C1 AB7159 [0,1,0,0,0,1|0,0,0]=2 213 B14R1.32 CCOC(=O)CCC1=CC=CC(Cl)=C1 D84518 [0,1,0,0,0,1|0,0,0]=2 214 B14R1.32 CCOC(=O)CNC1=CC=CC(Br)=C1 F52118 [0,1,0,0,0,1|0,0,0]=2 215 B14R1.32 CCOC(=O)COC1=CC=CC(F)=C1 AC6808 [0,1,0,0,0,1|0,0,0]=2 216 B14R1.32 CCOC(=O)\C=C\C1=CC(N)=CC=C1 50749 [0,1,0,0,0,1|0,0,1]=3 217 B14R1.32 CCOC(=O)\C=C\C1=CC(O)=CC=C1 W15436 [0,1,0,0,0,1|0,0,1]=3 218 B14R1.32 CCOC(=O)\C=C\C1=CC=CC(Cl)=C1 A10035 [0,1,0,0,0,1|0,0,1]=3 219 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 Y12270 [0,1,0,0,0,1|0,0,0]=2 220 B14R1.60 CCOC(=O)[C@@H](O)CC1=CC=CC=C1 D97639 [0,1,0,0,0,1|0,0,0]=2 221 B14R1.156 C#CCNC(=O)OCC1=CC=CC=C1 68200 [0,1,0,0,0,1|1,0,1]=4 222 B14R1.156 CCCCC(=O)OCC1=CC=CC=C1 D81803 [0,1,0,0,0,1|1,0,0]=3 223 B14R1.156 O=C(CCCO)OCC1=CC=CC=C1 W16162 [0,1,0,0,0,1|1,0,0]=3 224 B14R1.502 CCOC(=O)C#CC1=CC=C(F)C=C1 84995 [0,1,0,0,0,1|0,0,1]=3 225 B14R1.502 CCOC(=O)CCC1=CC=C(Cl)C=C1 C10962 [0,1,0,0,0,1|0,0,0]=2 226 B14R1.502 CCOC(=O)CCC1=CC=C(N)C=C1 F20005 [0,1,0,0,0,1|0,0,0]=2 227 B14R1.502 CCOC(=O)COC1=CC=C(F)C=C1 W18870 [0,1,0,0,0,1|0,0,0]=2 228 B14R1.502 CCOC(=O)COC1=CC=C(O)C=C1 C11637 [0,1,0,0,0,1|0,0,0]=2 229 B14R1.502 CCOC(=O)\C=C\C1=CN=C(N)C=C1 Y11005 [0,1,0,0,0,1|1,0,1]=4 230 B14R1.598 CCOC(=O)CCC1=C(F)C=CC=N1 D79920 [0,1,0,0,0,1|1,0,0]=3 231 B14R1.598 CCOC(=O)CCC1=C(O)C=CC=C1 W18949 [0,1,0,0,0,1|0,0,0]=2 232 B14R1.598 CCOC(=O)COC1=C(O)C=CC=C1 F17454 [0,1,0,0,0,1|0,0,0]=2 233 B14R1.598 CCOC(=O)\C=C\C1=C(Cl)C=CC=C1 AB7167 [0,1,0,0,0,1|0,0,1]=3 234 B14R1.818 CC(C)NC(=O)CCC1=CC=CC=C1 W16282 [0,1,0,0,0,1|1,0,0]=3 235 B14R1.35 CCOC(=O)[C@H](N)C1=CC=C(Cl)C=C1 N11403 [0,2,0,0,0,0|0,0,0]=2 236 B14R1.35 CCOC(=O)[C@H](O)C1=CC=C(Cl)C=C1 AR2858 [0,2,0,0,0,0|0,0,0]=2 237 B14R1.954 CCOC(=O)CC1=CC=C(C=O)C=C1 S10849 [0,2,0,0,0,0|0,0,0]=2 238 B14R1.967 CCOC(=O)CC1=CC(Cl)=C(F)C=C1 98296 [0,2,0,0,0,0|0,0,0]=2 239 B14R1.967 CCOC(=O)CC1=CC(O)=C(O)C=C1 AB10040 [0,2,0,0,0,0|0,0,0]=2 240 B14R1.967 CCOC(=O)CC1=NC(C)=C(Cl)C=C1 D79453 [0,2,0,0,0,0|1,0,0]=3 241 B14R1.6823 CCOC(=O)CC1=C(F)C=C(N)C=C1 F52303 [0,2,0,0,0,0|0,0,0]=2 242 B14R1.6823 CCOC(=O)CC1=NC=C(Br)C=C1N P20832 [0,2,0,0,0,0|1,0,0]=3 243 B14R1.17 CCOC(=O)CC1=CC=CC(Br)=C1C A11756 [0,2,0,0,0,0|0,0,0]=2 244 B14R1.36 CCOC(=O)C(=O)C1=CC=CC(Br)=C1 A10045 [0,2,0,0,0,0|0,0,1]=3 245 B14R1.952 CCOC(=O)CC1=CC(C)=CC(C)=C1 D88163 [0,2,0,0,0,0|0,0,0]=2 246 B14R1.962 C=CC1=CC=CC(CC(=O)OCC)=C1 P16759 [0,2,0,0,0,0|0,0,0]=2 247 B14R1.962 CCOC(=O)CC1=CC(CN)=CC=C1 AB3709 [0,2,0,0,0,0|0,0,0]=2 248 B14R1.962 CCOC(=O)CC1=CC=CC(CBr)=C1 P16763 [0,2,0,0,0,0|0,0,0]=2 249 B14R1.510 CCOC(=O)C(C)(C)C1=CN=CC=C1 73372 [0,2,0,0,0,0|1,0,0]=3 250 B14R1.3348 CCOC(=O)C(=O)C1=C(Br)C=CC=C1 21190 [0,2,0,0,0,0|0,0,1]=3 251 B14R1.19171 CCOC(=O)CC1=C(Cl)N=CN=C1Cl 87322 [0,2,0,0,0,0|2,0,0]=4 252 B14R1.19171 CCOC(=O)CC1=C(O)N=CN=C1O 87323 [0,2,0,0,0,0|2,0,0]=4 253 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 59896 [1,0,0,1,0,0|2,0,0]=4 254 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 59947 [1,0,0,1,0,0|2,0,0]=4 255 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 N11212 [1,0,0,1,0,0|2,0,0]=4 256 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 69529 [1,0,0,1,0,0|1,0,1]=4 257 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 P12556 [1,0,0,1,0,0|1,0,1]=4 258 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 P15250 [1,0,0,1,0,0|1,0,1]=4 259 B12R2.41 C1=CC2=C(C=C1)CCNCC2 52717 [1,0,0,1,0,0|1,0,1]=4 260 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 64901 [1,0,0,1,0,0|2,0,0]=4 261 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 72471 [1,0,0,1,0,0|2,0,0]=4 262 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 W10122 [1,0,0,1,0,0|2,0,0]=4 263 B12R2.2057 C1=CC=C(CNC2CC2)C=C1 70487 [1,0,0,1,0,0|2,0,0]=4 264 B12R2.18 CN1C(=O)CC2=C1C=NC=C2 P21083 [1,0,0,1,0,0|2,0,0]=4 265 B12R2.18 C[C@@H]1C(=O)NC2=C1C=CC=N2 P15375 [1,0,0,1,0,0|2,0,0]=4 266 B12R2.18 N[C@@H]1C(=O)NC2=C1C=CC=C2 W10169 [1,0,0,1,0,0|2,0,0]=4 267 B12R2.24 CN1CCC2=C(C=CC=C2)C1 66638 [1,0,0,1,0,0|2,0,0]=4 268 B12R2.24 CN1CCC2=C(C=CC=C2)C1 O10829 [1,0,0,1,0,0|2,0,0]=4 269 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 69307 [1,0,0,1,0,0|1,0,1]=4 270 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 69309 [1,0,0,1,0,0|1,0,1]=4 271 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 C15389 [1,0,0,1,0,0|1,0,0]=3 272 B12R2.24 O=C1CCC2=C(C=CN=C2)N1 P10564 [1,0,0,1,0,0|2,0,0]=4 273 B12R2.24 O=C1CCC2=C(C=NC=N2)C1 F52711 [1,0,0,1,0,0|2,0,0]=4 274 B12R2.24 O=C1CCC2=CC=CN=C2N1 66146 [1,0,0,1,0,0|2,0,0]=4 275 B12R2.24 O=C1NCC2=C(C=CC=C2)N1 C76098 [1,0,0,1,0,0|2,0,0]=4 276 B12R2.32 CCC1=NC2=C(C=CC=C2)O1 Y10990 [1,0,0,1,0,0|1,0,1]=4 277 B12R2.94 OC1(CC2=CC=CC=C2)CC1 W18583 [1,0,0,1,0,0|0,0,2]=4 278 B12R2.2028 CN1NC(=O)C2=C1C=CC=C2 C71035 [0,0,0,1,1,0|2,0,0]=4 279 B12R2.2028 C[C@@H]1NC(=O)C2=C1C=CC=C2 72362 [0,0,0,1,1,0|1,0,0]=3 280 B12R2.2028 N[C@H]1NC(=O)C2=C1C=CC=C2 Y10046 [0,0,0,1,1,0|2,0,0]=4 281 B12R2.2075 O=C(C1=CC=NC=C1)C2CC2 N14247 [0,0,0,1,1,0|2,0,0]=4 282 B14R2.21 O=C1CCO[C@H](C2=CC=CC=C2)C1 25492 [0,0,0,1,0,1|2,0,0]=4 283 B14R2.30 S=C1CCCN1CC2=CC=CC=C2 W15685 [0,0,0,1,0,1|1,1,0]=4 284 B14R2.598 O=C1C[C@H](C2=CC=CC=C2)C(=O)O1 86146 [0,0,0,1,0,1|1,0,1]=4 285 B14R2.2899 O=C(OCC1=CC=CC=C1)N2CC2 58577 [0,0,0,1,0,1|1,0,0]=3 286 B14R2.926 NC1=CC=C(N2CCCC2=O)C=C1 W10065 [0,1,0,1,0,0|2,0,0]=4 287 B14R2.926 O=C1CCCN1C2=CC=C(Cl)C=C2 W12980 [0,1,0,1,0,0|2,0,0]=4 288 B14R2.926 O=C1CCCN1C2=CC=C(F)C=C2 F13161 [0,1,0,1,0,0|2,0,0]=4 289 B14R2.926 O=C1NCCN1C2=CC=C(Br)C=C2 AT20737 [0,1,0,1,0,0|2,0,0]=4 290 B14R2.7974 O=C1CCCC2=C(C=CC(Br)=C2)N1 P19143 [0,1,0,1,0,0|2,0,0]=4 291 B14R2.8235 C[C@H]1CC(=O)NC2=C1C=C(Cl)C=C2 P16869 [0,1,0,1,0,0|2,0,0]=4 292 B14R2.380 O=C1CCCC2=C(C=C(Br)C=C2)N1 N13010 [0,1,0,1,0,0|2,0,0]=4 293 B14R2.28454 O=C1CCCC2=C(Br)C=CC=C2N1 N13123 [0,1,0,1,0,0|2,0,0]=4 294 B14R2.6 C1=CC=C(C[C@H]2CNCCO2)C=C1 98131 [0,1,0,1,0,0|1,0,1]=4 295 B14R2.6 C1=CC=C(C[C@H]2COCCN2)C=C1 77673 [0,1,0,1,0,0|1,0,1]=4 296 B14R2.6 C1=CC=C(C[C@H]2COCCN2)C=C1 FD6024 [0,1,0,1,0,0|1,0,1]=4 297 B14R2.24 O=C1CCCCN1C2=CC=CC=C2 C12699 [0,1,0,1,0,0|2,0,0]=4 298 B14R2.24 O=C1CNCCN1C2=CC=CC=C2 AB1573 [0,1,0,1,0,0|2,0,0]=4 299 B14R2.24 O=C1NCCN[C@H]1C2=CC=CC=C2 P10460 [0,1,0,1,0,0|1,0,0]=3 300 B14R2.24 O=C1NCCN[C@H]1C2=CC=CC=C2 P10461 [0,1,0,1,0,0|1,0,0]=3 301 B14R2.24 O=C1OCCC[C@H]1C2=NC=CC=C2 66323 [0,1,0,1,0,0|1,0,0]=3 302 B14R2.517 NCCN1C(=O)NC2=C1C=CC=C2 D80807 [0,1,0,1,0,0|2,0,0]=4 303 B14R2.517 NCC[C@@H]1C(=O)NC2=C1C=CC=C2 AR2408 [0,1,0,1,0,0|2,0,0]=4 304 B14R2.517 O=C1NC2=C(C=CC=C2)N1CCBr W16874 [0,1,0,1,0,0|2,0,0]=4 305 B14R2.517 O=C1NC2=C(C=CC=C2)N1CCCl FD7371 [0,1,0,1,0,0|2,0,0]=4 306 B14R2.279 N[C@@H]1C(=O)NCCC2=C1C=CC=C2 C15419 [0,1,0,1,0,0|1,0,0]=3 307 B14R2.1129 CCN1C(C=O)=CC2=C1C=CC=C2 F19717 [0,1,0,1,0,0|1,0,1]=4 308 B14R2.741 CN1CCC2=C(C=CC=C2)CC1=O C11953 [0,1,0,1,0,0|1,0,0]=3 309 B14R2.642 CC(C)[C@@H]1C(=O)NC2=C1C=CC=C2 W18023 [0,1,0,1,0,0|2,0,0]=4 310 B14R2.296 O=C1CCC[C@@H]1C2=C(Cl)C=CC=C2 P15939 [0,1,0,1,0,0|1,0,0]=3 311 B14R2.390 NC1=C2NC(=O)CCCC2=CC=C1 P20083 [0,1,0,1,0,0|2,0,0]=4 312 B14R2.390 O=C1CCCC2=CC=CC(F)=C2N1 I10673 [0,1,0,1,0,0|2,0,0]=4 313 B14R3.698 O=C1NC2=C(C=CC=C2)C13CC3 84866 [0,0,0,2,0,0|2,0,0]=4 314 B10R1.15 C=C(CBr)C1=CC=CC=C1 35089 [1,0,0,0,1,0|2,0,0]=4 315 B10R1.15 C=C(CC)C1=CC=CC=C1 C73845 [1,0,0,0,1,0|1,0,0]=3 316 B10R1.15 C=CC(=O)C1=CC=CC=C1 77875 [1,0,0,0,1,0|0,0,2]=4 317 B10R1.15 CCC(=O)C1=NC=CN=C1 P11366 [1,0,0,0,1,0|2,0,0]=4 318 B10R1.15 CCN(C)C1=CC=CC=C1 S10715 [1,0,0,0,1,0|2,0,0]=4 319 B10R1.15 CC[C@H](Br)C1=CC=CC=C1 A11640 [1,0,0,0,1,0|1,0,1]=4 320 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T71858 [1,0,0,0,1,0|0,0,2]=4 321 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T72707 [1,0,0,0,1,0|0,0,2]=4 322 B10R1.15 COC(=O)C1=CN=NC=C1 23653 [1,0,0,0,1,0|2,0,0]=4 323 B10R1.15 O=C(CBr)C1=CN=CC=C1 D82267 [1,0,0,0,1,0|2,0,0]=4 324 B10R1.15 O=C(CO)C1=NC=CC=C1 AC7454 [1,0,0,0,1,0|2,0,0]=4 325 B10R1.27 COC(=O)CC1=CN=CN1 F53522 [1,0,0,0,1,0|2,0,0]=4 326 B10R1.11 CCOC(=O)C1=NC=CS1 24386 [0,0,0,0,2,0|2,0,0]=4 327 B14R1.520 CCOC(=O)CNCC1=NC=CC=C1 T72721 [0,0,0,0,0,2|1,0,0]=3