0 B13R2.369 CC1=C(C)N=C2C=CC=CC2=C1 8854AA [0,0,0,0,0,0|3,0,1]=4 1 B13R2.369 CC1=CC2=C(C=CC=N2)C=C1Cl 3699AC [0,0,0,0,0,0|3,0,0]=3 2 B13R2.369 CC1=CC2=C(C=CN=C2)C=C1O 0240AC [0,0,0,0,0,0|4,0,0]=4 3 B13R2.369 CC1=CC2=CC=CC=C2N=C1N 2809AA [0,0,0,0,0,0|3,0,1]=4 4 B13R2.369 CC1=CC2=CC=CC=C2NC1=O 2544AB [0,0,0,0,0,0|2,0,0]=2 5 B13R2.369 CC1SC2=CC=CC=C2NC1=O 8425AE [0,0,0,0,0,0|3,0,1]=4 6 B13R2.369 NC1=CC2=C(C=CC=N2)C=C1Cl 1377AB [0,0,0,0,0,0|3,0,0]=3 7 B13R2.369 NC1=NC2=C(C=CC=C2)C=C1Cl 6755AB [0,0,0,0,0,0|3,0,1]=4 8 B13R2.369 NC1=NC2=CC=CC=C2NC1=O 2364AL [0,0,0,0,0,0|3,0,0]=3 9 B13R2.369 NC1CC2=NC=CC=C2NC1=O 8946AB [0,0,0,0,0,0|1,0,2]=3 10 B13R2.369 O=C1NC2=CC=CC=C2C=C1Cl 6012AC [0,0,0,0,0,0|2,0,0]=2 11 B12R2.24 BrC1=CC2=NN=CC=C2C=C1 6593AA [1,0,0,0,0,0|3,0,0]=4 12 B12R2.24 ClC1=CC2=C(C=C1)C=NC=N2 1742AC [1,0,0,0,0,0|3,0,0]=4 13 B12R2.24 ClC1=CC2=C(C=C1)N=NC=C2 8996AA [1,0,0,0,0,0|3,0,0]=4 14 B12R2.24 ClC1=CC2=C(N=CC=N2)N=C1 9717AC [1,0,0,0,0,0|2,0,1]=4 15 B12R2.24 ClC1=CC2=CN=CN=C2C=C1 0851AC [1,0,0,0,0,0|3,0,0]=4 16 B12R2.24 ClC1=NC2=NC=CC=C2N=C1 Z4211 [1,0,0,0,0,0|2,0,1]=4 17 B12R2.24 FC1=CC2=C(C=C1)N=NC=C2 3489AB [1,0,0,0,0,0|3,0,0]=4 18 B12R2.24 FC1=CC2=NC=CC=C2C=C1 5205AB [1,0,0,0,0,0|2,0,0]=3 19 B12R2.24 FC1=CN=C2C=CC=CC2=C1 5204AB [1,0,0,0,0,0|2,0,1]=4 20 B12R2.24 IC1=CC=C2C=CC=CC2=N1 0061AC [1,0,0,0,0,0|2,0,1]=4 21 B12R2.24 NC1=CC=C2N=NC=CC2=C1 1890AC [1,0,0,0,0,0|3,0,0]=4 22 B12R2.24 O=C1CNC2=C(C=CC=N2)N1 9842AH [1,0,0,0,0,0|1,0,1]=3 23 B12R2.24 OC1=CC2=CN=CC=C2C=C1 Y7545 [1,0,0,0,0,0|3,0,0]=4 24 B12R2.24 SC1=CC2=CC=CC=C2N=C1 Y4019 [1,0,0,0,0,0|1,1,1]=4 25 B14R2.1128 CCC1=NC2=C(C=CC=C2)NC1=O 6031AA [0,1,0,0,0,0|3,0,0]=4 26 B14R2.1128 COC1=C(O)C=C2C=CC=CC2=C1 V5678 [0,1,0,0,0,0|2,0,1]=4 27 B14R2.1128 NCC1=C(O)C=C2C=CC=CC2=C1 5677AJ [0,1,0,0,0,0|3,0,0]=4 28 B14R2.1128 O=C1OC2=C(C=CC=C2)N\C1=N\O 5043AC [0,1,0,0,0,0|3,0,0]=4 29 B14R2.1128 O=C1SC2=C(C=CC=C2)N\C1=N\O 5044AC [0,1,0,0,0,0|3,0,0]=4 30 B14R2.1128 O=CC1=C(Cl)C=C2N=CC=CC2=C1 5458AC [0,1,0,0,0,0|2,0,0]=3 31 B14R2.1128 O=CC1=C(F)C=C2N=CC=CC2=C1 X5100 [0,1,0,0,0,0|2,0,0]=3 32 B14R2.8188 CC1=C(O)C(=O)C2=CC=CC=C2N1 4162AB [0,1,0,0,0,0|2,0,0]=3 33 B14R2.8239 NC1=NC2=C(C=CC(Br)=C2)NC1=O 1680AA [0,1,0,0,0,0|3,0,0]=4 34 B14R2.8239 O=C1NC2=CC=C(O)C=C2OC1O W2723 [0,1,0,0,0,0|2,0,1]=4 35 B14R2.28472 CC1=NC=CC2=C1C=C(Br)C(=O)N2 4503AD [0,1,0,0,0,0|3,0,0]=4 36 B14R2.28472 NC1=NC2=C(O)C=CC=C2NC1=O 0123AC [0,1,0,0,0,0|3,0,0]=4 37 B14R2.28472 O=C1NC2=C(NC1=O)C(O)=CC=C2 Y4363 [0,1,0,0,0,0|2,0,1]=4 38 B12R2.18 CC1=C(Br)C2=CC=CN=C2N1 3231AH [0,0,0,0,1,0|3,0,0]=4 39 B12R2.18 CN1CC2=C(C=CC=N2)C1=O 5331AB [0,0,0,0,1,0|2,0,1]=4 40 B12R2.18 NC1=C(Cl)SC2=C1N=CC=C2 2391AB [0,0,0,0,1,0|3,0,0]=4 41 B12R2.18 O=C1NC2=CN=CC=C2C1=O 9885AH [0,0,0,0,1,0|2,0,1]=4 42 B12R2.100 OC1=C(F)C=C2NC=CC2=C1 2875AB [0,0,0,0,1,0|3,0,0]=4 43 B11R1.86 NC1=CC=CN=C1CC(=O)O 2520AC [1,0,1,0,0,0|0,0,1]=3 44 B13R1.418 N#C\C(=C/C1=CC=CC=C1)C(N)=O Y9885 [0,1,1,0,0,0|2,0,0]=4 45 B13R2.32 CC1=CC=C2C=CC=NC2=C1O 8091AB [1,1,0,0,0,0|2,0,0]=4 46 B13R2.32 NC1=C(Cl)C2=C(C=CC=N2)N=C1 5735AC [1,1,0,0,0,0|1,0,1]=4 47 B13R2.32 NC1=C(N)C2=CC=CN=C2C=C1 3058AE [1,1,0,0,0,0|2,0,0]=4 48 B13R2.32 NC1=CN=C2C=CC=NC2=C1I 3316AD [1,1,0,0,0,0|1,0,1]=4 49 B13R2.32 NC1=CN=C2C=CC=NC2=C1O 2121AB [1,1,0,0,0,0|1,0,1]=4 50 B13R2.32 OC1=C2N=CC=CC2=CC=C1F 4287AB [1,1,0,0,0,0|2,0,0]=4 51 B13R2.32 OC1=CN=C2C=CC=NC2=C1I 3058AD [1,1,0,0,0,0|0,0,1]=3 52 B13R2.57 BrCC1=CC=C2N=CC=CC2=C1 0362AA [1,1,0,0,0,0|2,0,0]=4 53 B13R2.57 C#CC1=CC2=C(C=CC=N2)C=C1 0933AA [1,1,0,0,0,0|2,0,0]=4 54 B13R2.57 N#CC1=CN=C2C=CC=NC2=C1 9480AC [1,1,0,0,0,0|1,0,1]=4 55 B13R2.57 N#CC1=NC2=C(C=C1)N=CC=C2 2370AA [1,1,0,0,0,0|1,0,1]=4 56 B13R2.57 NCC1=CC2=NC=CC=C2C=C1 Y4064 [1,1,0,0,0,0|2,0,0]=4 57 B13R2.57 O=CC1=CC2=C(C=C1)N=NC=C2 5775AC [1,1,0,0,0,0|2,0,0]=4 58 B13R2.57 O=CC1=CC2=C(C=CC=N2)N=C1 4506AF [1,1,0,0,0,0|0,0,2]=4 59 B13R2.155 CC1=CN=C2OCC(=O)NC2=C1 0786AD [1,1,0,0,0,0|1,0,1]=4 60 B13R2.155 CC1=NC2=C(C=CC(N)=C2)C=C1 9854AB [1,1,0,0,0,0|2,0,0]=4 61 B13R2.155 NC1=CC2=CC(Cl)=CC=C2N=C1 1182AA [1,1,0,0,0,0|2,0,0]=4 62 B13R2.155 O=C1COC2=NC=C(I)C=C2N1 0899AD [1,1,0,0,0,0|1,0,1]=4 63 B13R2.155 O=C1N=CC2=CC=C(Br)C=C2N1 6402AC [1,1,0,0,0,0|2,0,0]=4 64 B13R2.155 OC1=NC2=C(C=C1)C=CC(Cl)=N2 8020AA [1,1,0,0,0,0|2,0,0]=4 65 B13R2.162 CC1=CC=NC2=C1C=C(Cl)C=C2 L852 [1,1,0,0,0,0|2,0,0]=4 66 B13R2.162 CC1=NC2=C(C=C1)N=CC=C2Cl 3778AJ [1,1,0,0,0,0|1,0,1]=4 67 B13R2.162 OC1=CC=C2N=CC=C(Br)C2=C1 3918AC [1,1,0,0,0,0|1,0,1]=4 68 B13R2.328 CC1=NC(=O)C2=C(C=CC=N2)N1 3760AB [1,1,0,0,0,0|2,0,0]=4 69 B13R2.328 NC1=CC2=C(N=CC=C2)C(Cl)=C1 6911AB [1,1,0,0,0,0|2,0,0]=4 70 B13R2.328 O=C1C=C(Br)C2=C(C=CC=C2)N1 6001AC [1,1,0,0,0,0|1,0,0]=3 71 B13R2.328 O=C1NC2=CC=CN=C2C(=O)O1 9882AH [1,1,0,0,0,0|1,0,0]=3 72 B13R2.328 OC1=CC(Br)=CC2=C1C=CC=N2 Z4051 [1,1,0,0,0,0|2,0,0]=4 73 B13R2.328 OC1=NC(O)=C2C=CC=NC2=C1 3495AA [1,1,0,0,0,0|2,0,0]=4 74 B13R2.3683 BrC1=CC=C2N=C(Br)C=CC2=C1 X3758 [1,1,0,0,0,0|2,0,0]=4 75 B13R2.3683 BrC1=CN=C2C=C(Br)C=NC2=C1 3222AH [1,1,0,0,0,0|1,0,1]=4 76 B13R2.3683 ClC1=NC2=C(C=C1)N=C(Cl)C=C2 2511AB [1,1,0,0,0,0|1,0,1]=4 77 B13R2.3683 NC1=CC2=CC=C(Cl)N=C2C=C1 Z4468 [1,1,0,0,0,0|2,0,0]=4 78 B13R2.3683 O=C1C=CC2=CC(Cl)=NC=C2N1 5866AC [1,1,0,0,0,0|2,0,0]=4 79 B13R2.3683 O=C1COC2=C(C=CC(Br)=N2)N1 4654AA [1,1,0,0,0,0|1,0,1]=4 80 B13R2.3683 O=C1COC2=NC(I)=CC=C2N1 0895AD [1,1,0,0,0,0|1,0,1]=4 81 B13R2.5179 BrC1=CC=C2C(I)=CC=NC2=C1 0855AC [1,1,0,0,0,0|2,0,0]=4 82 B13R2.5179 CC1=NC=CC2=C1C=CC(=O)N2 1572AF [1,1,0,0,0,0|2,0,0]=4 83 B13R2.5179 ClC1=CC2=NC=CC(Br)=C2C=C1 W9845 [1,1,0,0,0,0|2,0,0]=4 84 B13R2.5179 NC1=C2C=CC(I)=CC2=NC=C1 5558AH [1,1,0,0,0,0|2,0,0]=4 85 B13R2.5179 NC1=CC2=C(C=C1)C(Cl)=CC=N2 6223AB [1,1,0,0,0,0|2,0,0]=4 86 B13R2.5179 NC1=CC=C2C(O)=CC=NC2=C1 0660AA [1,1,0,0,0,0|2,0,0]=4 87 B13R2.5179 O=C1C=CC2=C(C=CN=C2Br)N1 3100AJ [1,1,0,0,0,0|2,0,0]=4 88 B13R2.5179 O=C1C=CC=C2NC(Cl)=CC=C12 4603AA [1,1,0,0,0,0|2,0,0]=4 89 B13R2.45 O=CC1=C(Cl)C2=CC=CC=C2N1 8761AC [0,1,0,0,1,0|2,0,0]=4 90 B13R2.45 O=CC1=C(I)C2=C(C=CC=C2)N1 5891AD [0,1,0,0,1,0|2,0,0]=4 91 B13R2.3085 O=C1C2=CC=CN=C2C(=O)N1O V3027 [0,1,0,0,1,0|1,0,0]=3 92 B13R2.5190 CN1C(=O)NC2=C1N=CC(I)=C2 3288AB [0,1,0,0,1,0|2,0,0]=4 93 B15R2.274 O=CC1=C(F)C2=CC=CN=C2C=C1F 3048AA [0,2,0,0,0,0|2,0,0]=4 94 B15R2.984 O=C1NC2=C(C=C1[N+](=O)[O-])N=CC=C2 9832AB [0,2,0,0,0,0|0,0,1]=3 95 B15R2.984 O=[N+]([O-])C1=CC2=C(N=CC=C2)N=C1O 7233AB [0,2,0,0,0,0|2,0,0]=4 96 B13R2.435 NC(=O)C1=CC2=CC=CC=C2O1 W6567 [0,0,1,1,0,0|1,0,0]=3 97 B13R2.435 NC(=O)C1=NN2C=CC=CC2=C1 4217AC [0,0,1,1,0,0|1,0,1]=4 98 B11R2.1 CC1=CNC2=CC=CN=C12 2332AJ [1,0,0,0,1,0|1,0,0]=3 99 B11R2.1 CC1=COC2=C1C=CC=N2 1819AA [1,0,0,0,1,0|2,0,0]=4 100 B11R2.1 ClC1=CNC2=NC=CC=C12 Y5559 [1,0,0,0,1,0|2,0,0]=4 101 B11R2.1 ClC1=CSC2=NC=CC=C12 7594AB [1,0,0,0,1,0|2,0,0]=4 102 B11R2.1 ClC1=NNC2=CC=CN=C21 Y5269 [1,0,0,0,1,0|2,0,0]=4 103 B11R2.1 IC1=CSC2=NC=CC=C12 7595AB [1,0,0,0,1,0|2,0,0]=4 104 B11R2.1 O=C1NNC2=CC=CN=C12 7206AB [1,0,0,0,1,0|1,0,1]=4 105 B11R2.10 BrC1=CC2=NC=CC=C2S1 6065AC [1,0,0,0,1,0|2,0,0]=4 106 B11R2.10 BrC1=NC2=C(C=CC=N2)N1 6646AA [1,0,0,0,1,0|2,0,0]=4 107 B11R2.10 ClC1=NC2=NC=CC=C2N1 Z2543 [1,0,0,0,1,0|2,0,0]=4 108 B11R2.10 NC1=CC2=C(C=CC=C2)N1 X2016 [1,0,0,0,1,0|2,0,0]=4 109 B11R2.10 O=C1C=C2C=CC=CN2N1 8937AB [1,0,0,0,1,0|2,0,0]=4 110 B11R2.10 O=C1NC2=C(N=CC=C2)O1 3093AA [1,0,0,0,1,0|1,0,0]=3 111 B11R2.10 O=C1NC2=C(N=CC=C2)S1 4991AC [1,0,0,0,1,0|1,0,0]=3 112 B11R2.10 OC1=NC2=NC=NC=C2N1 7288AB [1,0,0,0,1,0|2,0,0]=4 113 B11R2.36 O=C1C=CN2N=CC=C2N1 3801AL [1,0,0,0,1,0|1,0,0]=3 114 B11R2.36 OC1=CN=C2C=COC2=C1 9864AC [1,0,0,0,1,0|1,0,1]=4 115 B11R2.36 OC1=CN=C2NC=NC2=C1 0606AA [1,0,0,0,1,0|1,0,1]=4 116 B13R1.348 C\C(=C/C1=CC=CC=C1)CC(N)=O 5994AL [0,0,1,0,0,1|2,0,0]=4