0 B13R2.162 CC1=C2N=C(Cl)C=CC2=CC=C1 W10449 [1,0,0,0,0,0|2,0,1]=4 1 B13R2.162 CC1=CC=C2C=CC=C(Br)C2=N1 94603 [1,0,0,0,0,0|1,1,1]=4 2 B13R2.162 CC1=CC=C2C=CC=C(Cl)C2=N1 70450 [1,0,0,0,0,0|1,1,1]=4 3 B13R2.162 CC1=CC=C2C=CC=C(F)C2=N1 AB3782 [1,0,0,0,0,0|1,0,1]=3 4 B13R2.162 CC1=CC=C2C=CC=C(O)C2=N1 P20524 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.162 CC1=CC=CC2=C1NC(=O)C=C2 32361 [1,0,0,0,0,0|1,0,0]=2 6 B13R2.162 CC1=NC2=C(N)C=CC=C2C=C1 33002 [1,0,0,0,0,0|2,0,1]=4 7 B13R2.162 ClC1=CC=C2C=CC=C(Br)C2=N1 69003 [1,0,0,0,0,0|1,1,1]=4 8 B13R2.162 ClC1=NC2=C(Cl)C=CC=C2C=C1 52924 [1,0,0,0,0,0|1,1,1]=4 9 B13R2.162 FC1=C2N=C(Cl)C=CC2=CC=C1 70345 [1,0,0,0,0,0|1,0,1]=3 10 B13R2.162 NC1=C2C=C(O)C=CC2=CC=C1 S11965 [1,0,0,0,0,0|2,0,1]=4 11 B13R2.162 O=C1C=CC2=CC=CC(Br)=C2N1 69002 [1,0,0,0,0,0|0,1,0]=2 12 B13R2.162 O=C1C=CC2=CC=CC(Br)=C2O1 27159 [1,0,0,0,0,0|1,1,0]=3 13 B13R2.162 O=C1C=CC2=CC=CC(Cl)=C2N1 12476 [1,0,0,0,0,0|0,1,0]=2 14 B13R2.162 O=C1C=CC2=CC=CC(O)=C2N1 50165 [1,0,0,0,0,0|1,0,0]=2 15 B13R2.162 O=C1C=CC2=CN=CC(Br)=C2N1 76829 [1,0,0,0,0,0|1,1,0]=3 16 B13R2.162 O=C1COC2=C(N1)C(O)=CC=C2 26721 [1,0,0,0,0,0|2,0,1]=4 17 B13R2.162 OC1=C2C=C(Br)C=CC2=CC=C1 F16512 [1,0,0,0,0,0|3,0,0]=4 18 B13R2.162 OC1=C2N=C(Br)C=CC2=CC=C1 F19191 [1,0,0,0,0,0|2,0,1]=4 19 B13R2.162 OC1=CC=C2C=CC=C(O)C2=C1 D87698 [1,0,0,0,0,0|2,0,1]=4 20 B13R2.369 BrC1=CC2=CC=CC=C2C=C1Br 60592 [1,0,0,0,0,0|3,0,0]=4 21 B13R2.369 BrC1=CC2=CC=CC=C2N=C1Br 26761 [1,0,0,0,0,0|2,0,1]=4 22 B13R2.369 CC1=CC2=CC=CC=C2C=C1O D82548 [1,0,0,0,0,0|2,0,0]=3 23 B13R2.369 CC1=CC2=CC=CC=C2N=C1Cl 58150 [1,0,0,0,0,0|2,0,1]=4 24 B13R2.369 CC1=NC2=CC=CC=C2C=C1Cl D84182 [1,0,0,0,0,0|2,0,1]=4 25 B13R2.369 CN1CC2=C(C=CC=C2)NC1=O F12578 [1,0,0,0,0,0|2,0,1]=4 26 B13R2.369 C[C@@H]1OC2=C(C=CC=C2)NC1=O 71492 [1,0,0,0,0,0|2,0,1]=4 27 B13R2.369 ClC1=NC2=CC=CC=C2C=C1Br 37457 [1,0,0,0,0,0|2,0,1]=4 28 B13R2.369 ClC1=NC2=CC=CC=C2C=C1I F30335 [1,0,0,0,0,0|2,0,1]=4 29 B13R2.369 NC1=CC2=CC=CC=C2C=C1N F16066 [1,0,0,0,0,0|3,0,0]=4 30 B13R2.369 NC1=CC2=CC=CC=C2C=C1O CX1064 [1,0,0,0,0,0|2,0,0]=3 31 B13R2.369 OC1=NC2=CC=CC=C2N=C1O F11637 [1,0,0,0,0,0|1,0,2]=4 32 B13R2.5179 BrC1=CC=C2C(Br)=CC=CC2=C1 AB6971 [1,0,0,0,0,0|2,1,0]=4 33 B13R2.5179 O=C1C=COC2=C1C=CC(O)=C2 39244 [1,0,0,0,0,0|3,0,0]=4 34 B13R2.5179 OC1=CC=C2C(Cl)=CC=NC2=C1 24933 [1,0,0,0,0,0|2,1,0]=4 35 B13R2.5179 OC1=CC=C2C(O)=CC=CC2=C1 F11438 [1,0,0,0,0,0|2,0,0]=3 36 B13R2.5179 OC1=CC=C2C(O)=CC=NC2=C1 CS1344 [1,0,0,0,0,0|3,0,0]=4 37 B13R2.5179 OC1=CN=C2C(Cl)=CC=CC2=N1 D82732 [1,0,0,0,0,0|1,1,1]=4 38 B13R1.148 O=C(O)[C@@H](O)CC1=CC=CC(F)=C1 AC1170 [0,0,1,0,0,0|1,0,2]=4 39 B13R2.4825 CC1=CC=CC2=C1NC(=O)C2=O 63146 [0,0,0,0,1,0|1,0,1]=3 40 B13R2.4825 C[C@@H]1C(=O)NC2=C(F)C=CC=C21 P16618 [0,0,0,0,1,0|1,0,1]=3 41 B13R2.4825 O=C1NC2=C(Br)C=CC=C2C1=O 64557 [0,0,0,0,1,0|0,1,1]=3 42 B13R2.4825 O=C1NC2=C(Cl)C=CC=C2C1=O 23030 [0,0,0,0,1,0|0,1,1]=3 43 B13R2.4825 O=C1NC2=C(F)C=CC=C2C1=O 21301 [0,0,0,0,1,0|0,0,1]=2 44 B13R2.4856 O=C1NC2=CC=CC(Br)=C2C1=O 82088 [0,0,0,0,1,0|1,1,1]=4 45 B13R2.4856 O=C1NC2=CC=CC(Cl)=C2C1=O 57818 [0,0,0,0,1,0|1,1,1]=4 46 B13R2.4856 O=C1NC2=CC=CC(I)=C2C1=O F15609 [0,0,0,0,1,0|1,1,1]=4 47 B12R1.224 CC1=C(F)C=CC=C1CC(=O)O CL8776 [1,0,1,0,0,0|1,0,1]=4 48 B12R1.224 O=C(O)CC1=CC=CC(F)=C1Br 22708 [1,0,1,0,0,0|1,0,1]=4 49 B12R1.224 O=C(O)CC1=CC=CC(F)=C1Cl CL8958 [1,0,1,0,0,0|1,0,1]=4 50 B12R1.224 O=C(O)CC1=CC=CC(F)=C1F 61772 [1,0,1,0,0,0|1,0,1]=4 51 B12R1.371 O=C(CBr)NC1=C(F)C=CC=C1 71401 [1,0,1,0,0,0|1,0,1]=4 52 B12R1.371 O=C(CCl)NC1=C(F)C=CC=C1 57527 [1,0,1,0,0,0|1,0,1]=4 53 B12R1.43 C=C(C)C(=O)NC1=CC=CC=C1 AC9002 [1,0,1,0,0,0|1,0,0]=3 54 B12R1.43 C=C(C)C(=O)OC1=CC=CC=C1 D82045 [1,0,1,0,0,0|2,0,0]=4 55 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 D91915 [1,0,1,0,0,0|2,0,0]=4 56 B12R1.226 CC1=CC=CC(\C=C\C(=O)O)=C1 66558 [1,0,1,0,0,0|2,0,0]=4 57 B12R1.226 CC1=CC=CC(\C=C\C(=O)O)=C1 AC7519 [1,0,1,0,0,0|2,0,0]=4 58 B12R1.226 O=C(O)\C=C\C1=CC(O)=CC=C1 F15419 [1,0,1,0,0,0|2,0,0]=4 59 B12R1.226 O=C(O)\C=C\C1=CC=CC(Br)=C1 AB6441 [1,0,1,0,0,0|1,1,0]=4 60 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 75802 [1,0,1,0,0,0|1,1,0]=4 61 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 AC7822 [1,0,1,0,0,0|1,1,0]=4 62 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 CK2538 [1,0,1,0,0,0|1,0,0]=3 63 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 P19618 [1,0,1,0,0,0|1,0,0]=3 64 B12R1.125 O=C(O)\C=C\C1=C(F)C=CC=C1 AC7832 [1,0,1,0,0,0|2,0,0]=4 65 B12R1.1009 O=C(O)CC1=C(Br)C=CC=C1F CL9410 [1,0,1,0,0,0|2,0,0]=4 66 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1F 67765 [1,0,1,0,0,0|2,0,0]=4 67 B12R1.1009 O=C(O)CC1=C(F)C=CC=C1F 67761 [1,0,1,0,0,0|2,0,0]=4 68 B12R2.24 BrC1=CC2=CC=CC=C2C=C1 11690 [2,0,0,0,0,0|2,0,0]=4 69 B12R2.24 BrC1=CC2=CC=CC=C2N=C1 20440 [2,0,0,0,0,0|1,0,1]=4 70 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 83965 [2,0,0,0,0,0|1,0,1]=4 71 B12R2.24 CC1=CC2=CC=CC=C2N=C1 26336 [2,0,0,0,0,0|1,0,1]=4 72 B12R2.24 ClC1=CC2=CC=CC=C2C=C1 59608 [2,0,0,0,0,0|2,0,0]=4 73 B12R2.24 ClC1=CC2=CC=CC=C2N=C1 35418 [2,0,0,0,0,0|1,0,1]=4 74 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 58004 [2,0,0,0,0,0|1,0,1]=4 75 B12R2.24 FC1=CC2=CC=CC=C2C=C1 C74649 [2,0,0,0,0,0|2,0,0]=4 76 B12R2.24 IC1=CC2=CC=CC=C2C=C1 S11969 [2,0,0,0,0,0|2,0,0]=4 77 B12R2.24 NC1=CC2=CC=CC=C2C=C1 23168 [2,0,0,0,0,0|2,0,0]=4 78 B12R2.24 NC1=CC2=CC=CC=C2N=C1 33959 [2,0,0,0,0,0|1,0,1]=4 79 B12R2.24 NC1=NC2=CC=CC=C2C=C1 33958 [2,0,0,0,0,0|1,0,1]=4 80 B12R2.24 O=C1C=C2C=CC=CC2=CN1 P10536 [2,0,0,0,0,0|2,0,0]=4 81 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 D81844 [2,0,0,0,0,0|1,0,0]=3 82 B12R2.24 O=C1C=NC2=C(C=CC=C2)N1 F16123 [2,0,0,0,0,0|1,0,0]=3 83 B12R2.24 O=C1CCC2=C(C=CC=C2)N1 64816 [2,0,0,0,0,0|0,0,2]=4 84 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 69683 [2,0,0,0,0,0|1,0,1]=4 85 B12R2.24 O=C1COC2=C(C=CC=C2)N1 64814 [2,0,0,0,0,0|1,0,1]=4 86 B12R2.24 O=C1CSC2=C(C=CC=C2)N1 F19976 [2,0,0,0,0,0|1,0,1]=4 87 B12R2.24 OC1=CC2=CC=CC=C2C=C1 D86186 [2,0,0,0,0,0|1,0,0]=3 88 B12R2.24 OC1=CC2=CC=CC=C2C=N1 28407 [2,0,0,0,0,0|2,0,0]=4 89 B12R2.24 OC1=CC2=CC=CC=C2N=C1 29144 [2,0,0,0,0,0|0,0,1]=3 90 B12R2.24 OC1=CC2=CC=CN=C2C=C1 CX1058 [2,0,0,0,0,0|2,0,0]=4 91 B12R2.24 OC1=CC2=CC=NC=C2C=C1 62313 [2,0,0,0,0,0|2,0,0]=4 92 B12R2.24 OC1=CC2=CN=CC=C2C=C1 37350 [2,0,0,0,0,0|2,0,0]=4 93 B12R2.24 OC1=CC2=NC=CC=C2C=C1 83197 [2,0,0,0,0,0|2,0,0]=4 94 B12R2.24 OC1=NC2=CC=CC=C2C=C1 70352 [2,0,0,0,0,0|0,0,2]=4 95 B12R2.24 SC1=CC2=CC=CC=C2C=C1 D70681 [2,0,0,0,0,0|1,1,0]=4 96 B12R2.1081 BrC1=CC=CC2=CC=CC=C12 20431 [2,0,0,0,0,0|1,1,0]=4 97 B12R2.1081 BrC1=CC=CC2=CC=CN=C12 56882 [2,0,0,0,0,0|0,1,1]=4 98 B12R2.1081 CC1=C2N=CC=CC2=CC=C1 I11487 [2,0,0,0,0,0|1,0,1]=4 99 B12R2.1081 ClC1=CC=CC2=CC=CN=C12 33526 [2,0,0,0,0,0|0,1,1]=4 100 B12R2.1081 FC1=CC=CC2=CC=CC=C12 36922 [2,0,0,0,0,0|1,0,0]=3 101 B12R2.1081 FC1=CC=CC2=CC=CN=C12 28762 [2,0,0,0,0,0|0,0,1]=3 102 B12R2.1081 FC1=CC=CC2=NC=CC=C12 78967 [2,0,0,0,0,0|2,0,0]=4 103 B12R2.1081 FC1=CC=CC2=NC=CN=C12 81019 [2,0,0,0,0,0|1,0,1]=4 104 B12R2.1081 FC1=CN=CC2=CC=CC=C12 11283 [2,0,0,0,0,0|2,0,0]=4 105 B12R2.1081 FC1=CN=CC2=CC=CC=C12 62060 [2,0,0,0,0,0|2,0,0]=4 106 B12R2.1081 IC1=CC=CC2=CC=CC=C12 24500 [2,0,0,0,0,0|1,1,0]=4 107 B12R2.1081 IC1=CC=CC2=CC=CN=C12 P10543 [2,0,0,0,0,0|0,1,1]=4 108 B12R2.1081 NC1=C2N=CC=CC2=CC=C1 11064 [2,0,0,0,0,0|1,0,1]=4 109 B12R2.1081 NC1=CC=CC2=CC=CC=C12 55749 [2,0,0,0,0,0|2,0,0]=4 110 B12R2.1081 NC1=CC=CC2=CC=CC=C12 75169 [2,0,0,0,0,0|2,0,0]=4 111 B12R2.1081 OC1=CC=CC2=CC=CN=C12 F19192 [2,0,0,0,0,0|1,0,1]=4 112 B12R2.1081 OC1=CC=CC2=CC=CN=C12 P17615 [2,0,0,0,0,0|1,0,1]=4 113 B12R2.1081 [O-]C1=CC=CC2=CC=CN=C12 D92587 [2,0,0,0,0,0|1,0,1]=4 114 B12R2.1081 [O-]C1=CC=CC2=CC=CN=C12 F14143 [2,0,0,0,0,0|1,0,1]=4 115 B14R1.5971 CC1=CC=CC(C)=C1NC(=O)C(=O)O W17413 [0,1,1,0,0,0|2,0,0]=4 116 B14R1.5971 O=C(O)C(=O)NC1=C(F)C=CC=C1F W13084 [0,1,1,0,0,0|1,0,0]=3 117 B14R2.142 O=CC1=NC2=C(O)C=CC=C2C=C1 84598 [1,1,0,0,0,0|1,0,1]=4 118 B14R2.4513 CC1=C(Cl)C=CC2=C1NC(=O)C=C2 D97443 [1,1,0,0,0,0|1,0,0]=3 119 B14R2.8045 CC1=CC=CC2=C1NC(=O)OC2=O 59401 [1,1,0,0,0,0|2,0,0]=4 120 B14R2.8045 O=C1NC(=O)C2=CC=CC(Br)=C2N1 81125 [1,1,0,0,0,0|1,1,0]=4 121 B14R2.8045 O=C1NC(=O)C2=CC=CC(I)=C2N1 F11875 [1,1,0,0,0,0|1,1,0]=4 122 B14R2.8045 O=C1NC2=C(Br)C=CC=C2C(=O)O1 66923 [1,1,0,0,0,0|1,1,0]=4 123 B14R2.1128 CCC1=NC2=C(C=CC=C2)NC1=O Y13473 [1,1,0,0,0,0|2,0,0]=4 124 B14R2.1128 N#CC1=CC2=C(C=CC=C2)OC1=O 95283 [1,1,0,0,0,0|2,0,0]=4 125 B14R2.1128 O=C1NC2=C(C=CC=C2)C=C1CO D94814 [1,1,0,0,0,0|0,0,0]=2 126 B14R2.1128 O=C1NC2=C(C=CC=C2)N=C1CBr 56526 [1,1,0,0,0,0|2,0,0]=4 127 B14R2.8188 CN1C(=O)C(=O)NC2=C1C=CC=C2 AT21275 [1,1,0,0,0,0|1,0,1]=4 128 B14R2.8188 O=C1CC2=C(C=CC=C2)C(=O)N1O D82581 [1,1,0,0,0,0|2,0,0]=4 129 B14R2.8239 CC1=CC2=C(C=C1)NC(=O)C(=O)N2 D87108 [1,1,0,0,0,0|1,0,1]=4 130 B14R2.8239 O=C1NC2=C(C=C(Br)C=C2)NC1=O C73649 [1,1,0,0,0,0|1,0,1]=4 131 B14R2.1801 COC1=CC2=CC=CC(O)=C2C=C1 FD10559 [1,1,0,0,0,0|2,0,0]=4 132 B14R2.7970 CC1(C)C(=O)NC2=C(F)C=CC=C21 61684 [0,1,0,0,1,0|1,0,1]=4 133 B14R2.8620 O=C1NC2=C(Cl)C=CC(Cl)=C2C1=O 28499 [0,1,0,0,1,0|0,1,1]=4 134 B14R2.8737 O=C1NC2=C(C=CC(Br)=C2F)C1=O 53854 [0,1,0,0,1,0|0,0,1]=3 135 B14R2.9184 CC1=C2NC(=O)C(=O)C2=CC(Cl)=C1 D70173 [0,1,0,0,1,0|1,0,1]=4 136 B14R2.9184 CC1=CC2=C(NC(=O)C2=O)C(C)=C1 61357 [0,1,0,0,1,0|1,0,1]=4 137 B14R2.9184 O=C1NC2=C(Br)C=C(Br)C=C2C1=O D94721 [0,1,0,0,1,0|0,1,1]=4 138 B14R2.9184 O=C1NC2=C(Br)C=C(F)C=C2C1=O C74941 [0,1,0,0,1,0|0,1,1]=4 139 B14R2.11645 CCC1=CC=CC2=C1NC(=O)C2=O 61516 [0,1,0,0,1,0|1,0,1]=4 140 B14R2.11645 COC1=CC=CC2=C1NC(=O)C2=O 23282 [0,1,0,0,1,0|1,0,1]=4 141 B14R2.28485 CN1C(=O)C(=O)C2=CC=CC(F)=C21 D84322 [0,1,0,0,1,0|0,0,1]=3 142 B14R2.27750 O=C1NC2=CC(F)=CC(F)=C2C1=O 84209 [0,1,0,0,1,0|1,0,1]=4 143 B14R2.4529 CC(=O)C1=CC2=C(C=CC(Br)=C2)O1 77541 [0,0,1,1,0,0|1,1,0]=4 144 B14R2.4529 NC(=O)C1=CC2=C(C=CC(Cl)=C2)N1 C74007 [0,0,1,1,0,0|1,1,0]=4 145 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)O1 H11401 [0,0,1,1,0,0|1,1,0]=4 146 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)O1 50626 [0,0,1,1,0,0|1,1,0]=4 147 B14R2.4529 O=C(O)C1=CC2=C(C=CC(F)=C2)N1 33858 [0,0,1,1,0,0|2,0,0]=4 148 B14R2.4529 O=C(O)C1=CC2=C(C=CC(F)=C2)S1 76283 [0,0,1,1,0,0|1,1,0]=4 149 B14R2.7969 O=C(O)C1=CC2=CC=CC(Br)=C2O1 66267 [0,0,1,1,0,0|1,1,0]=4 150 B12R1.225 O=C(O)C(=O)C1=CC=CC(F)=C1 A12852 [0,0,1,0,1,0|1,0,1]=4 151 B12R1.124 O=C(O)C(=O)C1=C(Br)C=CC=C1 25864 [0,0,1,0,1,0|1,1,0]=4 152 B12R2.202 CC1=CC=CC2=C1NC(=O)C2 O11661 [1,0,0,0,1,0|1,0,1]=4 153 B12R2.202 CC1=CC=CC2=C1NC(=O)N2 O11256 [1,0,0,0,1,0|2,0,0]=4 154 B12R2.202 O=C1CC2=C(F)C=CC=C2N1 84276 [1,0,0,0,1,0|2,0,0]=4 155 B12R2.202 O=C1CC2=CC=CC(Br)=C2N1 BL006424 [1,0,0,0,1,0|0,1,1]=4 156 B12R2.202 O=C1CC2=CC=CC(Cl)=C2N1 33874 [1,0,0,0,1,0|0,1,1]=4 157 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 61126 [1,0,0,0,1,0|0,0,1]=3 158 B12R2.202 O=C1NC2=C(F)C=CC=C2O1 P15214 [1,0,0,0,1,0|1,0,0]=3 159 B12R2.203 O=C1CCC2=CC=CC(F)=C12 61630 [1,0,0,0,1,0|0,0,2]=4 160 B12R2.203 O=C1NNC2=CC=CC(F)=C12 F18027 [1,0,0,0,1,0|2,0,0]=4 161 B12R2.18 CC1=C(C)C2=C(C=CC=C2)N1 F12404 [1,0,0,0,1,0|2,0,0]=4 162 B12R2.18 CN1C(=O)NC2=C1C=CC=C2 W11509 [1,0,0,0,1,0|2,0,0]=4 163 B12R2.18 C[C@@H]1C(=O)NC2=C1C=CC=C2 D84199 [1,0,0,0,1,0|1,0,1]=4 164 B12R2.18 N[C@@H]1C(=O)NC2=C1C=CC=C2 AT10673 [1,0,0,0,1,0|1,0,1]=4 165 B12R2.18 O=C1CC2=C(C=CC=C2)C1=O 29193 [1,0,0,0,1,0|0,0,2]=4 166 B12R2.18 O=C1NC2=C(C=CC=C2)C1=O D70304 [1,0,0,0,1,0|0,0,1]=3 167 B12R2.196 CC1=CNC2=C(Br)C=CC=C12 50162 [1,0,0,0,1,0|1,1,0]=4 168 B12R2.196 FC1=CC=CC2=C1NN=C2Br 83191 [1,0,0,0,1,0|2,0,0]=4 169 B12R2.196 NC1=NNC2=C(F)C=CC=C12 51569 [1,0,0,0,1,0|2,0,0]=4