0 B10R1.1 C=COC1=CC=C(N)C=C1 7199AC [0,0,0,0,0,0|3,0,1]=4 1 B10R1.1 CC1=CC=C(N=[N+]=[N-])C=C1 0054AQ [0,0,0,0,0,0|3,0,1]=4 2 B10R1.1 CC1=NC=C(CNN)C=C1 0436AA [0,0,0,0,0,0|3,0,0]=3 3 B10R1.1 CNCC1=CN=C(Cl)C=C1 9683AL [0,0,0,0,0,0|4,0,0]=4 4 B10R1.1 CSCC1=CN=C(Cl)C=C1 7608AC [0,0,0,0,0,0|4,0,0]=4 5 B10R1.1 NCCC1=CN=C(Br)C=C1 5186AC [0,0,0,0,0,0|2,0,0]=2 6 B10R1.1 NCCC1=CN=C(Cl)C=C1 7778AB [0,0,0,0,0,0|2,0,0]=2 7 B10R1.1 O=CNC1=CC=C(Br)C=C1 1242AQ [0,0,0,0,0,0|3,0,1]=4 8 B10R1.1 [N-]=[N+]=NC1=CC=C(Br)C=C1 0041AQ [0,0,0,0,0,0|3,0,1]=4 9 B10R1.1 [N-]=[N+]=NC1=CC=C(Cl)C=C1 0043AQ [0,0,0,0,0,0|3,0,1]=4 10 B10R1.1 [N-]=[N+]=NC1=CC=C(F)C=C1 0045AQ [0,0,0,0,0,0|3,0,1]=4 11 B9R1.1 CC1=NC=C(CN)C=N1 6982AA [1,0,0,0,0,0|3,0,0]=4 12 B9R1.1 CCC1=CC=C(Cl)N=N1 2240AJ [1,0,0,0,0,0|3,0,0]=4 13 B9R1.1 CCC1=CN=C(Cl)C=C1 1065AA [1,0,0,0,0,0|2,0,0]=3 14 B9R1.1 CCC1=NC=C(Br)C=N1 W8957 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.1 CCC1=NC=C(C)C=C1 9500AA [1,0,0,0,0,0|2,0,0]=3 16 B9R1.1 CSC1=CN=C(N)C=C1 2168AC [1,0,0,0,0,0|3,0,0]=4 17 B9R1.1 ClC1=CN=C(CBr)C=C1 9045AB [1,0,0,0,0,0|3,0,0]=4 18 B9R1.1 FC1=NC=C(CBr)C=C1 Y6935 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.1 NC1=CC=C(C=O)C=C1 L628 [1,0,0,0,0,0|2,0,1]=4 20 B9R1.1 NCC1=CC=C(Br)N=C1 4185AA [1,0,0,0,0,0|2,0,0]=3 21 B9R1.1 NCC1=CN=C(Cl)C=C1 8881AH [1,0,0,0,0,0|2,0,0]=3 22 B9R1.1 NCC1=CN=C(N)C=C1 4936AD [1,0,0,0,0,0|2,0,0]=3 23 B9R1.1 NCC1=CN=C(N)N=C1 0341AC [1,0,0,0,0,0|3,0,0]=4 24 B9R1.1 NCC1=NC=C(F)C=N1 3894AJ [1,0,0,0,0,0|3,0,0]=4 25 B9R1.1 NCC1=NC=C(F)C=N1 8843AH [1,0,0,0,0,0|3,0,0]=4 26 B9R1.1 NNC1=NC=C(F)C=C1 Y2066 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.8 C#C[I+]C1=CC=CC=C1 7930AL [1,0,0,0,0,0|2,0,1]=4 28 B9R1.8 CNCC1=CN=CC=C1 7435AH [1,0,0,0,0,0|3,0,0]=4 29 B9R1.8 ClC#CC1=CC=CC=C1 0032AQ [1,0,0,0,0,0|1,0,2]=4 30 B9R1.8 ClCCC1=CC=NC=C1 2738AB [1,0,0,0,0,0|2,0,0]=3 31 B9R1.8 ClCCC1=CN=CC=C1 5261AB [1,0,0,0,0,0|2,0,0]=3 32 B9R1.8 Cl[Mg]CC1=CC=CC=C1 8408AJ [1,0,0,0,0,0|2,0,0]=3 33 B9R1.8 IC#CC1=CC=CC=C1 0175AQ [1,0,0,0,0,0|1,0,2]=4 34 B9R1.8 NCCC1=CN=CN=C1 3332AC [1,0,0,0,0,0|2,0,0]=3 35 B9R1.8 NCCC1=NC=CC=N1 4806AC [1,0,0,0,0,0|2,0,0]=3 36 B9R1.8 NCCC1=NC=NC=C1 1885AJ [1,0,0,0,0,0|2,0,0]=3 37 B9R1.8 NCCC1=NC=NC=C1 1886AJ [1,0,0,0,0,0|2,0,0]=3 38 B9R1.8 NNCC1=CC=CC=N1 4874AC [1,0,0,0,0,0|2,0,0]=3 39 B9R1.8 NNCC1=NC=CN=C1 1808AL [1,0,0,0,0,0|3,0,0]=4 40 B9R1.8 NNCC1=NC=CN=C1 5211AA [1,0,0,0,0,0|3,0,0]=4 41 B9R1.8 O=CCC1=CC=CN=C1 5877AB [1,0,0,0,0,0|2,0,1]=4 42 B9R1.8 OCCC1=NC=CC=N1 1887AJ [1,0,0,0,0,0|3,0,0]=4 43 B9R1.8 OCCC1=NC=NC=C1 0497AC [1,0,0,0,0,0|3,0,0]=4 44 B9R1.8 O\N=C/C1=CC=CC=C1 9354AB [1,0,0,0,0,0|2,0,1]=4 45 B11R1.1 C=CCCC1=CC=C(Br)C=C1 4835AD [0,1,0,0,0,0|2,0,0]=3 46 B11R1.1 C=CCCC1=CC=C(Cl)C=C1 9629AD [0,1,0,0,0,0|2,0,0]=3 47 B11R1.1 CC1=CC=C(OCC#N)C=C1 6210AJ [0,1,0,0,0,0|1,0,2]=4 48 B11R1.1 CCCOC1=NC=C(Cl)C=C1 Y3728 [0,1,0,0,0,0|3,0,0]=4 49 B11R1.1 CCOCC1=CC=C(O)C=C1 Z4904 [0,1,0,0,0,0|1,0,0]=2 50 B11R1.1 CCOCC1=CN=C(N)C=C1 Y4084 [0,1,0,0,0,0|3,0,0]=4 51 B11R1.1 CNCCC1=CC=C(C)C=C1 1463AB [0,1,0,0,0,0|1,0,0]=2 52 B11R1.1 COCOC1=CC=C(C)C=C1 2069AB [0,1,0,0,0,0|3,0,0]=4 53 B11R1.1 N#CNCC1=CC=C(Cl)C=C1 0136AE [0,1,0,0,0,0|1,0,2]=4 54 B11R1.1 NC1=CC=C(CCCO)C=C1 2833AC [0,1,0,0,0,0|2,0,0]=3 55 B11R1.1 O=CCCC1=CC=C(Cl)C=C1 1755AC [0,1,0,0,0,0|2,0,0]=3 56 B11R1.1 OCCCC1=CC=C(Cl)N=C1 2859AA [0,1,0,0,0,0|3,0,0]=4 57 B11R1.20 C=C(Br)CC1=CC=C(Cl)C=C1 3636AF [0,1,0,0,0,0|2,0,1]=4 58 B11R1.20 CC(N)CC1=CC=C(O)C=C1 2498AL [0,1,0,0,0,0|0,0,0]=1 59 B11R1.20 CC1=CC=C(NC(C)C)C=C1 7984AC [0,1,0,0,0,0|3,0,0]=4 60 B11R1.20 FC1=CC=C(OC(F)F)C=C1 1094AE [0,1,0,0,0,0|3,0,0]=4 61 B11R1.22 CC(CN)C1=CC=C(Cl)C=C1 1725AC [0,1,0,0,0,0|1,0,0]=2 62 B11R1.22 CCC(O)C1=CC=C(Br)C=C1 1423AL [0,1,0,0,0,0|2,0,0]=3 63 B11R1.22 NC(CO)C1=CC=C(F)C=N1 1539AA [0,1,0,0,0,0|3,0,0]=4 64 B11R1.22 NC1=CC=C(C(=O)CCl)C=C1 2322AB [0,1,0,0,0,0|2,0,1]=4 65 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 X3150 [0,1,0,0,0,0|2,0,0]=3 66 B11R1.81 CCOC1=CC=C(Cl)C=C1Br Y3880 [0,1,0,0,0,0|3,0,0]=4 67 B11R1.81 CCOC1=CC=C(F)C=C1O Z0556 [0,1,0,0,0,0|3,0,0]=4 68 B11R1.81 O=CCC1=CC=C(Br)C=C1F 3153AF [0,1,0,0,0,0|2,0,1]=4 69 B11R1.83 CCC1=CN=C(CCN)C=C1 3531AA [0,1,0,0,0,0|2,0,0]=3 70 B11R1.83 CCOC1=CC=C(CCl)C=C1 7680AE [0,1,0,0,0,0|3,0,0]=4 71 B11R1.83 COC1=CN=C(CCN)C=C1 1340AA [0,1,0,0,0,0|1,0,0]=2 72 B11R1.83 N#CCC1=CC=C(CCl)C=C1 A717 [0,1,0,0,0,0|1,0,2]=4 73 B11R1.83 O=CC1=CC=C(CCO)C=C1 8288AA [0,1,0,0,0,0|1,0,1]=3 74 B11R1.192 CC1=CC=C(CCN)C=C1C 8902AA [0,1,0,0,0,0|1,0,0]=2 75 B11R1.192 CCNC1=CC(C)=C(C)C=C1 8938AD [0,1,0,0,0,0|3,0,0]=4 76 B11R1.192 N#CCC1=CC(Br)=C(N)C=C1 1571AF [0,1,0,0,0,0|1,0,2]=4 77 B11R1.192 N#CCC1=CC=C(I)C(F)=C1 5668AC [0,1,0,0,0,0|1,0,2]=4 78 B11R2.34 ClC1=CC=C(C2CO2)C=C1 0625AQ [0,0,0,1,0,0|2,0,0]=3 79 B11R2.34 OC1=CN=C(C2CC2)N=C1 1471AC [0,0,0,1,0,0|3,0,0]=4 80 B11R2.36 CC1=CC2=C(CCC2)N=C1 2832AB [0,0,0,1,0,0|3,0,0]=4 81 B11R2.36 ClC1=CC=C2CCOC2=C1 3499AJ [0,0,0,1,0,0|2,0,0]=3 82 B11R2.36 ClC1=CN=C2CCCC2=C1 5171AA [0,0,0,1,0,0|3,0,0]=4 83 B11R2.36 IC1=CC=C2CNCC2=C1 5068AC [0,0,0,1,0,0|3,0,0]=4 84 B11R2.36 NC1=CC2=C(C=C1)CCC2 2198AC [0,0,0,1,0,0|2,0,0]=3 85 B11R2.36 NC1=CC2=C(C=C1)NCC2 5784AH [0,0,0,1,0,0|3,0,0]=4 86 B11R2.36 OC1=CC2=CON=C2C=C1 6260AB [0,0,0,1,0,0|3,0,0]=4 87 B9R1.7 CC1=CN(CCN)N=C1 7229AC [0,0,0,0,1,0|3,0,0]=4 88 B9R1.7 CC1=CN=C(CCN)S1 3258AF [0,0,0,0,1,0|3,0,0]=4 89 B9R1.7 CC1=NC(CCN)=CN1 4612AB [0,0,0,0,1,0|3,0,0]=4 90 B9R1.7 CC1=NC=C(CCN)N1 3349AC [0,0,0,0,1,0|3,0,0]=4 91 B9R1.7 CC1=NN(CCN)C=C1 6993AE [0,0,0,0,1,0|3,0,0]=4 92 B9R1.7 NCCC1=CSC(N)=N1 4600AA [0,0,0,0,1,0|3,0,0]=4 93 B9R1.7 NNCC1=CC=C(Cl)S1 1543AL [0,0,0,0,1,0|3,0,0]=4 94 B8R1.2 ClCC1=CC=CC=N1 V2306 [2,0,0,0,0,0|2,0,0]=4 95 B8R1.2 NCC1=CN=CN=C1 W4845 [2,0,0,0,0,0|2,0,0]=4 96 B8R1.2 NCC1=NC=CC=N1 4855AH [2,0,0,0,0,0|2,0,0]=4 97 B8R1.2 NCC1=NC=CN=C1 9838AJ [2,0,0,0,0,0|2,0,0]=4 98 B8R1.2 NNC1=CC=CN=C1 Z1664 [2,0,0,0,0,0|2,0,0]=4 99 B8R1.2 OCC1=CC=NC=C1 D932 [2,0,0,0,0,0|2,0,0]=4 100 B8R1.2 OCC1=NC=CC=C1 D931 [2,0,0,0,0,0|2,0,0]=4 101 B8R1.3 C[N+]1=CC=C(N)C=C1 9467AE [2,0,0,0,0,0|2,0,0]=4 102 B10R1.3 C=CC1=NC=C(CC)C=C1 7768AB [1,1,0,0,0,0|2,0,0]=4 103 B10R1.3 COC1=CN=C(CCl)C=C1 1704AC [1,1,0,0,0,0|2,0,0]=4 104 B10R1.3 CSC1=CC=C(C#N)C=C1 D346 [1,1,0,0,0,0|2,0,0]=4 105 B10R1.3 NCC1=CC=C(CBr)C=C1 9484AE [1,1,0,0,0,0|1,0,0]=3 106 B10R1.3 NCC1=CC=C(CCl)C=C1 9520AE [1,1,0,0,0,0|1,0,0]=3 107 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 O022 [1,1,0,0,0,0|2,0,0]=4 108 B10R1.13 CC1=CN=C(C(C)C)C=C1 1750AJ [1,1,0,0,0,0|2,0,0]=4 109 B10R1.13 C[C@@H](N)C1=CC=C(I)C=C1 W7028 [1,1,0,0,0,0|1,0,0]=3 110 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 W7688 [1,1,0,0,0,0|1,0,0]=3 111 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y6478 [1,1,0,0,0,0|2,0,0]=4 112 B10R1.25 CC1=C(NN)C=CC(Cl)=C1 0145AB [1,1,0,0,0,0|2,0,0]=4 113 B10R1.25 COC1=CC=C(C)C=C1F Z0570 [1,1,0,0,0,0|2,0,0]=4 114 B10R1.25 CSC1=CC=C(F)C=C1O Y3948 [1,1,0,0,0,0|2,0,0]=4 115 B10R1.25 NCC1=NC=C(Cl)C=C1F 4863AA [1,1,0,0,0,0|2,0,0]=4 116 B10R1.25 NNC1=C(Cl)C=C(I)C=C1 3038AB [1,1,0,0,0,0|2,0,0]=4 117 B10R1.25 NNC1=C(I)C=C(Cl)C=C1 3037AB [1,1,0,0,0,0|2,0,0]=4 118 B10R1.25 NNC1=CC=C(Br)C=C1F 8750AH [1,1,0,0,0,0|2,0,0]=4 119 B10R1.25 NNC1=CC=C(F)C=C1Br X6575 [1,1,0,0,0,0|2,0,0]=4 120 B10R1.176 CC1=CC(CCl)=CC=C1Br V3412 [1,1,0,0,0,0|2,0,0]=4 121 B10R1.176 CC1=CC(CN)=NC=C1Br 4770AJ [1,1,0,0,0,0|2,0,0]=4 122 B10R1.176 CCC1=CC(O)=C(O)C=C1 2184AA [1,1,0,0,0,0|0,0,0]=2 123 B10R1.176 CCC1=CC=C(O)C(C)=N1 X8291 [1,1,0,0,0,0|1,0,0]=3 124 B10R1.176 FC1=CC=C(CCl)C=C1I 3358AD [1,1,0,0,0,0|2,0,0]=4 125 B10R1.176 NCC1=CC=C(N)C(O)=C1 1512AJ [1,1,0,0,0,0|1,0,0]=3 126 B10R1.176 O=C1C=C(CO)NC=C1O Y3273 [1,1,0,0,0,0|2,0,0]=4 127 B10R1.176 O=C1C=C(C[O-])OC=C1O 8125AL [1,1,0,0,0,0|2,0,0]=4 128 B10R1.176 OCC1=CC=C(F)C(I)=C1 7762AD [1,1,0,0,0,0|2,0,0]=4 129 B10R1.176 OCC1=CC=C(O)C(Br)=N1 5393AD [1,1,0,0,0,0|2,0,0]=4 130 B10R1.4 C=CCC1=C(Cl)C=CC=C1 7969AA [1,1,0,0,0,0|1,0,1]=4 131 B10R1.4 C=CCC1=C(F)C=CC=C1 5696AE [1,1,0,0,0,0|1,0,1]=4 132 B10R1.4 CC1=CC=CC=C1CC=O 7409AC [1,1,0,0,0,0|1,0,1]=4 133 B10R1.4 ClCOC1=C(Cl)C=CC=C1 8609AB [1,1,0,0,0,0|2,0,0]=4 134 B10R1.4 NC1=NC=CC=C1CCO 6447AC [1,1,0,0,0,0|2,0,0]=4 135 B10R1.4 NCCC1=C(F)C=CC=N1 1108AJ [1,1,0,0,0,0|1,0,0]=3 136 B10R1.4 NCCN1C=CC=CC1=O Y8846 [1,1,0,0,0,0|1,0,0]=3 137 B10R1.4 NOCC1=CC=CC=C1Br 7199AB [1,1,0,0,0,0|1,0,0]=3 138 B10R1.4 O=C1C=CC=CN1CCCl 7140AB [1,1,0,0,0,0|2,0,0]=4 139 B10R1.4 O=CCC1=CC=CC=C1Br X2126 [1,1,0,0,0,0|1,0,1]=4 140 B10R1.4 O=CCC1=CC=CC=C1Cl 5867AB [1,1,0,0,0,0|1,0,1]=4 141 B10R1.10 C=CCC1=CC(O)=CC=C1 5771AJ [1,1,0,0,0,0|1,0,1]=4 142 B10R1.10 C=CCC1=CC=CC(C)=C1 0989AQ [1,1,0,0,0,0|1,0,1]=4 143 B10R1.10 CC1=CC(CC=O)=CC=C1 8853AE [1,1,0,0,0,0|1,0,1]=4 144 B10R1.10 CC1=NC=CC(CCN)=C1 Y9654 [1,1,0,0,0,0|1,0,0]=3 145 B10R1.10 CC1=NC=CC(CNN)=C1 2499AD [1,1,0,0,0,0|2,0,0]=4 146 B10R1.10 CCCC1=CC(F)=CC=C1 2809AB [1,1,0,0,0,0|1,0,0]=3 147 B10R1.10 CCCC1=CC(N)=NC=C1 2921AJ [1,1,0,0,0,0|2,0,0]=4 148 B10R1.10 CCCC1=NC=CC(Cl)=C1 2766AJ [1,1,0,0,0,0|2,0,0]=4 149 B10R1.10 CCCC1=NC=CC(Cl)=C1 Z2848 [1,1,0,0,0,0|2,0,0]=4 150 B10R1.10 N#CCC1=CC(N)=CC=C1 2233AA [1,1,0,0,0,0|0,0,2]=4 151 B10R1.10 NCCC1=CC(Br)=CN=C1 1207AJ [1,1,0,0,0,0|1,0,0]=3 152 B10R1.10 NCCC1=NC(Cl)=CC=C1 5821AC [1,1,0,0,0,0|1,0,0]=3 153 B10R1.10 NNCC1=CC=CC(O)=C1 W8565 [1,1,0,0,0,0|1,0,0]=3 154 B10R1.10 NOCC1=CC(Br)=CC=C1 7993AA [1,1,0,0,0,0|1,0,0]=3 155 B10R1.10 O=CCC1=CC(Cl)=CC=C1 3014AE [1,1,0,0,0,0|1,0,1]=4 156 B10R1.10 O=CCC1=CC(F)=CC=C1 9224AE [1,1,0,0,0,0|1,0,1]=4 157 B10R1.10 O=CCC1=CC=CC(Br)=C1 Y7020 [1,1,0,0,0,0|1,0,1]=4 158 B10R1.15 C=C(CBr)C1=CC=CC=C1 Z4610 [1,1,0,0,0,0|1,0,1]=4 159 B10R1.15 C[C@@H](NO)C1=CC=CC=C1 1195AL [1,1,0,0,0,0|2,0,0]=4 160 B10R1.15 N#C[C@@H](O)C1=CC=CC=C1 2803AB [1,1,0,0,0,0|0,0,2]=4 161 B10R1.15 NC(CO)C1=CC=CC=N1 1469AJ [1,1,0,0,0,0|2,0,0]=4 162 B10R1.15 NC(CO)C1=CC=NC=C1 1231AC [1,1,0,0,0,0|2,0,0]=4 163 B10R1.15 NCC(=O)C1=CC=NC=C1 1463AJ [1,1,0,0,0,0|1,0,1]=4 164 B10R1.15 NCC(=O)C1=NC=CC=C1 1454AJ [1,1,0,0,0,0|1,0,1]=4 165 B10R1.15 NCC(=O)C1=NC=CC=C1 1462AJ [1,1,0,0,0,0|1,0,1]=4 166 B10R1.15 NCC(O)C1=CC=CC=C1 3929AE [1,1,0,0,0,0|0,0,0]=2 167 B10R1.15 NCC(O)C1=CC=NC=C1 1456AJ [1,1,0,0,0,0|1,0,0]=3 168 B10R1.15 NC[C@@H](F)C1=CC=CC=C1 0407AQ [1,1,0,0,0,0|0,0,0]=2 169 B10R1.15 O=CC(Br)C1=CC=CC=C1 8662AA [1,1,0,0,0,0|1,0,1]=4 170 B10R1.17 BrCCCC1=CN=CC=C1 8653AC [1,1,0,0,0,0|2,0,0]=4 171 B10R1.17 C#CCNC1=CC=CC=C1 6094AD [1,1,0,0,0,0|1,0,1]=4 172 B10R1.17 COCOC1=CC=CC=C1 0189AF [1,1,0,0,0,0|2,0,0]=4 173 B10R1.17 NCCNC1=CN=CC=N1 6077AB [1,1,0,0,0,0|2,0,0]=4 174 B10R1.17 NC\C=C\C1=CC=CC=C1 5624AE [1,1,0,0,0,0|0,0,1]=3 175 B10R1.18 CC(O)CC1=CC=CC=N1 5034AE [1,1,0,0,0,0|2,0,0]=4 176 B10R1.18 N=C(N)CC1=CN=CC=C1 4101AE [1,1,0,0,0,0|1,0,1]=4 177 B12R1.1 NCCNCC1=CC=C(F)C=C1 7048AD [0,2,0,0,0,0|1,0,0]=3 178 B12R1.1 OCCNCC1=CC=C(Br)C=C1 Z2388 [0,2,0,0,0,0|2,0,0]=4 179 B12R1.16 CC1=CC=C([C@@H](N)CCO)C=C1 1299AL [0,2,0,0,0,0|2,0,0]=4 180 B12R1.16 CCC[C@H](N)C1=CC=C(F)C=C1 W5405 [0,2,0,0,0,0|2,0,0]=4 181 B12R1.21 CC(=O)CCC1=CC=C(Br)C=C1 2246AF [0,2,0,0,0,0|2,0,0]=4 182 B12R1.21 CC(N)COC1=CC=C(Cl)C=C1 7946AD [0,2,0,0,0,0|1,0,0]=3 183 B12R1.21 CN(C)CCC1=CC=C(Br)C=C1 7634AA [0,2,0,0,0,0|1,0,0]=3 184 B12R1.21 O=C(O)CCC1=CC=C(S)C=C1 6555AL [0,2,0,0,0,0|1,1,0]=4 185 B12R1.49 CC1=CC=C(OC(C)CN)C=C1 7330AE [0,2,0,0,0,0|1,0,0]=3 186 B12R1.49 CNC(=O)NC1=CC=C(O)C=C1 5000AB [0,2,0,0,0,0|1,0,1]=4 187 B12R1.49 N[C@@H](CO)CC1=CC=C(F)C=C1 4252AB [0,2,0,0,0,0|1,0,0]=3 188 B12R1.49 N[C@@H](CO)CC1=CC=C(I)C=C1 0762AB [0,2,0,0,0,0|1,0,0]=3 189 B12R1.69 C=CCCC1=C(Cl)C=C(Cl)C=C1 9628AD [0,2,0,0,0,0|2,0,0]=4 190 B12R1.69 CCCOC1=C(N)C=C(C)C=C1 8328AE [0,2,0,0,0,0|2,0,0]=4 191 B12R1.69 NCCOC1=CC=C(Cl)C=C1Cl 0819AD [0,2,0,0,0,0|1,0,0]=3 192 B12R1.71 C=CCCC1=CC=C(OC)C=C1 6964AD [0,2,0,0,0,0|1,0,0]=3 193 B12R1.71 COC1=CC=C(CCC=O)C=C1 0461AB [0,2,0,0,0,0|1,0,0]=3 194 B12R1.71 COC1=CC=C(CCCN)C=C1 4617AB [0,2,0,0,0,0|0,0,0]=2 195 B12R1.385 CC1=CC(OCCBr)=CC=C1Cl 7329AE [0,2,0,0,0,0|2,0,0]=4 196 B12R1.385 NCCCC1=CC(F)=C(F)C=C1 1958AE [0,2,0,0,0,0|1,0,0]=3 197 B12R1.20 CC(C)[C@H](N)C1=CC=C(F)C=C1 3802AA [0,2,0,0,0,0|2,0,0]=4 198 B12R1.106 CC1=CC=C(CS(N)(=O)=O)C=C1 7376AE [0,2,0,0,0,0|2,0,0]=4 199 B12R1.5 CC[C@@H](N)C1=CC=C(OC)C=C1 W5875 [0,2,0,0,0,0|1,0,0]=3 200 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 L175 [0,2,0,0,0,0|0,0,1]=3 201 B12R1.367 CC[C@@H](N)C1=CC(F)=C(F)C=C1 0504AF [0,2,0,0,0,0|2,0,0]=4 202 B12R1.367 CC[C@@H](N)C1=CC=C(Cl)C(Cl)=C1 9072AE [0,2,0,0,0,0|2,0,0]=4 203 B12R1.1703 CC[C@@H](N)C1=CC=C(F)C=C1F 4783AA [0,2,0,0,0,0|2,0,0]=4 204 B12R1.1095 CC1=CC(C)=C(CCN)C(C)=C1 1024AQ [0,2,0,0,0,0|1,0,0]=3 205 B12R1.1095 CC1=CC(C)=C(CNN)C(C)=C1 4315AD [0,2,0,0,0,0|2,0,0]=4 206 B12R1.1095 CCOC1=C(Cl)C=C(O)C=C1Cl Z1040 [0,2,0,0,0,0|2,0,0]=4 207 B12R1.113 CC(C)C1=CC=C(CCN)C=C1 1177AJ [0,2,0,0,0,0|1,0,0]=3 208 B12R1.116 BrCCC1=CC=C(CCBr)C=C1 6255AB [0,2,0,0,0,0|2,0,0]=4 209 B12R1.116 CCOC1=CC=C(CC=O)C=C1 5989AB [0,2,0,0,0,0|1,0,1]=4 210 B12R1.288 CNCC1=CC=C(OC)C(Br)=C1 8628AH [0,2,0,0,0,0|2,0,0]=4 211 B12R1.288 CNCC1=CC=C(OC)C(Br)=C1 8629AH [0,2,0,0,0,0|2,0,0]=4 212 B12R1.288 COC1=C(Br)C=C(CCN)C=C1 5058AD [0,2,0,0,0,0|0,0,0]=2 213 B12R1.288 COC1=C(C)C=C(CCN)C=C1 6092AD [0,2,0,0,0,0|0,0,0]=2 214 B12R1.286 CCOC1=CC(C=O)=C(O)C=C1 0000AF [0,2,0,0,0,0|2,0,0]=4 215 B10R2.6 C1=CC(C2CC2)=CN=C1 Y1556 [1,0,0,1,0,0|2,0,0]=4 216 B10R2.7 C1=CC2=C(C=N1)CCC2 7574AB [1,0,0,1,0,0|2,0,0]=4 217 B10R2.7 C1=CC2=C(C=N1)CCN2 1362AJ [1,0,0,1,0,0|1,0,0]=3 218 B10R2.7 C1=CC=C2SCOC2=C1 2605AB [1,0,0,1,0,0|2,0,0]=4 219 B12R2.24 BrC1=CC2=C(N=C1)NCCN2 3659AJ [0,1,0,1,0,0|2,0,0]=4 220 B12R2.24 ClC1=CC2=C(C=C1)COCC2 2268AC [0,1,0,1,0,0|2,0,0]=4 221 B12R2.24 ClC1=CC2=C(C=N1)CCNC2 1388AA [0,1,0,1,0,0|2,0,0]=4 222 B12R2.24 ClC1=CC2=C(CCNC2)N=C1 X5472 [0,1,0,1,0,0|2,0,0]=4 223 B12R2.24 NC1=CC2=C(C=C1)CNCC2 1216AC [0,1,0,1,0,0|2,0,0]=4 224 B12R2.24 NC1=CC2=C(CCNC2)N=C1 Y6674 [0,1,0,1,0,0|2,0,0]=4 225 B12R2.24 NC1=CC=C2CCCNC2=C1 9585AH [0,1,0,1,0,0|1,0,0]=3 226 B12R2.24 NC1=CC=C2NCCCC2=C1 9584AH [0,1,0,1,0,0|2,0,0]=4 227 B12R2.24 NC1=CC=C2NCCNC2=C1 0199AC [0,1,0,1,0,0|1,0,0]=3 228 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 1156AJ [0,1,0,1,0,0|1,0,0]=3 229 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 5076AC [0,1,0,1,0,0|1,0,0]=3 230 B12R2.79 NC1CC1C2=CC=C(Cl)C=C2 1164AJ [0,1,0,1,0,0|1,0,0]=3 231 B12R2.79 NC1CC1C2=CC=C(F)C=C2 1174AJ [0,1,0,1,0,0|1,0,0]=3 232 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(F)C=C2 8367AH [0,1,0,1,0,0|1,0,0]=3 233 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 8409AH [0,1,0,1,0,0|1,0,0]=3 234 B12R2.132 CC1=CC2=C(C=C1)CCC2O 0306AB [0,1,0,1,0,0|2,0,0]=4 235 B12R2.132 NC1=CC=C2CCC(O)C2=C1 3419AJ [0,1,0,1,0,0|2,0,0]=4 236 B12R2.132 NC1CCC2=CC=C(Br)C=C21 3445AJ [0,1,0,1,0,0|1,0,0]=3 237 B12R2.132 NC1CCC2=CC=C(Cl)C=C21 3497AJ [0,1,0,1,0,0|1,0,0]=3 238 B12R2.132 NC1COC2=CC=C(Br)C=C21 3113AJ [0,1,0,1,0,0|1,0,0]=3 239 B12R2.132 NC1COC2=CC=C(F)C=C21 5848AH [0,1,0,1,0,0|1,0,0]=3 240 B12R2.132 N[C@@H]1CCC2=C1C=C(F)C=C2 W8477 [0,1,0,1,0,0|1,0,0]=3 241 B12R2.132 N[C@@H]1CCC2=CC=C(Br)C=C21 8360AH [0,1,0,1,0,0|1,0,0]=3 242 B12R2.132 N[C@@H]1CCC2=CC=C(Br)C=C21 9025AH [0,1,0,1,0,0|1,0,0]=3 243 B12R2.132 N[C@@H]1COC2=CC=C(Br)C=C21 8693AH [0,1,0,1,0,0|1,0,0]=3 244 B12R2.132 O=C1NCC2=C1C=C(O)C=C2 0124AC [0,1,0,1,0,0|1,0,1]=4 245 B12R2.294 IC1=CC=C(OC2CC2)C=C1 3012AD [0,1,0,1,0,0|2,0,0]=4 246 B12R2.2302 BrC1=CC=C(C2CNC2)C=C1 2229AL [0,1,0,1,0,0|1,0,0]=3 247 B12R2.2302 FC1=CC=C(C2CNC2)C=C1 2234AL [0,1,0,1,0,0|1,0,0]=3 248 B12R2.606 O=C1CC2=C(C=C(I)C=C2)N1 X6110 [0,1,0,1,0,0|1,0,1]=4 249 B12R2.290 CC1=CC=C(C2(N)CC2)C=C1 6903AB [0,1,0,1,0,0|2,0,0]=4 250 B12R2.290 NC1=CC=C(C2(N)CC2)C=C1 2414AJ [0,1,0,1,0,0|2,0,0]=4 251 B12R2.612 CC1=CNC2=CC(O)=CC=C12 2446AL [0,1,0,1,0,0|0,0,2]=4 252 B12R2.612 NC1CCC2=C1C=CC(F)=C2 7424AA [0,1,0,1,0,0|2,0,0]=4 253 B12R2.612 NC1CCC2=CC(Cl)=CC=C21 3177AJ [0,1,0,1,0,0|2,0,0]=4 254 B12R2.612 NC1COC2=C1C=CC(Br)=C2 6155AC [0,1,0,1,0,0|2,0,0]=4 255 B12R2.612 NC1COC2=CC(Cl)=CC=C21 3496AJ [0,1,0,1,0,0|2,0,0]=4 256 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 X8974 [0,1,0,1,0,0|2,0,0]=4 257 B12R2.612 N[C@H]1COC2=CC(Cl)=CC=C21 8672AH [0,1,0,1,0,0|2,0,0]=4 258 B12R2.612 OC1=CC2=C(C=C1)C(O)CC2 4876AB [0,1,0,1,0,0|1,0,0]=3 259 B12R2.246 CC1=CC(O)=CC2=C1C=NN2 4366AC [0,1,0,1,0,0|1,0,1]=4 260 B12R2.246 ClC1=CC2=C(CCN2)C(Cl)=C1 5039AC [0,1,0,1,0,0|1,0,0]=3 261 B12R2.246 OC1=CC2=C(C=NN2)C(Br)=C1 Z3756 [0,1,0,1,0,0|1,0,1]=4 262 B12R2.9 N#CC1=CC=C(C2CC2)C=C1 2199AA [0,1,0,1,0,0|2,0,0]=4 263 B12R2.44 C#CC1=CC2=C(C=C1)CCC2 3337AH [0,1,0,1,0,0|2,0,0]=4 264 B12R2.44 NCC1=CC2=C(C=C1)CCC2 X2082 [0,1,0,1,0,0|2,0,0]=4 265 B12R2.44 O=CC1=CC=C2CCNC2=C1 3132AA [0,1,0,1,0,0|0,0,1]=3 266 B12R2.82 OC1=CC=C2C=NNC2=C1I 3220AA [0,1,0,1,0,0|1,0,1]=4 267 B12R2.100 OC1=CC2=C(C=C1O)OCO2 7300AD [0,1,0,1,0,0|2,0,0]=4 268 B12R2.291 ClC1=C(Cl)C=C(C2CO2)C=C1 1729AL [0,1,0,1,0,0|2,0,0]=4 269 B8R1.1 NCC1=CC(Cl)=CS1 0924AB [1,0,0,0,1,0|2,0,0]=4 270 B8R1.1 NCC1=CC=C(Br)O1 4771AJ [1,0,0,0,1,0|2,0,0]=4 271 B8R1.1 NCC1=CSC(Cl)=C1 6085AC [1,0,0,0,1,0|2,0,0]=4 272 B8R1.8 BrCCC1=CC=CO1 1031AJ [1,0,0,0,1,0|2,0,0]=4 273 B8R1.8 NCCC1=CON=C1 1755AJ [1,0,0,0,1,0|2,0,0]=4