0 B10R1.176 CC1=CC=C(C=O)C=C1C D3200 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.176 COC1=CC(C)=C(Br)C=C1 B9069 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.176 COC1=CC=C(C)C(Cl)=C1 C6757 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.176 COC1=CC=C(C)C(Cl)=C1 C6757 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.176 COC1=CC=C(N)C(N)=N1 D11566 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.176 COC1=CC=C(N)C(N)=N1 D11566 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.176 COC1=CC=C(N)C(N)=N1 M6761 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.1 CC1=CC=C(CN)C=C1 M4305 [1,0,0,0,0,0|3,0,0]=4 8 B9R1.1 CC1=CC=C(CN)C=C1 M4305 [1,0,0,0,0,0|3,0,0]=4 9 B9R1.1 CC1=NC=C(CO)C=N1 M17093 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.1 CCC1=CC=C(Br)C=C1 B8398 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.1 CCC1=CN=C(Cl)N=C1 C3173 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.1 COC1=CN=C(N)C=C1 A18252 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.1 COC1=NC=C(Br)C=C1 B2938 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.1 COC1=NC=C(N)C=C1 A1857 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.1 COC1=NC=C(O)C=C1 H14190 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.1 CSC1=CC=C(C)C=C1 M3899 [1,0,0,0,0,0|3,0,0]=4 17 B9R1.1 ClCC1=CN=C(Cl)C=C1 C0611 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.1 NCC1=CN=C(N)C=C1 A14418 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.1 OCC1=CN=C(Cl)C=C1 C1155 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.1 OCC1=NC=C(Br)C=C1 B8505 [1,0,0,0,0,0|3,0,0]=4 21 B9R1.2 BrCC1=NC(Br)=CC=C1 B12644 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.2 C=CC1=CC(C)=CN=C1 M13360 [1,0,0,0,0,0|1,0,2]=4 23 B9R1.2 CC1=CC(CN)=CC=C1 M4304 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.2 CC1=CC=CC(C#N)=N1 M2704 [1,0,0,0,0,0|2,0,1]=4 25 B9R1.2 CC1=CC=CC(CO)=N1 M11438 [1,0,0,0,0,0|2,0,0]=3 26 B9R1.2 CCC1=CC(O)=CC=C1 E18807 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.2 CCC1=CC=CC(Br)=C1 B8399 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.2 COC1=CC=CC(Br)=N1 B11416 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.2 COC1=CC=CC(N)=N1 M0099 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.2 COC1=CN=CC(Br)=C1 B11442 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.2 COC1=CN=CC(Cl)=C1 C17302 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.2 COC1=CN=CC(N)=C1 M11541 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.2 COC1=NC(C)=CC=C1 M2706 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.2 COC1=NC(C)=CC=C1 M2706 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.2 COC1=NC(Cl)=CC=C1 C2489 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.2 COC1=NC=CC(C)=N1 M11332 [1,0,0,0,0,0|3,0,0]=4 37 B9R1.2 NCC1=NC(Br)=CC=C1 B0272 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.2 OCC1=CC(Br)=CN=C1 B2855 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.2 OCC1=NC(Br)=CC=C1 B8506 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.69 CC1=C(Br)N=CC(Br)=C1 D5055 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.69 CC1=C(Br)N=CC(N)=C1 A1023 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.69 CC1=C(Cl)N=CC(N)=C1 A15257 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.69 CC1=C(F)C=CC(Br)=N1 B4568 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.69 CC1=C(F)C=CC(Br)=N1 B4568 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.69 CC1=CC(Br)=CN=C1C B19461 [1,0,0,0,0,0|2,0,0]=3 46 B9R1.69 CC1=CC(Br)=CN=C1Cl B1829 [1,0,0,0,0,0|3,0,0]=4 47 B9R1.69 CC1=CC(Br)=CN=C1I B13853 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.69 CC1=CC(Br)=CN=C1N A1022 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.69 CC1=CC(Cl)=CN=C1Cl D1830 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.69 CC1=CC=C(Br)C(Cl)=N1 B18492 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.69 CC1=CC=C(Br)C=C1C B17706 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.69 CC1=CC=C(Br)N=C1Br D1831 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.69 CC1=CC=C(C)C(S)=C1 D0558 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.69 CC1=CC=C(N)C(Cl)=N1 A15272 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.69 CC1=CC=C(S)C(C)=C1 D0551 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.69 CC1=CN=C(C)C(C)=N1 T0524 [1,0,0,0,0,0|0,0,0]=1 57 B9R1.69 CC1=CN=C(C)C(Cl)=N1 C3827 [1,0,0,0,0,0|1,0,0]=2 58 B9R1.69 CC1=CN=C(Cl)C(N)=C1 A15273 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.69 CC1=CN=C(N)C(Br)=C1 A5323 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.69 CC1=NC(Br)=C(N)C=C1 A1033 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.69 CC1=NC(Br)=C(N)C=C1 A1033 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.69 CC1=NC(C)=C(Br)C=C1 B8438 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.69 CC1=NC(Cl)=CC=C1N A18276 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.69 CC1=NC(N)=C(Br)C=C1 A1031 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.69 CC1=NC(N)=CC=C1Br A3762 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.69 CC1=NC(N)=CC=C1Br A3762 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.69 CC1=NC=C(Br)C=C1Br M11134 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.69 CC1=NC=C(N)C(C)=N1 D17022 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.69 NC1=C(Br)N=C(Br)C=N1 A3769 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.69 NC1=C(Br)N=C(Br)C=N1 A3769 [1,0,0,0,0,0|3,0,0]=4 71 B11R1.280 CCC1=CC(OC)=C(O)C=C1 M4695 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.280 CNC1=NC(OC)=CC=C1N M11580 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.280 COC1=CC=C(Br)C(OC)=N1 B16947 [0,1,0,0,0,0|3,0,0]=4 74 B11R1.280 COC1=CC=C(I)C(OC)=N1 I17070 [0,1,0,0,0,0|3,0,0]=4 75 B11R1.280 COC1=CC=C(O)C(OC)=N1 D14172 [0,1,0,0,0,0|3,0,0]=4 76 B8R1.2 C=CC1=NC=CN=C1 V13362 [2,0,0,0,0,0|0,0,2]=4 77 B8R1.2 ClCC1=CC=CN=C1 C1770 [2,0,0,0,0,0|2,0,0]=4 78 B8R1.2 ClCC1=NC=CC=C1 C5538 [2,0,0,0,0,0|2,0,0]=4 79 B8R1.2 NCC1=CC=CN=C1 P2319 [2,0,0,0,0,0|2,0,0]=4 80 B8R1.2 OCC1=NC=CC=C1 P1495 [2,0,0,0,0,0|2,0,0]=4 81 B8R1.3 BrC1=CN=C(I)C=N1 I14524 [2,0,0,0,0,0|2,0,0]=4 82 B8R1.3 CC1=CN=C(Br)C=C1 B5054 [2,0,0,0,0,0|2,0,0]=4 83 B8R1.3 CC1=CN=C(F)C=C1 F16734 [2,0,0,0,0,0|2,0,0]=4 84 B8R1.3 CC1=CN=C(N)C=C1 A1408 [2,0,0,0,0,0|2,0,0]=4 85 B8R1.3 CC1=CN=C(N)C=N1 A18243 [2,0,0,0,0,0|1,0,0]=3 86 B8R1.3 CC1=CN=C(O)C=C1 H11434 [2,0,0,0,0,0|2,0,0]=4 87 B8R1.3 CC1=NC=C(Br)C=C1 B0366 [2,0,0,0,0,0|2,0,0]=4 88 B8R1.3 CC1=NC=C(N)C=C1 A1025 [2,0,0,0,0,0|2,0,0]=4 89 B8R1.3 CC1=NC=C(N)C=C1 A1025 [2,0,0,0,0,0|2,0,0]=4 90 B8R1.3 NC1=CN=C(Br)C=N1 A12579 [2,0,0,0,0,0|2,0,0]=4 91 B8R1.4 CC1=CC(N)=CN=C1 M11544 [2,0,0,0,0,0|2,0,0]=4 92 B8R1.4 CC1=CC=CC(Br)=N1 B7894 [2,0,0,0,0,0|2,0,0]=4 93 B8R1.4 CC1=CC=CC(Cl)=N1 C0781 [2,0,0,0,0,0|2,0,0]=4 94 B8R1.4 CC1=CC=CC(O)=N1 H2705 [2,0,0,0,0,0|2,0,0]=4 95 B8R1.4 CC1=CC=CC(O)=N1 H2705 [2,0,0,0,0,0|2,0,0]=4 96 B8R1.4 CC1=CN=CC(Br)=C1 B1021 [2,0,0,0,0,0|2,0,0]=4 97 B8R1.4 CC1=CN=CC(Br)=C1 B1021 [2,0,0,0,0,0|2,0,0]=4 98 B8R1.4 CC1=CN=CC(C)=C1 D3192 [2,0,0,0,0,0|1,0,0]=3 99 B8R1.4 CC1=NC(N)=CC=C1 A1028 [2,0,0,0,0,0|2,0,0]=4 100 B8R1.4 ClC1=CN=CC(Cl)=N1 D1339 [2,0,0,0,0,0|2,0,0]=4 101 B8R1.4 NC1=CN=CC(Cl)=N1 A3767 [2,0,0,0,0,0|2,0,0]=4 102 B8R1.5 CC1=C(Br)C=CC=N1 B7895 [2,0,0,0,0,0|2,0,0]=4 103 B8R1.5 CC1=C(Br)C=CC=N1 B7895 [2,0,0,0,0,0|2,0,0]=4 104 B8R1.5 CC1=C(F)N=CC=C1 F4563 [2,0,0,0,0,0|2,0,0]=4 105 B8R1.5 CC1=CC=CN=C1Br B1020 [2,0,0,0,0,0|2,0,0]=4 106 B8R1.5 CC1=CC=CN=C1Br B1020 [2,0,0,0,0,0|2,0,0]=4 107 B8R1.5 CC1=CC=CN=C1Cl C1079 [2,0,0,0,0,0|2,0,0]=4 108 B8R1.5 CC1=CC=CN=C1O H11432 [2,0,0,0,0,0|2,0,0]=4 109 B8R1.5 CC1=NC=CC=C1N A5470 [2,0,0,0,0,0|2,0,0]=4 110 B8R1.5 CC1=NC=CC=C1O H6683 [2,0,0,0,0,0|2,0,0]=4 111 B8R1.5 CC1=NC=CN=C1C D0878 [2,0,0,0,0,0|0,0,0]=2 112 B8R1.5 ClC1=NC=CN=C1Cl D3858 [2,0,0,0,0,0|2,0,0]=4 113 B8R1.5 NC1=NC=CN=C1Br A19171 [2,0,0,0,0,0|2,0,0]=4 114 B10R1.1 CCOC1=CC=C(Br)C=N1 B9112 [1,1,0,0,0,0|2,0,0]=4 115 B10R1.3 CCC1=CC=C(CCl)C=C1 E18905 [1,1,0,0,0,0|2,0,0]=4 116 B10R1.13 CC(O)C1=NC=C(Br)C=C1 B13828 [1,1,0,0,0,0|2,0,0]=4 117 B10R1.13 CC1=CN=C(C(=N)N)C=N1 M14954 [1,1,0,0,0,0|1,0,1]=4 118 B10R1.13 CC1=CN=C(C(=O)O)C=N1 M0470 [1,1,0,0,0,0|1,0,1]=4 119 B10R1.2 CCC1=C(N)C(C)=CC=C1 M18865 [1,1,0,0,0,0|2,0,0]=4 120 B10R1.10 CC1=CC=CC(CCBr)=N1 B13336 [1,1,0,0,0,0|1,0,0]=3 121 B10R1.10 CCCC1=CC=CC(N)=N1 P17223 [1,1,0,0,0,0|2,0,0]=4 122 B10R1.10 CCOC1=CC=CC(N)=N1 E0124 [1,1,0,0,0,0|2,0,0]=4 123 B10R1.30 CCC1=C(O)C=CC(C)=N1 E16240 [1,1,0,0,0,0|1,0,0]=3 124 B10R1.113 CC(C)C1=CC=CC(Cl)=N1 C3699 [1,1,0,0,0,0|2,0,0]=4 125 B10R1.172 CCC1=NC(CO)=CC=C1 E11444 [1,1,0,0,0,0|1,0,0]=3 126 B10R1.172 COC1=CC=CC(OC)=N1 D4569 [1,1,0,0,0,0|2,0,0]=4 127 B10R1.172 OCC1=CC=CC(CO)=N1 D11421 [1,1,0,0,0,0|2,0,0]=4 128 B10R1.22 CC1=CC(O)=C(C)C(C)=C1 T0523 [1,1,0,0,0,0|2,0,0]=4 129 B10R1.118 CC1=NC(C)=C(C)N=C1C T0388 [1,1,0,0,0,0|0,0,0]=2 130 B10R1.58 CC1=C(C)SC(C(C)C)=N1 D7396 [0,1,0,0,1,0|1,0,0]=3 131 B10R1.131 CNCC1=NN(C)C(C)=C1 D16212 [0,1,0,0,1,0|1,0,0]=3 132 B12R1.19 CC1=C(C)N=C(CC(C)C)C=N1 I7656 [0,2,0,0,0,0|0,0,0]=2 133 B12R1.385 CC1=CC=C(SCCO)C=C1C D8290 [0,2,0,0,0,0|2,0,0]=4 134 B8R1.1 CC1=NC(CO)=CN1 M14970 [1,0,0,0,1,0|1,0,1]=4 135 B8R1.1 CC1=NC(CO)=CS1 M15583 [1,0,0,0,1,0|2,0,0]=4 136 B8R1.1 CCC1=NC(C)=CN1 E1457 [1,0,0,0,1,0|0,0,1]=3 137 B8R1.1 CCC1=NC(C)=CN1 E1887 [1,0,0,0,1,0|0,0,1]=3 138 B8R1.1 CCC1=NC(C)=CS1 E0630 [1,0,0,0,1,0|1,0,0]=3 139 B8R1.1 CCC1=NNC(N)=C1 E16726 [1,0,0,0,1,0|2,0,0]=4 140 B8R1.18 CC1=NC(C)=C(Br)S1 B8669 [1,0,0,0,1,0|2,0,0]=4 141 B8R1.18 CC1=NC(C)=C(C)S1 T11320 [1,0,0,0,1,0|1,0,0]=3 142 B8R1.18 CC1=NN(C)C(N)=C1 A13658 [1,0,0,0,1,0|2,0,0]=4 143 B8R1.50 CC1=C(C)C(N)=NO1 A12569 [1,0,0,0,1,0|2,0,0]=4 144 B8R1.50 CC1=NNC(C)=C1Br B8009 [1,0,0,0,1,0|2,0,0]=4 145 B8R1.50 CC1=NOC(C)=C1Br B8044 [1,0,0,0,1,0|2,0,0]=4 146 B8R1.50 CC1=NOC(C)=C1N A18208 [1,0,0,0,1,0|2,0,0]=4 147 B8R1.50 CC1=NOC(N)=C1C A11501 [1,0,0,0,1,0|2,0,0]=4