0 B12R2.1081 BrC1=C2C=CC=NC2=CC=C1 BB56-0626 [0,0,0,0,0,0|2,0,0]=2 1 B12R2.1081 BrC1=C2N=CC=CC2=CC=C1 BB56-0627 [0,0,0,0,0,0|2,0,0]=2 2 B12R2.1081 CC1=CC=CC2=C1NCCC2 BB05-1497 [0,0,0,0,0,0|1,0,3]=4 3 B12R2.1081 IC1=CN=CC2=CC=CC=C12 BB58-4970 [0,0,0,0,0,0|4,0,0]=4 4 B12R2.1081 NC1=CC=NC2=C1C=CC=C2 BB54-4038 [0,0,0,0,0,0|4,0,0]=4 5 B12R2.1081 NC1=CN=CC2=CC=CC=C12 BB58-0352 [0,0,0,0,0,0|4,0,0]=4 6 B12R2.1081 NC1=NC=CC2=C1C=CC=C2 BB01-6263 [0,0,0,0,0,0|4,0,0]=4 7 B12R2.1081 O=C1NC=CC2=CC=CC=C12 BB57-4849 [0,0,0,0,0,0|4,0,0]=4 8 B12R2.1081 OC1=CC=NC2=CC=CC=C12 BB01-2824 [0,0,0,0,0,0|4,0,0]=4 9 B12R2.1081 SC1=NC=CC2=CC=CC=C21 BB57-5707 [0,0,0,0,0,0|4,0,0]=4 10 B13R2.32 CC1=C(N)C2=CC=CN=C2C=C1 BB12-5008 [0,1,0,0,0,0|2,0,0]=3 11 B13R2.32 CC1=C(O)C2=C(C=CC=N2)C=C1 BB57-3397 [0,1,0,0,0,0|2,0,0]=3 12 B13R2.32 CC1=CC=C2N=CC=CC2=C1Br BB57-7200 [0,1,0,0,0,0|2,0,0]=3 13 B13R2.32 NC1=C2C=CC=CC2=CC=C1O BB54-1922 [0,1,0,0,0,0|3,0,0]=4 14 B13R2.32 NC1=CC=C2N=CC=CC2=C1Br BB57-3429 [0,1,0,0,0,0|2,0,0]=3 15 B13R2.32 OC1=C(Cl)C2=CC=CC=C2C=C1 BB12-5003 [0,1,0,0,0,0|3,0,0]=4 16 B13R2.162 BrC1=NC2=C(Br)C=CN=C2C=C1 BB31-1976 [0,1,0,0,0,0|3,0,0]=4 17 B13R2.162 CC1=C2N=C(N)C=CC2=CC=C1 BB58-5092 [0,1,0,0,0,0|1,0,0]=2 18 B13R2.162 CC1=NC2=C(Br)C=CC=C2C=C1 BB56-0660 [0,1,0,0,0,0|2,0,0]=3 19 B13R2.162 NC1=NC2=C(C=CC=C2O)C=C1 BB57-3388 [0,1,0,0,0,0|2,0,0]=3 20 B13R2.328 NC1=CC(Br)=CC2=CC=CN=C12 BB54-0021 [0,1,0,0,0,0|2,0,0]=3 21 B13R2.328 NC1=CC(Cl)=CC2=C1N=CC=C2 BB54-3680 [0,1,0,0,0,0|2,0,0]=3 22 B13R2.328 OC1=CC2=C(N=CC=C2)C(O)=C1 BB58-1203 [0,1,0,0,0,0|2,0,0]=3 23 B13R2.342 CC1=C2N=CC=C(N)C2=CC=C1 BB54-3689 [0,1,0,0,0,0|1,0,0]=2 24 B13R2.342 ClC1=CC=NC2=C(Cl)C=CC=C12 BB54-4173 [0,1,0,0,0,0|2,0,0]=3 25 B13R2.342 FC1=C2N=CC=C(Cl)C2=CC=C1 BB54-4566 [0,1,0,0,0,0|2,0,0]=3 26 B13R2.342 NC1=C2C=CC=C(Br)C2=NC=C1 BB54-4904 [0,1,0,0,0,0|2,0,0]=3 27 B13R2.342 NC1=CC=NC2=C(Cl)C=CC=C12 BB54-3690 [0,1,0,0,0,0|2,0,0]=3 28 B13R2.342 NC1=CC=NC2=C(F)C=CC=C12 BB54-4176 [0,1,0,0,0,0|2,0,0]=3 29 B13R2.342 O=C1C=CNC2=C(Cl)C=CC=C12 BB54-3990 [0,1,0,0,0,0|2,0,1]=4 30 B13R2.342 OC1=CC=NC2=C(Cl)C=CC=C12 BB54-4273 [0,1,0,0,0,0|2,0,0]=3 31 B13R2.342 OC1=CC=NC2=C(F)C=CC=C12 BB54-4175 [0,1,0,0,0,0|2,0,0]=3 32 B13R2.371 BrC1=C2C=CC=NC2=C(Br)C=C1 BB56-0624 [0,1,0,0,0,0|2,0,0]=3 33 B13R2.371 CC1=C2N=CC=CC2=C(Br)C=C1 BB56-0625 [0,1,0,0,0,0|1,0,0]=2 34 B13R2.371 CC1=CC=C(O)C2=C1C=CC=N2 BB58-1201 [0,1,0,0,0,0|1,0,0]=2 35 B13R2.371 NC1=C2N=CC=CC2=C(Cl)C=C1 BB20-1267 [0,1,0,0,0,0|2,0,0]=3 36 B13R2.371 NC1=CC=C(Br)C2=CC=CC=C12 BB56-0520 [0,1,0,0,0,0|3,0,0]=4 37 B13R2.371 NC1=CC=C(Br)C2=CC=CN=C12 BB05-1493 [0,1,0,0,0,0|2,0,0]=3 38 B13R2.371 NC1=CC=C(Br)C2=CC=CN=C12 BB54-0102 [0,1,0,0,0,0|2,0,0]=3 39 B13R2.371 OC1=CC=C(Br)C2=CC=CN=C12 BB12-5009 [0,1,0,0,0,0|2,0,0]=3 40 B13R2.371 OC1=NN=C(O)C2=NC=CN=C12 BB54-0816 [0,1,0,0,0,0|3,0,0]=4 41 B13R2.1613 ClCC1=CC=CC2=CC=CC=C21 BB20-3535 [0,1,0,0,0,0|2,0,0]=3 42 B13R2.1613 N#CC1=C2C=CC=NC2=CC=C1 BB56-0659 [0,1,0,0,0,0|1,0,1]=3 43 B13R2.1613 NCC1=C2C=CC=NC2=CC=C1 BB01-0070 [0,1,0,0,0,0|1,0,0]=2 44 B13R2.1613 NCC1=C2C=CN=CC2=CC=C1 BB01-0074 [0,1,0,0,0,0|3,0,0]=4 45 B13R2.1613 NCC1=C2N=CC=CC2=CC=C1 BB58-3621 [0,1,0,0,0,0|1,0,0]=2 46 B13R2.1613 NCC1=NC=CC2=CC=CC=C21 BB54-1493 [0,1,0,0,0,0|3,0,0]=4 47 B13R2.1613 NNC1=CC=CC2=C1C=CC=N2 BB54-1950 [0,1,0,0,0,0|2,0,0]=3 48 B13R2.1613 NNC1=CC=CC2=CC=CN=C21 BB54-3745 [0,1,0,0,0,0|2,0,0]=3 49 B13R2.1613 O=CC1=C2N=CC=NC2=CC=C1 BB55-6967 [0,1,0,0,0,0|0,0,1]=2 50 B13R2.1613 O=CC1=CC=CC2=C1C=CC=N2 BB05-4690 [0,1,0,0,0,0|1,0,1]=3 51 B13R2.1613 O=CC1=CC=CC2=C1N=CC=C2 BB01-7757 [0,1,0,0,0,0|1,0,1]=3 52 B13R2.1613 OCC1=C2C=CC=NC2=CC=C1 BB55-7550 [0,1,0,0,0,0|1,0,0]=2 53 B13R2.1613 OCC1=C2N=CC=CC2=CC=C1 BB55-7549 [0,1,0,0,0,0|1,0,0]=2 54 B13R2.5179 CC1=CC=C2C(N)=CC=CC2=N1 BB17-0572 [0,1,0,0,0,0|2,0,0]=3 55 B13R2.5179 NC1=C2N=CC(I)=CC2=CC=C1 BB32-2886 [0,1,0,0,0,0|2,0,0]=3 56 B11R1.13 CC1=CC=CC(N=C=S)=C1C BB53-1307 [0,0,1,0,0,0|2,0,1]=4 57 B11R1.222 N\C(=C/O)C1=NC=CN=C1Cl BB58-0183 [0,0,1,0,0,0|3,0,0]=4 58 B11R2.1 NC1=NOC2=C1N=CC=N2 BB58-0182 [0,0,0,0,1,0|3,0,0]=4 59 B11R2.106 BrC1=C2OC=NC2=NC=C1 BB26-0146 [0,0,0,0,1,0|3,0,0]=4 60 B11R2.106 BrC1=C2OC=NC2=NC=C1 BB58-1429 [0,0,0,0,1,0|3,0,0]=4 61 B11R2.106 BrC1=CC=CC2=NN=NN12 BB57-4133 [0,0,0,0,1,0|3,0,0]=4 62 B11R2.106 CC1=C2N=NNC2=CC=C1 BB12-3009 [0,0,0,0,1,0|1,0,1]=3 63 B11R2.106 ClC1=C2SC=CC2=NC=C1 BB57-3978 [0,0,0,0,1,0|3,0,0]=4 64 B11R2.106 ClC1=NC=CC2=C1C=CS2 BB01-2455 [0,0,0,0,1,0|3,0,0]=4 65 B11R2.106 ClC1=NC=CC2=C1OC=C2 BB90-0078 [0,0,0,0,1,0|3,0,0]=4 66 B11R2.106 ClC1=NC=CN2C=CN=C12 BB58-0075 [0,0,0,0,1,0|3,0,0]=4 67 B11R2.106 NC1=C2NC=NC2=CC=C1 BB12-1727 [0,0,0,0,1,0|1,0,1]=3 68 B11R2.106 NC1=C2NN=CC2=CC=C1 BB12-1725 [0,0,0,0,1,0|2,0,1]=4 69 B11R2.106 NC1=CC=CC2=C1N=NN2 BB54-1745 [0,0,0,0,1,0|2,0,1]=4 70 B11R2.106 NC1=CC=CN2C=NN=C12 BB57-5870 [0,0,0,0,1,0|3,0,0]=4 71 B11R2.106 NC1=CC=CN2N=NN=C12 BB55-6228 [0,0,0,0,1,0|3,0,0]=4 72 B11R2.106 O=C1C=CNC2=C1C=CS2 BB32-3299 [0,0,0,0,1,0|3,0,0]=4 73 B11R2.106 O=C1NC=CC2=C1C=CO2 BB01-2448 [0,0,0,0,1,0|3,0,0]=4 74 B11R2.106 O=C1NC=CC2=C1NC=C2 BB58-5431 [0,0,0,0,1,0|2,0,1]=4 75 B11R2.106 OC1=CC=CC2=NSN=C12 BB54-2826 [0,0,0,0,1,0|2,0,0]=3 76 B11R2.106 OC1=CC=CN2C=CN=C12 BB58-0363 [0,0,0,0,1,0|2,0,0]=3 77 B10R1.4 CC1=C(N=C=S)C=CC=C1 BB01-8014 [1,0,1,0,0,0|1,0,1]=4 78 B10R1.10 CC1=CC(\C=N\O)=CC=C1 BB20-3238 [1,0,1,0,0,0|2,0,0]=4 79 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 BB56-1289 [0,1,1,0,0,0|2,0,0]=4 80 B12R2.24 BrC1=CC2=C(C=C1)N=CC=C2 BB54-0061 [1,1,0,0,0,0|1,0,0]=3 81 B12R2.24 BrC1=NC2=NC=CC=C2C=C1 BB32-2954 [1,1,0,0,0,0|2,0,0]=4 82 B12R2.24 BrC1=NC2=NC=CN=C2N=C1 BB58-0748 [1,1,0,0,0,0|2,0,0]=4 83 B12R2.24 FC1=CC2=CC=CC=C2C=C1 BB53-1916 [1,1,0,0,0,0|2,0,0]=4 84 B12R2.24 NC1=CC=C2C=CC=NC2=C1 BB58-0390 [1,1,0,0,0,0|1,0,0]=3 85 B12R2.24 NC1=CC=C2N=CC=CC2=C1 BB12-2220 [1,1,0,0,0,0|1,0,0]=3 86 B12R2.24 NC1=CC=C2N=CC=NC2=C1 BB12-2798 [1,1,0,0,0,0|0,0,0]=2 87 B12R2.24 O=C1C=NC2=CC=CC=C2N1 BB57-5371 [1,1,0,0,0,0|0,0,1]=3 88 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 BB57-3400 [1,1,0,0,0,0|1,0,0]=3 89 B12R2.2028 O=C1OC(=O)C2=NC=CN=C12 BB54-1412 [0,1,0,0,1,0|2,0,0]=4 90 B12R2.82 CC1=C(N)C2=C(C=C1)NC=N2 BB54-2641 [0,1,0,0,1,0|1,0,1]=4 91 B12R2.82 CC1=CC=C2NC=NC2=C1C BB58-1924 [0,1,0,0,1,0|0,0,1]=3 92 B12R2.82 CC1=CC=C2NN=NC2=C1C BB12-3007 [0,1,0,0,1,0|1,0,1]=4 93 B12R2.202 CC1=C2N=C(S)OC2=CC=C1 BB12-1589 [0,1,0,0,1,0|1,0,0]=3 94 B12R2.202 CC1=C2NC(=O)CC2=CC=C1 BB12-1576 [0,1,0,0,1,0|0,0,2]=4 95 B12R2.202 CC1=C2OC(N)=NC2=CC=C1 BB17-0771 [0,1,0,0,1,0|1,0,0]=3 96 B12R2.202 CC1=CC2=CC=CC(N)=C2O1 BB12-1928 [0,1,0,0,1,0|2,0,0]=4 97 B12R2.202 CC1=CC=NC2=NC(N)=NN12 BB12-1705 [0,1,0,0,1,0|2,0,0]=4 98 B12R2.202 CC1=NC2=C(Br)C=CC=C2S1 BB31-8257 [0,1,0,0,1,0|2,0,0]=4 99 B12R2.202 CC1=NC2=C(C=CC=C2N)N1 BB54-1298 [0,1,0,0,1,0|1,0,1]=4 100 B12R2.202 CC1=NN2C=CC=C(N)C2=N1 BB54-5227 [0,1,0,0,1,0|2,0,0]=4 101 B12R2.202 NC1=NC2=CC=CC(Cl)=C2O1 BB54-5163 [0,1,0,0,1,0|2,0,0]=4 102 B12R2.202 NC1=NC2=CC=CC(Cl)=C2S1 BB54-3777 [0,1,0,0,1,0|2,0,0]=4 103 B12R2.202 SC1=NC2=C(O1)C(Cl)=CC=C2 BB12-1564 [0,1,0,0,1,0|2,0,0]=4 104 B12R2.221 ClC1=C2N=CNC2=C(Cl)C=C1 BB17-0906 [0,1,0,0,1,0|1,0,1]=4 105 B12R2.246 CC1=C2NN=CC2=CC(Br)=C1 BB54-1647 [0,1,0,0,1,0|1,0,1]=4 106 B12R2.246 CC1=C2NN=CC2=CC(N)=C1 BB54-1616 [0,1,0,0,1,0|1,0,1]=4 107 B12R2.246 CC1=CC(Br)=CN2C=CN=C12 BB57-4092 [0,1,0,0,1,0|1,0,0]=3 108 B12R2.246 CC1=CC(C)=NC2=NC=NN12 BB05-2328 [0,1,0,0,1,0|2,0,0]=4 109 B12R2.315 COC1=CC=CC2=C1C=CN2 BB01-7869 [0,1,0,0,1,0|0,0,1]=3 110 B12R2.315 N#CC1=CC=CN2C=CN=C12 BB12-1244 [0,1,0,0,1,0|1,0,1]=4 111 B12R2.315 NCC1=C2C=CNC2=CC=C1 BB12-1479 [0,1,0,0,1,0|0,0,1]=3 112 B12R2.315 O=CC1=CC=CC2=NON=C12 BB55-6806 [0,1,0,0,1,0|1,0,1]=4 113 B12R2.315 OCC1=CC=CC2=C1C=CN2 BB54-3799 [0,1,0,0,1,0|0,0,1]=3 114 B14R2.203 N#CC1=C(N)C=CC2=NC=CC=C21 BB57-6222 [0,2,0,0,0,0|1,0,1]=4 115 B14R2.7724 CC1=CC(C)=C(O)C2=C1C=CC=N2 BB57-3396 [0,2,0,0,0,0|1,0,0]=3 116 B14R2.7724 NC1=CC(Cl)=C2C=CC=NC2=C1O BB54-1171 [0,2,0,0,0,0|2,0,0]=4 117 B14R2.29369 CC1=CC=C2C(=N1)C=CC(C)=C2N BB12-4579 [0,2,0,0,0,0|2,0,0]=4 118 B14R2.8045 CC1=CC(Cl)=NC2=C(C)C=CC=C12 BB57-6990 [0,2,0,0,0,0|1,0,0]=3 119 B14R2.8045 CC1=CC=CC2=C1N=C(C)C=C2Cl BB54-3276 [0,2,0,0,0,0|1,0,0]=3 120 B14R2.8045 CC1=CC=CC2=C1N=C(C)C=C2O BB54-3148 [0,2,0,0,0,0|1,0,0]=3 121 B14R2.8045 CC1=NC2=C(Cl)C=CC=C2C(Cl)=C1 BB54-4565 [0,2,0,0,0,0|2,0,0]=4 122 B14R2.8045 CC1=NC2=C(Cl)C=CC=C2C(N)=C1 BB54-3688 [0,2,0,0,0,0|2,0,0]=4 123 B14R2.8045 CC1=NC2=C(F)C=CC=C2C(N)=C1 BB54-4466 [0,2,0,0,0,0|2,0,0]=4 124 B14R2.8045 CC1=NC2=C(F)C=CC=C2C(O)=C1 BB54-4640 [0,2,0,0,0,0|2,0,0]=4 125 B14R2.8045 NC1=CC=NC2=C(Cl)C=C(Cl)C=C12 BB54-3780 [0,2,0,0,0,0|2,0,0]=4 126 B14R2.8045 NC1=CC=NC2=C(F)C=C(F)C=C12 BB54-5237 [0,2,0,0,0,0|2,0,0]=4 127 B14R2.8045 OC1=C2C=C(F)C=C(F)C2=NC=C1 BB31-7603 [0,2,0,0,0,0|2,0,0]=4 128 B14R2.8751 CC1=CC=C(O)C2=C1C=CC(C)=N2 BB57-3395 [0,2,0,0,0,0|1,0,0]=3 129 B14R2.11684 COC1=CC=CC2=C1N=C(Cl)C=C2 BB57-3405 [0,2,0,0,0,0|1,0,0]=3 130 B14R2.11684 COC1=CC=CC2=C1NC(=O)C=C2 BB58-1215 [0,2,0,0,0,0|1,0,1]=4 131 B14R2.11684 COC1=CC=CC2=CC=C(C)N=C21 BB58-1193 [0,2,0,0,0,0|1,0,0]=3 132 B14R2.1019 COC1=CC2=C(N=CC=C2)C(N)=C1 BB54-2920 [0,2,0,0,0,0|2,0,0]=4 133 B14R2.29365 CC1=CC(=O)NC2=C1C=CC(N)=N2 BB54-1806 [0,2,0,0,0,0|2,0,0]=4 134 B14R2.29365 CC1=CC(C)=C2C=CC(O)=NC2=N1 BB57-6305 [0,2,0,0,0,0|2,0,0]=4 135 B14R2.1078 COC1=C2N=CC=C(N)C2=CC=C1 BB54-3975 [0,2,0,0,0,0|1,0,0]=3 136 B14R2.1078 COC1=C2NC=CC(=O)C2=CC=C1 BB54-4836 [0,2,0,0,0,0|1,0,1]=4 137 B14R2.1131 CC1=C2N=CC=CC2=C(C=O)C=C1 BB55-7670 [0,2,0,0,0,0|1,0,0]=3 138 B14R2.1131 CC1=C2N=CC=CC2=C(CN)C=C1 BB57-7199 [0,2,0,0,0,0|1,0,0]=3 139 B14R2.1131 CC1=C2N=CC=CC2=C(CO)C=C1 BB55-7669 [0,2,0,0,0,0|1,0,0]=3 140 B14R2.1131 COC1=C2N=CC=CC2=C(Br)C=C1 BB56-0628 [0,2,0,0,0,0|1,0,0]=3 141 B14R2.1131 FC1=CC=C(CCl)C2=CC=CC=C12 BB57-6000 [0,2,0,0,0,0|2,0,0]=4 142 B14R2.1131 NNC1=C2C=CC=NC2=C(O)C=C1 BB17-1005 [0,2,0,0,0,0|2,0,0]=4 143 B14R2.1131 O=NC1=C2C=CC=NC2=C(O)C=C1 BB57-4964 [0,2,0,0,0,0|2,0,0]=4 144 B14R2.1131 OC1=C2N=CC=CC2=C(CCl)C=C1 BB55-4815 [0,2,0,0,0,0|1,0,0]=3 145 B14R2.1131 OCC1=C2C=CC=NC2=C(O)C=C1 BB55-5135 [0,2,0,0,0,0|1,0,0]=3 146 B14R2.7150 CNCC1=C2C=CC=NC2=CC=C1 BB55-6173 [0,2,0,0,0,0|1,0,0]=3 147 B14R2.7150 CNCC1=C2C=CC=NC2=CC=C1 BB56-1131 [0,2,0,0,0,0|1,0,0]=3 148 B14R2.7150 CNCC1=C2N=CC=CC2=CC=C1 BB55-6179 [0,2,0,0,0,0|1,0,0]=3 149 B14R2.7150 NCCC1=CC=CC2=CC=CC=C21 BB54-4444 [0,2,0,0,0,0|2,0,0]=4 150 B14R2.31359 O=C(O)C1=C2N=CC=NC2=CC=C1 BB01-6642 [0,2,0,0,0,0|0,0,1]=3 151 B14R2.31359 O=[N+]([O-])C1=CC=CC2=CC=CN=C21 BB12-5020 [0,2,0,0,0,0|2,0,0]=4 152 B14R2.31359 O=[N+]([O-])C1=CC=CC2=NC=CC=C12 BB12-5019 [0,2,0,0,0,0|2,0,0]=4 153 B14R2.31359 OB(O)C1=C2N=CC=CC2=CC=C1 BB55-6177 [0,2,0,0,0,0|2,0,0]=4 154 B14R2.1801 N#CC1=CC=C2C(O)=CC=CC2=N1 BB32-3566 [0,2,0,0,0,0|2,0,0]=4 155 B12R2.2 C1=CC(C2=CN=CC=N2)=NN1 BB55-6972 [0,0,1,1,0,0|2,0,0]=4 156 B12R2.2 C1=CN(C2=CN=CC=N2)C=C1 BB56-0796 [0,0,1,1,0,0|1,0,1]=4 157 B12R2.32 C=CC1=NC2=CC=CC=C2N1 BB12-1680 [0,0,1,1,0,0|2,0,0]=4 158 B12R2.32 O=CC1=NC2=CC=CC=C2N1 BB55-6325 [0,0,1,1,0,0|2,0,0]=4 159 B10R2.7 C1=CC2=C(C=C1)NN=N2 BB01-6327 [1,0,0,0,1,0|1,0,1]=4 160 B10R2.7 C1=CC2=C(N=C1)NC=C2 BB12-3415 [1,0,0,0,1,0|1,0,1]=4 161 B10R2.7 C1=CC2=NC=CN2C=C1 BB56-1794 [1,0,0,0,1,0|1,0,0]=3 162 B10R2.7 C1=CC2=NN=CN2C=C1 BB26-0431 [1,0,0,0,1,0|2,0,0]=4 163 B10R2.7 C1=CC=C2NC=NC2=C1 BB01-7424 [1,0,0,0,1,0|0,0,1]=3 164 B10R2.7 C1=CN2C=CN=C2N=C1 BB58-1095 [1,0,0,0,1,0|2,0,0]=4 165 B10R2.7 C1=CN2N=CN=C2N=C1 BB12-2234 [1,0,0,0,1,0|2,0,0]=4