0 B13R2.369 CC1=CC2=CC=CC=C2C=C1O BB31-5686 [0,0,0,0,0,0|2,0,0]=2 1 B13R2.369 CC1=NC2=CC=CC=C2C=C1Cl BB31-0296 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.369 ClC1=CC2=CC=NC=C2C=C1Br BB31-1666 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.369 NC1=CC2=CC=CC=C2C=C1Br BB32-2439 [0,0,0,0,0,0|3,0,0]=3 4 B13R2.369 O=C1OC2=C(C=CC=C2)C=C1Br BB31-7389 [0,0,0,0,0,0|1,0,0]=1 5 B13R2.369 OC1=NC2=CC=CC=C2C=C1Br BB31-7203 [0,0,0,0,0,0|2,0,1]=3 6 B12R2.24 BrC1=CC2=CC=CN=C2N=C1 BB31-3730 [1,0,0,0,0,0|3,0,0]=4 7 B12R2.24 ClC1=NC2=C(C=CC=C2)C=N1 BB54-4154 [1,0,0,0,0,0|3,0,0]=4 8 B12R2.24 ClC1=NC2=CN=CC=C2C=C1 BB32-2019 [1,0,0,0,0,0|3,0,0]=4 9 B12R2.24 ClC1=NC2=NC=CC=C2C=C1 BB31-3061 [1,0,0,0,0,0|3,0,0]=4 10 B12R2.24 FC1=CC2=CC=CC=C2N=C1 BB32-1722 [1,0,0,0,0,0|2,0,0]=3 11 B12R2.24 FC1=NC2=CC=CC=C2C=C1 BB31-4902 [1,0,0,0,0,0|2,0,0]=3 12 B12R2.24 IC1=CC2=CC=CC=C2N=C1 BB31-6878 [1,0,0,0,0,0|2,0,0]=3 13 B12R2.24 IC1=CC2=CC=NC=C2C=C1 BB31-7186 [1,0,0,0,0,0|3,0,0]=4 14 B12R2.24 NC1=CC2=CC=CC=C2N=C1 BB52-6146 [1,0,0,0,0,0|2,0,0]=3 15 B12R2.24 NC1=CC2=CC=NC=C2N=C1 BB32-3122 [1,0,0,0,0,0|3,0,0]=4 16 B12R2.24 O=C1C=CC2=C(C=CC=N2)N1 BB31-0331 [1,0,0,0,0,0|2,0,0]=3 17 B14R2.1128 C#CC1=CC2=CC=CC=C2N=C1Cl BB31-9885 [0,1,0,0,0,0|3,0,0]=4 18 B14R2.1128 C(=O)C1=CC2=CC=CC=C2OC1C BB52-0800 [0,1,0,0,0,0|1,0,2]=4 19 B14R2.1128 COC1=CC2=CC=CC=C2C=C1O BB31-5802 [0,1,0,0,0,0|1,0,1]=3 20 B14R2.1128 COC1=CC2=NC=CC=C2C=C1Br BB32-0769 [0,1,0,0,0,0|3,0,0]=4 21 B14R2.1128 O=C1NC2=C(C=CC=C2)C=C1CO BB31-7473 [0,1,0,0,0,0|1,0,0]=2 22 B14R2.1128 O=CC1=CC2=C(C=CC=C2)OC1=O BB52-7366 [0,1,0,0,0,0|0,0,1]=2 23 B14R2.1128 O=CC1=CC2=CC=CC=C2C=C1O BB31-5796 [0,1,0,0,0,0|1,0,0]=2 24 B14R2.1128 OCC1=CC2=CC=CC=C2N=C1Cl BB31-1316 [0,1,0,0,0,0|2,0,0]=3 25 B14R2.8188 CC1=C(O)C2=C(C=CC=C2)NC1=O BB32-0539 [0,1,0,0,0,0|2,0,0]=3 26 B14R2.8188 CC1=NC2=CC=CC=C2C(O)=C1Br BB32-3659 [0,1,0,0,0,0|3,0,0]=4 27 B14R2.8188 CC1=NC2=CC=CC=C2C(O)=C1I BB32-3084 [0,1,0,0,0,0|3,0,0]=4 28 B14R2.8239 CC1=CC2=CC(Cl)=CC=C2N=C1Cl BB31-1927 [0,1,0,0,0,0|3,0,0]=4 29 B14R2.8239 CC1=CC=C2N=C(C)C(=O)NC2=C1 BB51-0034 [0,1,0,0,0,0|3,0,0]=4 30 B14R2.8239 CC1=NC2=CC(Br)=CC=C2NC1=O BB51-0035 [0,1,0,0,0,0|3,0,0]=4 31 B14R2.8239 CC1=NC2=CC=C(Cl)C=C2NC1=O BB51-0033 [0,1,0,0,0,0|3,0,0]=4 32 B14R2.8239 O=C1NC2=C(C=C(F)C=C2)NC1=O BB32-3579 [0,1,0,0,0,0|2,0,1]=4 33 B14R2.28472 CC1=C(N)C=C2C=CC=C(F)C2=N1 BB31-1422 [0,1,0,0,0,0|3,0,0]=4 34 B12R1.43 CN(C)C(=O)OC1=CC=CC=C1 BB32-3884 [0,0,1,0,0,0|2,0,1]=4 35 B12R1.43 C[C@H](NC1=CC=CC=C1)C(=O)O BB31-3006 [0,0,1,0,0,0|2,0,1]=4 36 B12R1.43 O=C(O)[C@H](Br)CC1=CC=CC=C1 BB31-7674 [0,0,1,0,0,0|1,0,2]=4 37 B12R2.18 CC1=C(C)C2=C(C=CC=C2)O1 BB32-1322 [0,0,0,0,1,0|2,0,0]=3 38 B12R2.18 O=C1SC2=C(C=CC=C2)C1=O BB31-7685 [0,0,0,0,1,0|0,1,1]=3 39 B12R2.100 OC1=C(Cl)C=C2NC=CC2=C1 BB32-0824 [0,0,0,0,1,0|3,0,0]=4 40 B14R2.738 CC1=NC2=CC=CC=C2NC(=O)C1 BB52-1545 [0,0,0,0,0,1|3,0,0]=4 41 B14R2.741 CN1N=CC2=C(C=CC=C2)CC1=O BB32-1533 [0,0,0,0,0,1|3,0,0]=4 42 B11R1.40 NNC(=O)OC1=CC=CC=C1 BB31-5306 [1,0,1,0,0,0|2,0,0]=4 43 B11R1.40 O=C(CO)NC1=CC=CC=C1 BB32-2558 [1,0,1,0,0,0|1,0,1]=4 44 B11R1.1 O=C\C=C\C1=CC=C(O)C=C1 BB32-1043 [1,0,1,0,0,0|2,0,0]=4 45 B13R1.133 O=C(O)C(O)CC1=CC=C(Cl)C=C1 BB31-4228 [0,1,1,0,0,0|0,0,2]=4 46 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(F)C=C1 BB31-1106 [0,1,1,0,0,0|0,0,2]=4 47 B13R1.418 O=C(O)[C@@H](CO)CC1=CC=CC=C1 BB31-0992 [0,1,1,0,0,0|0,0,2]=4 48 B13R2.32 CC1=C(Br)C=CC2=CC=CC=C21 BB31-3846 [1,1,0,0,0,0|2,0,0]=4 49 B13R2.32 CC1=C(Cl)C2=CC=CC=C2N=C1 BB31-5917 [1,1,0,0,0,0|2,0,0]=4 50 B13R2.32 CC1=C(O)C=CC2=CC=CC=C21 BB31-8753 [1,1,0,0,0,0|1,0,0]=3 51 B13R2.32 NC1=C(F)C2=CC=CC=C2C=C1 BB31-2550 [1,1,0,0,0,0|2,0,0]=4 52 B13R2.32 NC1=C(N)C2=CC=CC=C2N=C1 BB31-6522 [1,1,0,0,0,0|2,0,0]=4 53 B13R2.32 OC1=C(O)C2=CC=CC=C2C=C1 BB31-5482 [1,1,0,0,0,0|1,0,0]=3 54 B13R2.57 CNC1=CC2=CC=CC=C2C=C1 BB32-1489 [1,1,0,0,0,0|2,0,0]=4 55 B13R2.57 O=CC1=CC2=CC=NC=C2C=C1 BB31-3393 [1,1,0,0,0,0|2,0,0]=4 56 B13R2.57 O=CC1=NC2=NC=CC=C2C=C1 BB32-3134 [1,1,0,0,0,0|2,0,0]=4 57 B13R2.57 OCC1=CC2=CC=NC=C2C=C1 BB32-0574 [1,1,0,0,0,0|2,0,0]=4 58 B13R2.155 BrC1=CC=C2N=CC(Br)=CC2=C1 BB31-7103 [1,1,0,0,0,0|2,0,0]=4 59 B13R2.155 CC1=CC=C2C=CC(O)=CC2=C1 BB31-4440 [1,1,0,0,0,0|1,0,0]=3 60 B13R2.155 NC1=CC=C2C=CC(Br)=CC2=N1 BB31-0461 [1,1,0,0,0,0|2,0,0]=4 61 B13R2.155 NC1=CN=C2C=CC(Cl)=CC2=C1 BB31-9284 [1,1,0,0,0,0|2,0,0]=4 62 B13R2.155 O=C1C=CC2=C(N=C(Cl)C=C2)N1 BB31-3066 [1,1,0,0,0,0|2,0,0]=4 63 B13R2.155 O=C1N=CC2=C(C=C(Br)C=C2)N1 BB31-7113 [1,1,0,0,0,0|2,0,0]=4 64 B13R2.155 OC1=CC=C2C=CC(Cl)=CC2=C1 BB31-7817 [1,1,0,0,0,0|1,0,0]=3 65 B13R2.155 OC1=CC=C2C=CC(Cl)=NC2=C1 BB32-2025 [1,1,0,0,0,0|2,0,0]=4 66 B13R2.162 BrC1=C2C=C(I)C=NC2=CC=C1 BB31-2709 [1,1,0,0,0,0|2,0,0]=4 67 B13R2.162 CC1=C2C=C(Br)C=CC2=CC=C1 BB31-5144 [1,1,0,0,0,0|2,0,0]=4 68 B13R2.162 CC1=CC=C2C=CC=C(N)C2=C1 BB31-5030 [1,1,0,0,0,0|2,0,0]=4 69 B13R2.162 CC1=NC2=C(N)C=CC=C2C=C1 BB52-5214 [1,1,0,0,0,0|2,0,0]=4 70 B13R2.162 ClC1=C2N=C(Br)C=CC2=CC=C1 BB31-7056 [1,1,0,0,0,0|2,0,0]=4 71 B13R2.162 N=C1C=CC2=CC=CC(Cl)=C2N1 BB32-1492 [1,1,0,0,0,0|2,0,0]=4 72 B13R2.162 NC1=C2C=C(Br)C=CC2=CC=C1 BB31-2047 [1,1,0,0,0,0|2,0,0]=4 73 B13R2.162 NC1=C2C=C(F)C=NC2=CC=C1 BB31-2946 [1,1,0,0,0,0|2,0,0]=4 74 B13R2.162 NC1=CN=C2C=CC=C(Cl)C2=C1 BB31-2699 [1,1,0,0,0,0|2,0,0]=4 75 B13R2.162 OC1=C2C=C(Br)C=CC2=CC=C1 BB31-5043 [1,1,0,0,0,0|2,0,0]=4 76 B13R2.162 OC1=C2C=C(Cl)C=CC2=CC=C1 BB32-3263 [1,1,0,0,0,0|2,0,0]=4 77 B13R2.162 OC1=C2C=C(F)C=CC2=CC=C1 BB32-2013 [1,1,0,0,0,0|2,0,0]=4 78 B13R2.162 OC1=C2N=C(Br)C=CC2=CC=C1 BB31-2451 [1,1,0,0,0,0|2,0,0]=4 79 B13R2.162 OC1=CC=C2N=CC=C(Cl)C2=C1 BB31-2642 [1,1,0,0,0,0|2,0,0]=4 80 B13R2.328 CC1=CC(C)=NC2=CC=CC=C12 BB31-1387 [1,1,0,0,0,0|2,0,0]=4 81 B13R2.328 CC1=CC(O)=NC2=CC=CC=C12 BB52-1533 [1,1,0,0,0,0|1,0,1]=4 82 B13R2.328 NC1=CC(Br)=NC2=CC=CC=C12 BB32-1704 [1,1,0,0,0,0|2,0,0]=4 83 B13R2.328 O=C1C=C(Br)C2=C(C=CC=C2)N1 BB31-7409 [1,1,0,0,0,0|1,0,0]=3 84 B13R2.328 O=C1C=C(O)C2=CC=CN=C2N1 BB32-3345 [1,1,0,0,0,0|2,0,0]=4 85 B13R2.328 OC1=CC(Br)=CC2=CC=CC=C12 BB31-5300 [1,1,0,0,0,0|2,0,0]=4 86 B13R2.328 OC1=CC(Cl)=NC2=CC=CC=C12 BB31-8676 [1,1,0,0,0,0|2,0,0]=4 87 B13R2.3683 BrC1=CC=C2C=C(I)C=CC2=C1 BB32-1777 [1,1,0,0,0,0|2,0,0]=4 88 B13R2.3683 BrC1=CN=C2C=C(I)C=CC2=C1 BB32-0044 [1,1,0,0,0,0|2,0,0]=4 89 B13R2.3683 CC1=CC=C2C=C(I)C=CC2=N1 BB31-8212 [1,1,0,0,0,0|2,0,0]=4 90 B13R2.3683 ClC1=CN=C2C=C(Br)C=CC2=C1 BB31-1088 [1,1,0,0,0,0|2,0,0]=4 91 B13R2.3683 FC1=CC=C2C=C(Br)C=NC2=C1 BB32-1201 [1,1,0,0,0,0|2,0,0]=4 92 B13R2.3683 FC1=CN=C2C=C(Br)C=CC2=C1 BB31-2087 [1,1,0,0,0,0|2,0,0]=4 93 B13R2.3683 NC1=CC2=C(C=C1)OC(=O)C=C2 BB31-6037 [1,1,0,0,0,0|0,0,0]=2 94 B13R2.3683 NC1=CC=C2OC(=O)C=CC2=C1 BB52-5081 [1,1,0,0,0,0|0,0,0]=2 95 B13R2.3683 NC1=CN=C2C=C(Br)C=CC2=C1 BB31-1580 [1,1,0,0,0,0|2,0,0]=4 96 B13R2.3683 O=C1CCC2=C(C=CC(I)=C2)O1 BB32-0105 [1,1,0,0,0,0|0,0,2]=4 97 B13R2.3683 O=C1N=CC2=C(C=CC(Br)=C2)N1 BB31-6835 [1,1,0,0,0,0|2,0,0]=4 98 B13R2.3683 OC1=CC=C2C=C(Cl)C=CC2=C1 BB32-1301 [1,1,0,0,0,0|1,0,0]=3 99 B13R2.3683 OC1=CC=C2C=C(Cl)C=NC2=C1 BB31-1518 [1,1,0,0,0,0|2,0,0]=4 100 B13R2.3683 OC1=CC=C2C=C(F)C=CC2=C1 BB31-1684 [1,1,0,0,0,0|1,0,0]=3 101 B13R2.5179 BrC1=CC=C2C(Br)=CC=CC2=C1 BB31-3997 [1,1,0,0,0,0|2,0,0]=4 102 B13R2.5179 CC1=CC2=CC=CC(N)=C2N=C1 BB32-1859 [1,1,0,0,0,0|2,0,0]=4 103 B13R2.5179 CC1=CC=C2C(Cl)=CC=CC2=N1 BB32-2473 [1,1,0,0,0,0|2,0,0]=4 104 B13R2.5179 CC1=CN=C2C(O)=CC=CC2=C1 BB31-7012 [1,1,0,0,0,0|2,0,0]=4 105 B13R2.5179 NC1=C2N=CC(Br)=CC2=CC=C1 BB31-2450 [1,1,0,0,0,0|2,0,0]=4 106 B13R2.5179 NC1=CC=C2C(O)=CC=CC2=C1 BB31-6036 [1,1,0,0,0,0|2,0,0]=4 107 B13R2.5179 NC1=CC=CC2=C1C=CC(=O)N2 BB32-3197 [1,1,0,0,0,0|1,0,0]=3 108 B13R2.5179 O=C1C=CC2=C(Br)C=CC=C2N1 BB31-7109 [1,1,0,0,0,0|1,0,0]=3 109 B13R2.5179 O=C1C=CC2=C(C=CC=C2O)N1 BB31-4990 [1,1,0,0,0,0|1,0,0]=3 110 B13R2.5179 O=C1C=CC2=C(F)C=CC=C2N1 BB32-3348 [1,1,0,0,0,0|1,0,0]=3 111 B13R2.5179 OC1=C2C=CC(Br)=CC2=CC=C1 BB31-5139 [1,1,0,0,0,0|2,0,0]=4 112 B13R2.5179 OC1=C2C=CC(F)=CC2=CC=C1 BB31-8653 [1,1,0,0,0,0|2,0,0]=4 113 B13R2.5179 OC1=C2N=CC(Cl)=CC2=CC=C1 BB31-9242 [1,1,0,0,0,0|2,0,0]=4 114 B13R2.5179 OC1=CC=C2C(Br)=CC=NC2=C1 BB31-3573 [1,1,0,0,0,0|2,0,0]=4 115 B13R2.45 CC1=C(C=O)NC2=C1C=CC=C2 BB32-2202 [0,1,0,0,1,0|2,0,0]=4 116 B13R2.135 CC1=C(C=O)C2=C(C=CC=C2)S1 BB31-4599 [0,1,0,0,1,0|2,0,0]=4 117 B13R2.135 O=CC1=C(Br)NC2=C1C=CC=C2 BB31-8991 [0,1,0,0,1,0|2,0,0]=4 118 B13R2.3085 O=C1C2=CC=CN=C2C(=O)N1O BB31-4232 [0,1,0,0,1,0|2,0,0]=4 119 B13R2.4856 O=C1NC2=CC=CC(Cl)=C2C1=O BB52-1468 [0,1,0,0,1,0|1,0,1]=4 120 B15R2.117 OCC1=CC2=CC=CC=C2C=C1CO BB31-5610 [0,2,0,0,0,0|1,0,1]=4 121 B15R2.984 CC1=CC2=CC=CC=C2N=C1C(=O)O BB31-7459 [0,2,0,0,0,0|2,0,0]=4 122 B15R2.984 CC1=NC2=CC=CC=C2C=C1C(=O)O BB52-1639 [0,2,0,0,0,0|2,0,0]=4 123 B15R2.984 NC(=O)C1=CC2=CC=CC=C2C=C1N BB32-1120 [0,2,0,0,0,0|2,0,0]=4 124 B15R2.984 O=C(O)C1=CC2=CC=CN=C2NC1=O BB32-2482 [0,2,0,0,0,0|2,0,0]=4 125 B15R2.984 O=C(O)C1=NC2=CC=CC=C2C=C1O BB31-7962 [0,2,0,0,0,0|1,0,0]=3 126 B15R2.1754 N#CC1=CC2=C(C=C(O)C=C2)OC1=O BB31-3987 [0,2,0,0,0,0|1,0,0]=3 127 B15R2.1754 O=CC1=CC2=C(C=C(Cl)C=C2)NC1=O BB31-6918 [0,2,0,0,0,0|1,0,1]=4 128 B15R2.1824 CC1=CC2=C(C=C1)NC(=O)C(C=O)=C2 BB31-0195 [0,2,0,0,0,0|1,0,1]=4 129 B15R2.63893 CC1=C(C)C2=CC=C(O)C=C2OC1=O BB52-0834 [0,2,0,0,0,0|1,0,0]=3 130 B15R2.63893 CC1=C(Cl)C(=O)OC2=CC(O)=CC=C21 BB52-0881 [0,2,0,0,0,0|1,0,0]=3 131 B15R2.63893 CC1=C(F)C(=O)OC2=CC(O)=CC=C21 BB52-0421 [0,2,0,0,0,0|1,0,0]=3 132 B15R2.62227 OC1=CC2=CC(Br)=C(O)C=C2C=C1Br BB31-0884 [0,2,0,0,0,0|2,0,0]=4 133 B13R2.435 NC(=O)C1=CC2=C(C=CC=C2)N1 BB32-0448 [0,0,1,1,0,0|2,0,0]=4 134 B13R2.435 NC(=O)C1=CC2=CC=CC=C2O1 BB52-4124 [0,0,1,1,0,0|1,0,0]=3 135 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)N1 BB32-0944 [0,0,1,1,0,0|2,0,0]=4 136 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)S1 BB31-4928 [0,0,1,1,0,0|1,1,0]=4 137 B13R2.435 O=C(O)C1=CN2C=CC=CC2=C1 BB32-1633 [0,0,1,1,0,0|2,0,0]=4 138 B13R2.435 O=C(O)C1=NN2C=CC=CC2=C1 BB51-0827 [0,0,1,1,0,0|2,0,0]=4 139 B13R2.163 O=C1CC2=C(C=CC=C2)C=CN1 BB31-5524 [0,0,1,1,0,0|2,0,0]=4 140 B13R2.1613 O=CC1=NC=CC2=CC=CC=C21 BB31-7698 [0,0,1,1,0,0|2,0,0]=4 141 B13R2.54 O=CC1=CC2=C(Br)C=CC=C2N1 BB31-2034 [0,0,1,1,0,0|2,0,0]=4 142 B11R1.222 CC1=C(C(=O)C=O)C=CC=C1 BB32-3322 [0,0,1,0,1,0|0,0,2]=4 143 B11R2.1 BrC1=COC2=CC=CN=C12 BB31-7324 [1,0,0,0,1,0|2,0,0]=4 144 B11R2.1 CC1=NOC2=C1C=CC=C2 BB31-4705 [1,0,0,0,1,0|2,0,0]=4 145 B11R2.1 ClC1=CNC2=C1C=CC=C2 BB31-3376 [1,0,0,0,1,0|2,0,0]=4 146 B11R2.1 NC1=CNC2=C1C=CC=C2 BB32-3019 [1,0,0,0,1,0|2,0,0]=4 147 B11R2.1 O=C1CSC2=C1C=CC=C2 BB31-1622 [1,0,0,0,1,0|1,0,1]=4 148 B11R2.10 BrC1=CC2=C(C=CC=C2)N1 BB31-2458 [1,0,0,0,1,0|2,0,0]=4 149 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 BB32-2216 [1,0,0,0,1,0|1,0,0]=3 150 B11R2.10 IC1=CC2=C(C=CC=C2)N1 BB31-4420 [1,0,0,0,1,0|2,0,0]=4 151 B11R2.10 IC1=CC2=C(C=CC=C2)S1 BB32-1612 [1,0,0,0,1,0|1,1,0]=4 152 B11R2.10 NC1=NC2=CC=CC=C2O1 BB52-8718 [1,0,0,0,1,0|2,0,0]=4 153 B11R2.10 O=C1NC2=C(C=NC=C2)O1 BB32-3787 [1,0,0,0,1,0|2,0,0]=4 154 B11R2.10 O=C1O[N+]2=C(C=CC=C2)S1 BB31-5543 [1,0,0,0,1,0|2,0,0]=4 155 B11R2.36 O=C1C=CC2=C(NC=C2)N1 BB31-4946 [1,0,0,0,1,0|2,0,0]=4 156 B11R2.36 OC1=CC2=C(C=C1)SC=C2 BB32-0598 [1,0,0,0,1,0|2,0,0]=4 157 B11R2.36 OC1=CC2=C(C=CO2)C=C1 BB31-1913 [1,0,0,0,1,0|2,0,0]=4 158 B13R1.351 C[C@@H](O)C(=O)OCC1=CC=CC=C1 BB31-6885 [0,0,1,0,0,1|0,0,2]=4