0 B12R2.32 ClCC1=CN2C=CC=CC2=N1 08-1908 [0,0,0,0,0,0|3,0,1]=4 1 B12R2.32 O=CC1=CC2=C(C=CC=N2)N1 08-4512 [0,0,0,0,0,0|2,0,0]=2 2 B12R2.32 O=CC1=CC2=C(C=CC=N2)O1 08-9709 [0,0,0,0,0,0|1,0,0]=1 3 B12R2.32 O=CC1=CC2=C(C=CN=C2)N1 08-4513 [0,0,0,0,0,0|2,0,0]=2 4 B12R2.32 O=CC1=CC2=C(C=CN=C2)S1 08-4527 [0,0,0,0,0,0|1,1,0]=2 5 B12R2.32 O=CC1=CC2=C(C=NC=C2)N1 08-4511 [0,0,0,0,0,0|2,0,0]=2 6 B12R2.32 O=CC1=CC2=C(C=NC=C2)S1 08-2802 [0,0,0,0,0,0|1,1,0]=2 7 B12R2.32 O=CC1=CC2=C(N=CC=C2)N1 08-4510 [0,0,0,0,0,0|2,0,0]=2 8 B12R2.32 OCC1=CC2=C(C=NC=C2)N1 08-10421 [0,0,0,0,0,0|2,0,2]=4 9 B12R2.32 OCC1=CN2C=CC=CC2=N1 08-3989 [0,0,0,0,0,0|2,0,2]=4 10 B11R2.10 BrC1=CC2=C(C=NC=C2)S1 08-3485 [1,0,0,0,0,0|2,1,0]=4 11 B11R2.10 CC1=CC2=CC=CN=C2N1 08-5436 [1,0,0,0,0,0|2,0,1]=4 12 B11R2.10 CC1=NC2=C(C=CC=C2)O1 CS-733 [1,0,0,0,0,0|1,0,1]=3 13 B11R2.10 ClC1=NN2C=CC=CC2=C1 08-3537 [1,0,0,0,0,0|3,0,0]=4 14 B11R2.10 FC1=NC2=C(C=CC=C2)S1 09-1147 [1,0,0,0,0,0|2,1,0]=4 15 B11R2.10 IC1=CC2=C(N=CC=C2)N1 08-7512 [1,0,0,0,0,0|3,0,0]=4 16 B11R2.10 O=C1CC2=C(C=CC=C2)N1 01-1256 [1,0,0,0,0,0|1,0,1]=3 17 B11R2.10 O=C1CC2=C(C=CC=N2)N1 08-3313 [1,0,0,0,0,0|2,0,1]=4 18 B11R2.10 O=C1CC2=C(C=CC=N2)N1 08-5099 [1,0,0,0,0,0|2,0,1]=4 19 B11R2.10 O=C1CC2=C(C=CN=C2)N1 08-5086 [1,0,0,0,0,0|2,0,1]=4 20 B11R2.10 O=C1CC2=C(C=NC=C2)N1 08-5100 [1,0,0,0,0,0|2,0,1]=4 21 B11R2.10 O=C1CC2=C(N=CC=C2)N1 08-5085 [1,0,0,0,0,0|2,0,1]=4 22 B13R2.43 O=CC1=CC2=C(C=C(Br)C=C2)N1 08-2940 [0,1,0,0,0,0|1,0,0]=2 23 B13R2.43 O=CC1=CN2C=CC(Br)=CC2=N1 08-6767 [0,1,0,0,0,0|2,0,0]=3 24 B13R2.54 O=CC1=CN2C(Br)=CC=CC2=N1 08-6689 [0,1,0,0,0,0|2,0,0]=3 25 B13R2.435 O=C(O)C1=CC2=C(C=CC=N2)N1 08-4516 [0,1,0,0,0,0|2,0,0]=3 26 B13R2.435 O=C(O)C1=CC2=C(C=CC=N2)O1 08-9710 [0,1,0,0,0,0|1,0,0]=2 27 B13R2.435 O=C(O)C1=CC2=C(C=CC=N2)S1 08-5656 [0,1,0,0,0,0|1,1,0]=3 28 B13R2.435 O=C(O)C1=CC2=C(C=CN=C2)S1 08-9834 [0,1,0,0,0,0|1,1,0]=3 29 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)S1 08-9833 [0,1,0,0,0,0|1,1,0]=3 30 B13R2.435 O=C(O)C1=CC2=C(N=CC=C2)N1 08-4514 [0,1,0,0,0,0|2,0,0]=3 31 B13R2.435 O=C(O)C1=CC2=C(N=CN=C2)N1 08-7925 [0,1,0,0,0,0|3,0,0]=4 32 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 08-4383 [0,1,0,0,0,0|2,0,0]=3 33 B13R2.435 O=C(O)C1=CN2N=CC=CC2=N1 08-3672 [0,1,0,0,0,0|3,0,0]=4 34 B13R2.435 OB(O)C1=CC2=C(C=CC=C2)O1 08-019 [0,1,0,0,0,0|1,0,1]=3 35 B13R2.57 C=CC1=CC2=CC=CC=C2C=C1 CS-970 [0,0,0,0,0,1|2,0,0]=3 36 B13R2.57 COC1=CC2=CC=CC=C2C=C1 CS-674 [0,0,0,0,0,1|3,0,0]=4 37 B13R2.57 N#CC1=CC2=CC=CC=C2N=C1 08-10141 [0,0,0,0,0,1|2,0,1]=4 38 B13R2.57 O=CC1=CC2=CC=CC=C2C=N1 08-3644 [0,0,0,0,0,1|1,0,0]=2 39 B13R2.57 O=CC1=CC2=CC=CN=C2C=C1 08-2514 [0,0,0,0,0,1|2,0,0]=3 40 B13R2.57 O=CC1=CC2=CC=NC=C2C=C1 08-3646 [0,0,0,0,0,1|2,0,0]=3 41 B13R2.57 O=CC1=CC2=CN=CC=C2C=C1 08-3647 [0,0,0,0,0,1|2,0,0]=3 42 B13R2.57 O=CC1=CC2=NC=CC=C2C=C1 08-3314 [0,0,0,0,0,1|2,0,0]=3 43 B13R2.57 O=CC1=CC2=NC=CN=C2C=C1 08-2523 [0,0,0,0,0,1|3,0,0]=4 44 B10R1.17 O=C\C=C\C1=CC=CC=C1 026023 [1,0,1,0,0,0|0,0,0]=2 45 B10R1.17 O=C\C=C\C1=CC=CC=C1 06-398 [1,0,1,0,0,0|0,0,0]=2 46 B10R1.17 OC\C=C\C1=CC=CC=C1 026025 [1,0,1,0,0,0|0,0,2]=4 47 B10R2.7 C1=CC2=C(C=C1)NC=C2 020650 [2,0,0,0,0,0|1,0,0]=3 48 B10R2.7 C1=CC2=C(C=C1)[S+]=CS2 26-100 [2,0,0,0,0,0|1,1,0]=4 49 B10R2.7 C1=CC2=C(C=CN2)C=N1 08-1536 [2,0,0,0,0,0|2,0,0]=4 50 B10R2.7 C1=CC2=C(C=CO2)C=N1 08-8428 [2,0,0,0,0,0|1,0,0]=3 51 B10R2.7 C1=CC2=C(C=CS2)C=N1 08-3819 [2,0,0,0,0,0|1,1,0]=4 52 B10R2.7 C1=CC2=C(C=N1)NC=C2 08-1537 [2,0,0,0,0,0|2,0,0]=4 53 B10R2.7 C1=CC2=C(C=N1)OC=C2 08-2223 [2,0,0,0,0,0|1,0,0]=3 54 B10R2.7 C1=CC2=C(C=N1)SC=C2 08-2556 [2,0,0,0,0,0|1,1,0]=4 55 B10R2.7 C1=CC2=NC=CN2C=C1 08-3994 [2,0,0,0,0,0|2,0,0]=4 56 B10R2.7 C1=CN=C2C=CNC2=C1 08-1535 [2,0,0,0,0,0|2,0,0]=4 57 B10R2.7 C1=CN=C2NC=CC2=C1 08-6221 [2,0,0,0,0,0|2,0,0]=4 58 B10R2.7 C1=CN=C2OC=CC2=C1 08-8427 [2,0,0,0,0,0|1,0,0]=3 59 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 08-6934 [0,1,1,0,0,0|1,0,0]=3 60 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 CS-187 [0,1,1,0,0,0|1,0,0]=3 61 B12R1.125 O=C(O)\C=C\C1=C(F)C=CC=C1 09-3497 [0,1,1,0,0,0|1,0,0]=3 62 B12R1.125 O=C(O)\C=C\C1=C(O)C=CC=C1 026029 [0,1,1,0,0,0|0,0,0]=2 63 B12R1.125 O=[N+]([O-])\C=C\C1=C(F)C=CC=C1 09-1280 [0,1,1,0,0,0|2,0,0]=4 64 B12R1.43 C\C(=C/C1=CC=CC=C1)C(=O)O 19-825 [0,1,1,0,0,0|1,0,0]=3 65 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 BIO-683 [0,1,1,0,0,0|0,0,2]=4 66 B12R2.606 CC1=CC2=C(C=CC(Br)=C2)N1 BIO-580 [1,1,0,0,0,0|1,0,1]=4 67 B12R2.606 CC1=CC2=C(C=CC(O)=C2)N1 BIO-617 [1,1,0,0,0,0|1,0,1]=4 68 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 19-828 [1,1,0,0,0,0|1,0,1]=4 69 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 08-4912 [1,1,0,0,0,0|1,0,1]=4 70 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)N1 08-4179 [1,1,0,0,0,0|2,0,0]=4 71 B14R2.92 N#CC1=COC2=C(C=CC=C2)C1=O 17-079 [0,1,0,0,0,1|1,0,1]=4 72 B14R2.92 O=CC1=COC2=C(C=CC=C2)C1=O 17-128 [0,1,0,0,0,1|0,0,0]=2 73 B14R2.134 O=CC1=CC=C2C=NC(Cl)=CC2=C1 08-10065 [0,1,0,0,0,1|2,0,0]=4 74 B14R2.142 O=CC1=CC=C2C=CN=C(Cl)C2=C1 08-8279 [0,1,0,0,0,1|2,0,0]=4 75 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 08-3235 [0,1,0,0,0,1|1,0,0]=3 76 B14R2.781 O=C(O)C1=CC2=CC=NC=C2C=C1 08-10027 [0,1,0,0,0,1|2,0,0]=4 77 B14R2.781 O=C(O)C1=CC2=CC=NC=C2C=N1 08-7778 [0,1,0,0,0,1|2,0,0]=4 78 B14R2.781 O=C(O)C1=CC2=CN=CC=C2C=C1 08-3688 [0,1,0,0,0,1|2,0,0]=4 79 B14R2.781 O=C(O)C1=NC2=CC=CC=C2N=C1 08-4523 [0,1,0,0,0,1|1,0,0]=3 80 B14R2.781 O=C(O)C1=NC2=CC=CN=C2N=C1 08-3807 [0,1,0,0,0,1|2,0,0]=4 81 B14R2.1128 N#CC1=CC2=C(C=CC=C2)OC1=O 17-080 [0,1,0,0,0,1|1,0,1]=4 82 B14R2.1801 O=CC1=CC=C2C(=C1)C=CN=C2Cl 08-8278 [0,1,0,0,0,1|2,0,0]=4 83 B14R2.2332 O=CC1=CC2=C(C=C1)OC(=O)C=C2 28-001 [0,1,0,0,0,1|2,0,0]=4 84 B14R2.972 COC(=O)C1=CC2=C(N=CC=C2)N1 08-2359 [0,2,0,0,0,0|2,0,0]=4 85 B14R2.972 COC(=O)C1=NN2C=CC=CC2=C1 08-2501 [0,2,0,0,0,0|2,0,0]=4 86 B14R2.4529 CC(=O)C1=CC2=C(C=CC(Br)=C2)O1 19-681 [0,2,0,0,0,0|0,0,0]=2 87 B14R2.4529 CC1=CC2=C(C=C1)C=C(C(=O)O)S2 08-10402 [0,2,0,0,0,0|0,1,0]=3 88 B14R2.4529 O=C(O)C1=CC2=C(C=C(F)C=C2)N1 08-2189 [0,2,0,0,0,0|1,0,0]=3 89 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)N1 08-1688 [0,2,0,0,0,0|1,0,0]=3 90 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=N2)N1 08-3925 [0,2,0,0,0,0|2,0,0]=4 91 B14R2.4529 O=C(O)C1=CC2=C(C=CC(F)=C2)N1 26-937 [0,2,0,0,0,0|1,0,0]=3 92 B14R2.4529 O=C(O)C1=CC2=C(N=C(Cl)C=C2)N1 08-3080 [0,2,0,0,0,0|2,0,0]=4 93 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CN=C2N1 08-6454 [0,2,0,0,0,0|2,0,0]=4 94 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=CN=C2N1 08-3078 [0,2,0,0,0,0|2,0,0]=4 95 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=NC=C2N1 19-2551 [0,2,0,0,0,0|2,0,0]=4 96 B14R2.4529 O=C(O)C1=CC2=NC=C(Br)C=C2N1 08-6782 [0,2,0,0,0,0|2,0,0]=4 97 B14R2.4529 O=C(O)C1=CC2=NC=C(Cl)C=C2N1 08-7035 [0,2,0,0,0,0|2,0,0]=4 98 B14R2.4529 O=C(O)C1=CN2C=C(Br)C=CC2=N1 08-6684 [0,2,0,0,0,0|2,0,0]=4 99 B14R2.4529 O=C(O)C1=NC2=C(C=CC(Br)=C2)N1 08-1695 [0,2,0,0,0,0|2,0,0]=4 100 B14R2.4529 O=C(O)C1=NN2C=C(Cl)C=CC2=C1 08-3064 [0,2,0,0,0,0|2,0,0]=4 101 B14R2.7969 O=C(O)C1=CC2=C(Br)C=CC=C2S1 08-9842 [0,2,0,0,0,0|0,1,0]=3 102 B14R2.7969 O=C(O)C1=CN2C(Br)=CC=CC2=N1 08-6690 [0,2,0,0,0,0|2,0,0]=4 103 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 08-1791 [0,0,1,1,0,0|2,0,0]=4 104 B12R2.24 FC1=CC2=CC=CC=C2C=C1 26-1742 [0,0,1,1,0,0|2,0,0]=4 105 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 020507S [0,0,1,1,0,0|0,0,0]=2 106 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 C-106 [0,0,1,1,0,0|0,0,0]=2 107 B12R2.24 O=C1C=CC2=CC=CNC2=N1 08-5526 [0,0,1,1,0,0|2,0,0]=4 108 B12R2.24 O=C1CCC2=C(C=CC=C2)O1 D-107 [0,0,1,1,0,0|0,0,2]=4 109 B12R2.24 O=C1COC2=C(C=CC=C2)N1 17-017 [0,0,1,1,0,0|1,0,1]=4 110 B12R2.24 OC1=CC2=CC=CC=C2C=C1 025445S [0,0,1,1,0,0|1,0,1]=4 111 B12R2.1081 BrC1=CC=CC2=NC=CC=C12 08-9978 [0,0,1,1,0,0|2,0,0]=4 112 B12R2.1081 FC1=CC=CC2=CC=CC=C12 21-127 [0,0,1,1,0,0|2,0,0]=4 113 B12R2.1081 IC1=CC=CC2=CC=CC=C12 CS-624 [0,0,1,1,0,0|2,0,0]=4 114 B12R2.1081 OC1=CC=CC2=CC=NC=C12 08-2232 [0,0,1,1,0,0|2,0,0]=4 115 B12R2.1081 OC1=CC=CC2=NC=CN=C12 08-10499 [0,0,1,1,0,0|2,0,0]=4 116 B12R2.1081 OC1=CC=NC2=CC=CC=C12 021817 [0,0,1,1,0,0|2,0,0]=4 117 B12R2.1081 OC1=CN=CC2=CC=CC=C12 08-3660 [0,0,1,1,0,0|2,0,0]=4 118 B12R2.1 O=CC1=CN=C2C=CC=CN12 08-2255 [0,0,1,1,0,0|2,0,0]=4 119 B12R2.1 O=CC1=CSC2=C1C=CC=C2 08-10186 [0,0,1,1,0,0|2,0,0]=4 120 B12R2.1 O=CC1=NNC2=C1C=CC=C2 08-4370 [0,0,1,1,0,0|2,0,0]=4 121 B12R2.44 O=CC1=CC2=C(C=C1)NC=C2 08-319 [0,0,1,1,0,0|2,0,0]=4 122 B12R2.44 O=CC1=CC2=C(C=CN2)C=C1 08-2214 [0,0,1,1,0,0|2,0,0]=4 123 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 CS-894 [0,0,1,0,1,0|0,0,2]=4