0 B10R1.20 BrCC1=C(CBr)C=CC=C1 67590 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.20 CCC1=C(C#N)C=CC=C1 75532 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.20 CCC1=C(C=O)C=CC=C1 67799 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.20 CCC1=C(CO)C=CC=C1 97471 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.20 CCC1=C(NN)C=CC=C1 F11684 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.20 CCC1=NC=CN=C1CC D89888 [0,0,0,0,0,0|0,0,0]=0 6 B10R1.20 CCC1=NC=CN=C1OC AC7777 [0,0,0,0,0,0|1,0,0]=1 7 B10R1.20 CCC1=NC=CN=C1SC D90558 [0,0,0,0,0,0|1,0,0]=1 8 B10R1.20 CNC1=C(C#N)C=CC=N1 87810 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.20 CNC1=C(CO)C=CC=N1 23263 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.20 CNC1=C(NC)C=CC=C1 F51935 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.20 CNC1=C(OC)C=CC=C1 O10823 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.20 COC1=C(C#N)N=CC=C1 79551 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.20 COC1=C(C=O)C=CC=N1 26015 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.20 COC1=C(CCl)C=CC=N1 71955 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.20 COC1=C(CN)C=CC=C1 F14886 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.20 COC1=C(CO)C=CC=C1 79243 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.20 COC1=C(OC)C=CC=C1 D70447 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.20 COC1=C(SC)C=CC=C1 D91542 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.20 COC1=CC=CN=C1OC 75309 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.20 COC1=NC=CC=C1C#N 71633 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.20 COC1=NC=CC=C1CN 36191 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.20 COC1=NC=CC=C1CO CL0061 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.20 ClCC1=CC=CN=C1CCl F19731 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.20 N#CC1=CC=CN=C1CBr W10397 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.20 N#CC1=NC=CN=C1C#N 87493 [0,0,0,0,0,0|2,0,2]=4 26 B10R1.20 NCC1=C(CN)C=CC=C1 20183 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.20 NCC1=C(CO)C=CC=C1 23734 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.20 OCC1=C(CO)C=CC=C1 35513 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.15 BrCC1=CC=CN=C1Br AT22145 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.15 BrCC1=CC=CN=C1Br I10149 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.15 CC1=C(C=O)C=CC=N1 CL0326 [1,0,0,0,0,0|2,0,1]=4 32 B9R1.15 CC1=C(CBr)C=CC=C1 73693 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.15 CC1=C(CN)C=CC=C1 CK2406 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.15 CC1=C(CO)C=CC=C1 AC7567 [1,0,0,0,0,0|3,0,0]=4 35 B9R1.15 CC1=C(CO)C=CC=C1 W15671 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.15 CC1=C(CO)C=CC=N1 AB4004 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.15 CC1=CC=CN=C1C#N SC4241 [1,0,0,0,0,0|2,0,1]=4 38 B9R1.15 CC1=CC=CN=C1C=O 23333 [1,0,0,0,0,0|2,0,1]=4 39 B9R1.15 CC1=CC=CN=C1CCl 25715 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.15 CC1=CC=CN=C1CCl P10614 [1,0,0,0,0,0|2,0,0]=3 41 B9R1.15 CC1=CC=CN=C1CN D82697 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.15 CC1=CC=CN=C1CN FD13047 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.15 CC1=CC=CN=C1CO 34871 [1,0,0,0,0,0|2,0,0]=3 44 B9R1.15 CC1=CC=CN=C1NN F18137 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.15 CC1=NC=CC=C1NN AC1782 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.15 CCC1=C(Br)C=CC=C1 28851 [1,0,0,0,0,0|3,0,0]=4 47 B9R1.15 CCC1=C(Br)C=NC=N1 F13814 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.15 CCC1=C(C)C=CC=C1 35300 [1,0,0,0,0,0|2,0,0]=3 49 B9R1.15 CCC1=C(F)C=NC=N1 38077 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.15 CCC1=C(I)C=CC=C1 N11906 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.15 CCC1=CC=CN=C1Cl 71994 [1,0,0,0,0,0|2,0,0]=3 52 B9R1.15 CCC1=CC=CN=C1N 20154 [1,0,0,0,0,0|2,0,0]=3 53 B9R1.15 CCC1=CN=CN=C1Cl H10163 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.15 CCC1=NC=CN=C1C D90495 [1,0,0,0,0,0|0,0,0]=1 55 B9R1.15 CCC1=NC=CN=C1Cl 35287 [1,0,0,0,0,0|1,0,0]=2 56 B9R1.15 CNC1=C(Br)C=CC=N1 O10973 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.15 CNC1=C(C)C=CC=C1 D78237 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.15 CNC1=C(Cl)C=CC=N1 W16401 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.15 CNC1=CC=CN=C1Cl F17445 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.15 CNC1=NC=CC=C1N 71770 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.15 COC1=C(Br)C=CC=N1 22447 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.15 COC1=C(C)N=CC=C1 82013 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.15 COC1=C(Cl)C=CC=N1 23212 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.15 COC1=C(F)C=CC=N1 34939 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.15 COC1=C(I)C=CC=N1 34179 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.15 COC1=C(N)N=CC=C1 BL001952 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.15 COC1=C(O)N=CC=C1 20791 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.15 COC1=CC=CN=C1Br 54570 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.15 COC1=CC=CN=C1Cl 22465 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.15 COC1=CC=CN=C1F O10777 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.15 COC1=NC=CC=C1N 33231 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.15 COC1=NC=CC=C1O C14621 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.15 COC1=NC=CN=C1C 28462 [1,0,0,0,0,0|1,0,0]=2 74 B9R1.15 COC1=NC=CN=C1Cl 23466 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.15 COC1=NC=CN=C1N BL006014 [1,0,0,0,0,0|2,0,0]=3 76 B9R1.15 CSC1=NC=CN=C1C AC7605 [1,0,0,0,0,0|1,0,0]=2 77 B9R1.15 ClCC1=C(Br)C=CC=N1 30584 [1,0,0,0,0,0|3,0,0]=4 78 B9R1.15 ClCC1=CC=CN=C1Cl 37574 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.15 ClCC1=CC=CN=C1Cl 57250 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.15 ClCC1=NC=CN=C1Cl 26522 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.15 FC1=C(CCl)C=CC=N1 D94976 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.15 FC1=CC=CN=C1CCl P11154 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.15 N#CC1=NC=CN=C1Br W11673 [1,0,0,0,0,0|2,0,1]=4 84 B9R1.15 N#CC1=NC=CN=C1Cl 33715 [1,0,0,0,0,0|2,0,1]=4 85 B9R1.15 N#CC1=NC=CN=C1N 24755 [1,0,0,0,0,0|2,0,1]=4 86 B9R1.15 NC1=C(CO)C=CC=N1 51059 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.15 NCC1=C(Cl)C=CC=N1 26418 [1,0,0,0,0,0|3,0,0]=4 88 B9R1.15 NCC1=CC=CN=C1F 26745 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.15 NCC1=CC=CN=C1F C76777 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.15 NCC1=NC=CN=C1Cl 25598 [1,0,0,0,0,0|2,0,0]=3 91 B9R1.15 NCC1=NC=CN=C1Cl 80496 [1,0,0,0,0,0|2,0,0]=3 92 B9R1.15 NCC1=NC=CN=C1Cl Y10047 [1,0,0,0,0,0|2,0,0]=3 93 B9R1.15 NNC1=NC=CN=C1Cl 23845 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.15 OCC1=C(Br)C=CC=N1 78441 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.15 OCC1=C(Cl)C=CC=N1 25536 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.15 OCC1=C(F)C=CC=N1 37476 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.15 OCC1=C(O)C=CC=N1 85301 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.15 OCC1=CC=CN=C1Br 55186 [1,0,0,0,0,0|3,0,0]=4 99 B9R1.15 OCC1=CC=CN=C1Cl CL0067 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.15 OCC1=CC=CN=C1F 34718 [1,0,0,0,0,0|3,0,0]=4 101 B11R1.37 CCC1=NC=C(C)N=C1CC D81788 [0,1,0,0,0,0|0,0,0]=1 102 B11R1.37 COC1=C(OC)N=C(Br)C=N1 26859 [0,1,0,0,0,0|2,0,0]=3 103 B11R1.37 COC1=C(OC)N=C(I)C=C1 50651 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.37 COC1=CC=C(N)N=C1OC 71971 [0,1,0,0,0,0|3,0,0]=4 105 B11R1.37 COC1=NC=C(F)C=C1CO 85041 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.41 CCNC1=C(C#N)C=CC=N1 D74896 [0,1,0,0,0,0|2,0,1]=4 107 B11R1.41 CCOC1=C(CN)C=CC=C1 F13431 [0,1,0,0,0,0|3,0,0]=4 108 B11R1.41 CCOC1=C(CO)C=CC=C1 D90532 [0,1,0,0,0,0|3,0,0]=4 109 B11R1.41 CCOC1=C(OC)C=CC=C1 34509 [0,1,0,0,0,0|3,0,0]=4 110 B11R1.41 CCOC1=CC=CN=C1C=O D95047 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.41 CCOC1=NC=CN=C1NN D80190 [0,1,0,0,0,0|2,0,0]=3 112 B11R1.41 CNCC1=C(OC)C=CC=C1 C10417 [0,1,0,0,0,0|3,0,0]=4 113 B11R1.41 COC1=C(CCBr)C=CC=C1 F19990 [0,1,0,0,0,0|3,0,0]=4 114 B11R1.41 COC1=C(CCN)C=CC=C1 63798 [0,1,0,0,0,0|3,0,0]=4 115 B11R1.41 COC1=C(CCO)C=CC=C1 36337 [0,1,0,0,0,0|3,0,0]=4 116 B11R1.53 CCC1=NC=CN=C1C(C)=O AC8556 [0,1,0,0,0,0|0,0,1]=2 117 B11R1.53 COC1=C(C(C)C)C=CC=C1 S11896 [0,1,0,0,0,0|3,0,0]=4 118 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 52751 [0,1,0,0,0,0|3,0,0]=4 119 B11R1.53 COC1=C([C@H](C)O)C=CC=C1 29310 [0,1,0,0,0,0|3,0,0]=4 120 B11R1.53 COC1=CC=CN=C1C(C)=O 27055 [0,1,0,0,0,0|2,0,1]=4 121 B11R1.53 COC1=NC=CN=C1C(C)C D70658 [0,1,0,0,0,0|1,0,0]=2 122 B11R1.265 CCC1=C(OC)C(=O)C=CO1 D80977 [0,1,0,0,0,0|3,0,0]=4 123 B11R2.1 C[C@H]1CCC2=NC=CN=C21 AC9223 [0,0,0,1,0,0|0,0,0]=1 124 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 36655 [0,0,0,1,0,0|3,0,0]=4 125 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 41002 [0,0,0,1,0,0|3,0,0]=4 126 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 67750 [0,0,0,1,0,0|3,0,0]=4 127 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 67775 [0,0,0,1,0,0|3,0,0]=4 128 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 67878 [0,0,0,1,0,0|3,0,0]=4 129 B11R2.1 O=C1CCC2=C1C=CC=N2 SC1911 [0,0,0,1,0,0|2,0,1]=4 130 B11R2.1 O=C1CCC2=CC=CN=C12 26598 [0,0,0,1,0,0|2,0,1]=4 131 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 I10213 [0,0,0,1,0,0|3,0,0]=4 132 B11R2.1 O[C@H]1CCC2=CC=CN=C21 25176 [0,0,0,1,0,0|2,0,0]=3 133 B11R2.20 C1=CC2=C(C=C1)CNCC2 66636 [0,0,0,1,0,0|3,0,0]=4 134 B11R2.20 C1=CC2=C(C=C1)CNCC2 66637 [0,0,0,1,0,0|3,0,0]=4 135 B11R2.20 C1=CC2=C(C=C1)COCC2 25404 [0,0,0,1,0,0|3,0,0]=4 136 B11R2.20 C1=CC2=C(C=C1)NCCC2 66632 [0,0,0,1,0,0|3,0,0]=4 137 B11R2.20 C1=CC2=C(C=C1)OCCC2 F13522 [0,0,0,1,0,0|3,0,0]=4 138 B11R2.20 C1=CC2=C(C=N1)CCCC2 67092 [0,0,0,1,0,0|3,0,0]=4 139 B11R2.20 C1=CC2=C(N=C1)NCCO2 84111 [0,0,0,1,0,0|3,0,0]=4 140 B11R2.20 C1=CN=C2CCCCC2=C1 66526 [0,0,0,1,0,0|1,0,0]=2 141 B11R2.20 C1=CN=C2CCCCC2=N1 O11321 [0,0,0,1,0,0|0,0,0]=1 142 B11R2.20 C1=CN=C2CCNCC2=C1 SC2731 [0,0,0,1,0,0|2,0,0]=3 143 B11R2.20 C1=CN=C2CNCCC2=C1 37895 [0,0,0,1,0,0|2,0,0]=3 144 B11R2.20 C1=CN=C2NCCCC2=C1 RB3283 [0,0,0,1,0,0|2,0,0]=3 145 B11R2.20 C1=CN=C2NCCNC2=C1 82955 [0,0,0,1,0,0|3,0,0]=4 146 B9R1.14 CCN1C=CN=C1C=O RB3054 [0,0,0,0,1,0|2,0,1]=4 147 B9R1.14 CCN1N=CC=C1C=O W17394 [0,0,0,0,1,0|2,0,1]=4 148 B9R1.14 CCN1N=CN=C1CO F50018 [0,0,0,0,1,0|2,0,0]=3 149 B8R1.2 BrCC1=CN=CC=C1 30280 [2,0,0,0,0,0|2,0,0]=4 150 B8R1.2 BrCC1=NC=CC=C1 77889 [2,0,0,0,0,0|2,0,0]=4 151 B8R1.2 CCC1=NC=CN=C1 O10771 [2,0,0,0,0,0|0,0,0]=2 152 B8R1.2 CNC1=CC=CN=C1 34276 [2,0,0,0,0,0|2,0,0]=4 153 B8R1.2 CNC1=NC=CC=C1 F19549 [2,0,0,0,0,0|2,0,0]=4 154 B8R1.2 CNC1=NC=CN=C1 71735 [2,0,0,0,0,0|1,0,0]=3 155 B8R1.2 COC1=CN=CC=C1 35432 [2,0,0,0,0,0|2,0,0]=4 156 B8R1.2 COC1=NC=CC=C1 26095 [2,0,0,0,0,0|2,0,0]=4 157 B8R1.2 COC1=NC=CN=C1 O10825 [2,0,0,0,0,0|1,0,0]=3 158 B8R1.2 CSC1=NC=CC=C1 75585 [2,0,0,0,0,0|2,0,0]=4 159 B8R1.2 CSC1=NC=CN=C1 W13055 [2,0,0,0,0,0|1,0,0]=3 160 B8R1.2 CSC1=NN=CC=N1 88638 [2,0,0,0,0,0|2,0,0]=4 161 B8R1.2 ClCC1=CN=CC=C1 83428 [2,0,0,0,0,0|2,0,0]=4 162 B8R1.2 ClCC1=NC=CC=C1 75521 [2,0,0,0,0,0|2,0,0]=4 163 B8R1.2 ClCC1=NC=CN=C1 79386 [2,0,0,0,0,0|1,0,0]=3 164 B8R1.2 N#CC1=NC=CN=C1 44475 [2,0,0,0,0,0|1,0,1]=4 165 B8R1.2 NCC1=CC=CN=C1 D70555 [2,0,0,0,0,0|2,0,0]=4 166 B8R1.2 NCC1=NC=CC=C1 F11236 [2,0,0,0,0,0|2,0,0]=4 167 B8R1.2 NCC1=NC=CN=C1 34958 [2,0,0,0,0,0|1,0,0]=3 168 B8R1.2 NCC1=NC=CN=C1 AR1004 [2,0,0,0,0,0|1,0,0]=3 169 B8R1.2 NNC1=NC=CN=C1 62974 [2,0,0,0,0,0|2,0,0]=4 170 B8R1.2 O=CC1=NC=CN=C1 24785 [2,0,0,0,0,0|1,0,1]=4 171 B8R1.2 OCC1=CN=CC=C1 P16746 [2,0,0,0,0,0|2,0,0]=4 172 B8R1.2 OCC1=NC=CC=C1 AC7883 [2,0,0,0,0,0|2,0,0]=4 173 B8R1.2 OCC1=NC=CN=C1 BL002777 [2,0,0,0,0,0|1,0,0]=3 174 B8R1.5 BrC1=NC=CN=C1Br 26811 [2,0,0,0,0,0|2,0,0]=4 175 B8R1.5 CC1=C(Br)C=CC=N1 22258 [2,0,0,0,0,0|2,0,0]=4 176 B8R1.5 CC1=C(Cl)C=CC=N1 22523 [2,0,0,0,0,0|2,0,0]=4 177 B8R1.5 CC1=C(F)C=CC=N1 22664 [2,0,0,0,0,0|2,0,0]=4 178 B8R1.5 CC1=C(O)C=CC=N1 CL0055 [2,0,0,0,0,0|2,0,0]=4 179 B8R1.5 CC1=CC=CN=C1Br 23100 [2,0,0,0,0,0|2,0,0]=4 180 B8R1.5 CC1=CC=CN=C1C P19755 [2,0,0,0,0,0|1,0,0]=3 181 B8R1.5 CC1=CC=CN=C1Cl 35875 [2,0,0,0,0,0|2,0,0]=4 182 B8R1.5 CC1=CC=CN=C1F 75536 [2,0,0,0,0,0|2,0,0]=4 183 B8R1.5 CC1=CC=CN=C1I W17869 [2,0,0,0,0,0|2,0,0]=4 184 B8R1.5 CC1=CC=CN=C1N AB2930 [2,0,0,0,0,0|2,0,0]=4 185 B8R1.5 CC1=CC=CN=C1O 33224 [2,0,0,0,0,0|2,0,0]=4 186 B8R1.5 CC1=NC=CC=C1N 22472 [2,0,0,0,0,0|2,0,0]=4 187 B8R1.5 CC1=NC=CN=C1C S12348 [2,0,0,0,0,0|0,0,0]=2 188 B8R1.5 CC1=NC=CN=C1Cl 23471 [2,0,0,0,0,0|1,0,0]=3 189 B8R1.5 CC1=NC=CN=C1N 23909 [2,0,0,0,0,0|1,0,0]=3 190 B8R1.5 CC1=NC=CN=C1O 29408 [2,0,0,0,0,0|1,0,0]=3 191 B8R1.5 ClC1=NC=CN=C1Cl P10041 [2,0,0,0,0,0|2,0,0]=4 192 B8R1.5 NC1=NC=CN=C1Cl 83269 [2,0,0,0,0,0|2,0,0]=4 193 B8R1.5 NC1=NC=CN=C1N 26762 [2,0,0,0,0,0|2,0,0]=4 194 B8R1.5 NC1=NC=CN=C1O 25554 [2,0,0,0,0,0|2,0,0]=4 195 B10R1.4 CC1=C(CCBr)C=CC=C1 F19986 [1,1,0,0,0,0|2,0,0]=4 196 B10R1.4 CC1=C(CCO)C=CC=C1 58187 [1,1,0,0,0,0|2,0,0]=4 197 B10R1.4 CCOC1=C(Br)C=CC=N1 F15483 [1,1,0,0,0,0|2,0,0]=4 198 B10R1.4 CCOC1=C(Cl)C=CC=N1 F52731 [1,1,0,0,0,0|2,0,0]=4 199 B10R1.4 CCOC1=C(I)C=CC=N1 C76455 [1,1,0,0,0,0|2,0,0]=4 200 B10R1.4 CCOC1=C(N)N=CC=C1 D97280 [1,1,0,0,0,0|2,0,0]=4 201 B10R1.4 CCOC1=NC=CC=C1N F20019 [1,1,0,0,0,0|2,0,0]=4 202 B10R1.4 CCOC1=NC=CN=C1C D91388 [1,1,0,0,0,0|0,0,0]=2 203 B10R1.4 CNCC1=C(C)C=CC=C1 I12011 [1,1,0,0,0,0|2,0,0]=4 204 B10R1.4 CNCC1=CC=CN=C1Cl 68594 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.25 CC1=C(CCl)C=CC(Cl)=N1 D83690 [1,1,0,0,0,0|2,0,0]=4 206 B10R1.25 CC1=CN=C(CCl)C(C)=C1 26464 [1,1,0,0,0,0|2,0,0]=4 207 B10R1.25 CC1=CN=C(CO)C(C)=C1 O10071 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.25 CCC1=NC=C(C)N=C1C O10767 [1,1,0,0,0,0|0,0,0]=2 209 B10R1.25 COC1=NC=C(Br)C=C1C 83015 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.25 COC1=NC=C(C)N=C1C 26298 [1,1,0,0,0,0|1,0,0]=3 211 B10R1.25 COC1=NC=C(N)C=C1C 20206 [1,1,0,0,0,0|2,0,0]=4 212 B10R1.25 CSC1=NC=C(C)N=C1C D95700 [1,1,0,0,0,0|1,0,0]=3 213 B10R1.30 CC1=NC=C(Br)C=C1CO P17507 [1,1,0,0,0,0|2,0,0]=4 214 B10R1.30 CCC1=C(O)C=CC(C)=N1 34316 [1,1,0,0,0,0|2,0,0]=4 215 B10R1.30 CCC1=C(O)C=CC(C)=N1 CK1206 [1,1,0,0,0,0|2,0,0]=4 216 B10R1.30 COC1=C(Cl)N=CC(Br)=N1 I10123 [1,1,0,0,0,0|2,0,0]=4 217 B10R1.30 COC1=C(N)N=CC(Br)=N1 BL005729 [1,1,0,0,0,0|2,0,0]=4 218 B10R1.30 COC1=C(N)N=CC(Cl)=N1 25271 [1,1,0,0,0,0|2,0,0]=4 219 B10R1.61 CC(=O)C1=NC=CC=C1C 29931 [1,1,0,0,0,0|1,0,1]=4 220 B10R1.61 CC(=O)C1=NC=CN=C1C D81739 [1,1,0,0,0,0|0,0,1]=3 221 B10R1.61 CC(=O)C1=NC=CN=C1Cl 52561 [1,1,0,0,0,0|1,0,1]=4 222 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 32611 [1,1,0,0,0,0|2,0,0]=4 223 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 N12083 [1,1,0,0,0,0|2,0,0]=4 224 B10R1.61 CC1=C([C@H](C)O)C=CC=C1 29797 [1,1,0,0,0,0|2,0,0]=4 225 B10R1.61 CC1=NC=CN=C1C(=O)O CL3443 [1,1,0,0,0,0|1,0,1]=4 226 B10R1.61 CC1=NC=CN=C1C(N)=O D96758 [1,1,0,0,0,0|1,0,1]=4 227 B10R1.61 CN(C)C1=NC=CN=C1Cl N10068 [1,1,0,0,0,0|2,0,0]=4 228 B10R1.61 CN(C)C1=NC=CN=C1N 25983 [1,1,0,0,0,0|2,0,0]=4 229 B10R1.61 C[C@H](O)C1=CC=CN=C1Br 79365 [1,1,0,0,0,0|2,0,0]=4 230 B10R1.61 C[C@H](O)C1=CC=CN=C1Cl W18332 [1,1,0,0,0,0|2,0,0]=4 231 B10R1.245 COC1=C(Cl)C=CN=C1C 39008 [1,1,0,0,0,0|2,0,0]=4 232 B12R1.75 COC1=NC=CN=C1CC(C)C 28463 [0,2,0,0,0,0|1,0,0]=3 233 B12R1.77 CC[C@H](C)C1=NC=CN=C1OC AC1469 [0,2,0,0,0,0|1,0,0]=3 234 B12R1.77 COC(=O)C1=NC=CN=C1OC AB11806 [0,2,0,0,0,0|1,0,1]=4 235 B12R1.169 CCNC1=C(NCC)C=CC=C1 AB9073 [0,2,0,0,0,0|2,0,0]=4 236 B12R1.169 CCOC1=C(OCC)C=CC=C1 AC7914 [0,2,0,0,0,0|2,0,0]=4 237 B12R1.169 OCCC1=C(CCO)C=CC=C1 D92918 [0,2,0,0,0,0|2,0,0]=4 238 B12R1.283 CCOC1=NC=CN=C1C(C)C T72883 [0,2,0,0,0,0|0,0,0]=2 239 B10R2.7 C1=CC2=C(C=C1)CCC2 D97393 [1,0,0,1,0,0|2,0,0]=4 240 B10R2.7 C1=CN=C2CCCC2=C1 85228 [1,0,0,1,0,0|1,0,0]=3 241 B10R2.7 C1=CN=C2CCNC2=C1 AC8217 [1,0,0,1,0,0|2,0,0]=4 242 B10R2.7 C1=CN=C2CNCC2=C1 F15050 [1,0,0,1,0,0|2,0,0]=4 243 B10R2.7 C1=CN=C2NCCC2=C1 67567 [1,0,0,1,0,0|2,0,0]=4 244 B10R2.32 O[C@H]1CCN2C=CN=C12 72630 [0,0,0,1,1,0|2,0,0]=4 245 B12R2.24 BrC1=CC2=C(C=C1)CCCC2 N10556 [0,1,0,1,0,0|2,0,0]=4 246 B12R2.24 BrC1=CN=C2CCCCC2=C1 55099 [0,1,0,1,0,0|1,0,0]=3 247 B12R2.24 CC1=CC=C2CCCCC2=N1 C15437 [0,1,0,1,0,0|1,0,0]=3 248 B12R2.24 CC1=CC=C2CCCNC2=N1 63326 [0,1,0,1,0,0|2,0,0]=4 249 B12R2.24 C[C@H]1CCC2=C(C=CC=C2)N1 AC1627 [0,1,0,1,0,0|2,0,0]=4 250 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 SC2831 [0,1,0,1,0,0|2,0,0]=4 251 B12R2.24 NC1=NC2=C(C=N1)CCCC2 31226 [0,1,0,1,0,0|2,0,0]=4 252 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 20236 [0,1,0,1,0,0|2,0,0]=4 253 B12R2.24 O=C1C=C2CCCCC2=NN1 D73284 [0,1,0,1,0,0|2,0,0]=4 254 B12R2.24 O=C1C=CC2=C(CCCC2)N1 87090 [0,1,0,1,0,0|1,0,1]=4 255 B12R2.24 OC1=CC2=C(C=C1)CCCC2 O11319 [0,1,0,1,0,0|2,0,0]=4 256 B12R2.24 OC1=CN=C2CCCCC2=C1 F51876 [0,1,0,1,0,0|1,0,0]=3 257 B12R2.24 O[C@H]1CCC2=C(C=CC=C2)C1 94674 [0,1,0,1,0,0|2,0,0]=4 258 B12R2.1081 BrC1=C2CCCCC2=CC=C1 N12384 [0,1,0,1,0,0|2,0,0]=4 259 B12R2.1081 C[C@@H]1NCCC2=C1C=CC=C2 24493 [0,1,0,1,0,0|2,0,0]=4 260 B12R2.1081 C[C@@H]1NCCC2=C1C=CC=C2 24577 [0,1,0,1,0,0|2,0,0]=4 261 B12R2.1081 NC1=C2CCCCC2=CC=C1 50818 [0,1,0,1,0,0|2,0,0]=4 262 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 52172 [0,1,0,1,0,0|2,0,0]=4 263 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 52173 [0,1,0,1,0,0|2,0,0]=4 264 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 F13060 [0,1,0,1,0,0|2,0,0]=4 265 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 F16883 [0,1,0,1,0,0|2,0,0]=4 266 B12R2.1081 N[C@H]1CCCC2=CC=CN=C21 54847 [0,1,0,1,0,0|1,0,0]=3 267 B12R2.1081 O=C1CCCC2=C1C=CC=N2 66292 [0,1,0,1,0,0|1,0,1]=4 268 B12R2.1081 O=C1CCCC2=CC=CN=C12 58440 [0,1,0,1,0,0|1,0,1]=4 269 B12R2.1081 OC1=C2CCCCC2=CC=C1 N11905 [0,1,0,1,0,0|2,0,0]=4 270 B12R2.1081 OC1=NC=NC2=C1CCCC2 W17290 [0,1,0,1,0,0|2,0,0]=4 271 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 73935 [0,1,0,1,0,0|2,0,0]=4 272 B12R2.1081 O[C@H]1CCCC2=CC=CN=C21 66602 [0,1,0,1,0,0|1,0,0]=3 273 B8R1.11 CC1=C(CN)SC=N1 W10148 [1,0,0,0,1,0|2,0,0]=4 274 B8R1.11 CC1=C(CO)N=CN1 CK2461 [1,0,0,0,1,0|1,0,1]=4 275 B8R1.11 CC1=C(CO)N=CN1 W10531 [1,0,0,0,1,0|1,0,1]=4 276 B8R1.11 CC1=C(CO)SC=C1 71542 [1,0,0,0,1,0|2,0,0]=4 277 B8R1.11 CC1=NON=C1CN 20188 [1,0,0,0,1,0|2,0,0]=4 278 B8R1.11 CCC1=CNN=C1N 82129 [1,0,0,0,1,0|2,0,0]=4 279 B8R1.11 CCN1C=CN=C1Cl 24215 [1,0,0,0,1,0|2,0,0]=4 280 B8R1.11 CCN1N=CC=C1N 61440 [1,0,0,0,1,0|2,0,0]=4 281 B8R1.11 CN1C=CN=C1CCl 83186 [1,0,0,0,1,0|2,0,0]=4 282 B8R1.11 CN1C=CN=C1CCl F17325 [1,0,0,0,1,0|2,0,0]=4 283 B8R1.11 CN1C=CN=C1CN 29381 [1,0,0,0,1,0|2,0,0]=4 284 B8R1.11 CN1C=CN=C1CO CL2202 [1,0,0,0,1,0|2,0,0]=4 285 B8R1.11 CN1N=CC=C1CCl P10739 [1,0,0,0,1,0|2,0,0]=4 286 B8R1.11 CN1N=CC=C1CN 30307 [1,0,0,0,1,0|2,0,0]=4 287 B8R1.11 CN1N=CC=C1CN 72161 [1,0,0,0,1,0|2,0,0]=4 288 B8R1.11 CN1N=CC=C1CO 30308 [1,0,0,0,1,0|2,0,0]=4 289 B8R1.11 CN1N=CN=C1CO F30159 [1,0,0,0,1,0|2,0,0]=4 290 B8R1.11 COC1=CC=NN1C D82675 [1,0,0,0,1,0|2,0,0]=4 291 B8R1.11 CSC1=C(C)OC=C1 H11351 [1,0,0,0,1,0|2,0,0]=4 292 B8R1.11 CSC1=NC=CN1C SC5098 [1,0,0,0,1,0|2,0,0]=4