0 B9R1.11 CCC(=O)C1=CC=CO1 Z5507 [0,0,0,0,0,0|1,0,0]=1 1 B9R1.11 COC(=O)C1=CNN=C1 9533AA [0,0,0,0,0,0|3,0,0]=3 2 B9R1.11 COC(=O)C1=NC=CO1 3452AB [0,0,0,0,0,0|1,0,0]=1 3 B9R1.11 CSC(=O)C1=CSC=N1 V9051 [0,0,0,0,0,0|2,1,0]=3 4 B9R1.11 N#CC(=O)C1=CC=CO1 9015AB [0,0,0,0,0,0|2,0,0]=2 5 B9R1.11 N#CC(=O)C1=CC=CS1 6481AE [0,0,0,0,0,0|2,1,0]=3 6 B9R1.11 NNC(=O)C1=CC=NN1 8723AD [0,0,0,0,0,0|4,0,0]=4 7 B9R1.11 NNC(=O)C1=CN=CO1 7607AH [0,0,0,0,0,0|3,0,0]=3 8 B9R1.11 NNC(=O)C1=COC=N1 Y5608 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.11 NNC(=O)C1=CSC=C1 2321AE [0,0,0,0,0,0|4,0,0]=4 10 B9R1.11 NNC(=O)C1=NC=CS1 Y7769 [0,0,0,0,0,0|3,1,0]=4 11 B9R1.11 N\C(=N/O)C1=CC=CO1 2252AB [0,0,0,0,0,0|3,0,0]=3 12 B9R1.11 O=C(CBr)C1=CSC=N1 3999AJ [0,0,0,0,0,0|4,0,0]=4 13 B9R1.11 O=C(CBr)C1=NC=CS1 6733AD [0,0,0,0,0,0|3,1,0]=4 14 B9R1.11 O=C(CCl)C1=NC=CO1 1641AJ [0,0,0,0,0,0|3,0,0]=3 15 B9R1.11 O=CC(=O)C1=CC=CO1 8783AA [0,0,0,0,0,0|2,0,0]=2 16 B9R1.11 O=CC(=O)C1=CC=CS1 W3018 [0,0,0,0,0,0|2,1,0]=3 17 B8R1.7 C=C(C)C1=NC=CS1 5670AL [1,0,0,0,0,0|2,1,0]=4 18 B8R1.7 CC(=O)C1=CC=NO1 4156AC [1,0,0,0,0,0|1,0,0]=2 19 B8R1.7 CC(=O)C1=CN=CS1 5381AC [1,0,0,0,0,0|1,1,0]=3 20 B8R1.7 CC(=O)C1=NC=CO1 W8389 [1,0,0,0,0,0|1,0,0]=2 21 B8R1.7 CC(=O)C1=NC=NN1 4769AD [1,0,0,0,0,0|3,0,0]=4 22 B8R1.7 CC(=O)C1=NOC=C1 4155AC [1,0,0,0,0,0|2,0,0]=3 23 B8R1.7 CC(N)C1=CC=CS1 9580AB [1,0,0,0,0,0|1,1,1]=4 24 B8R1.7 CC(O)C1=CC=CN1 Z2357 [1,0,0,0,0,0|1,0,2]=4 25 B8R1.7 CC(O)C1=CC=CO1 0311AQ [1,0,0,0,0,0|0,0,2]=3 26 B8R1.7 NC(=O)C1=CC=CN1 V6031 [1,0,0,0,0,0|2,0,0]=3 27 B8R1.7 NC(=O)C1=CN=CO1 Y7670 [1,0,0,0,0,0|2,0,0]=3 28 B8R1.7 NC(=O)C1=CNC=C1 1113AC [1,0,0,0,0,0|3,0,0]=4 29 B8R1.7 NC(=O)C1=CNC=N1 2439AB [1,0,0,0,0,0|3,0,0]=4 30 B8R1.7 NC(=O)C1=COC=N1 Z4456 [1,0,0,0,0,0|3,0,0]=4 31 B8R1.7 NC(=O)C1=CSC=N1 Y5399 [1,0,0,0,0,0|3,0,0]=4 32 B8R1.7 NC(=O)C1=NC=CS1 X5637 [1,0,0,0,0,0|2,1,0]=4 33 B8R1.7 NC(=S)C1=CN=CO1 Y4507 [1,0,0,0,0,0|2,1,0]=4 34 B8R1.7 NC(=S)C1=NC=CO1 4442AJ [1,0,0,0,0,0|2,1,0]=4 35 B8R1.7 O=C(O)C1=COCC1 W9830 [1,0,0,0,0,0|2,0,1]=4 36 B8R1.7 O=C(O)C1=NC=CO1 Z1844 [1,0,0,0,0,0|1,0,0]=2 37 B8R1.7 O=C(O)C1=NSC=C1 6302AB [1,0,0,0,0,0|2,0,0]=3 38 B8R1.7 O=C(O)C1C=CCO1 1916AL [1,0,0,0,0,0|0,0,2]=3 39 B8R1.7 O=C(O)N1C=CC=C1 Z3516 [1,0,0,0,0,0|2,0,0]=3 40 B8R1.7 O=C([O-])C1=NC=CS1 4281AE [1,0,0,0,0,0|1,1,1]=4 41 B8R1.8 CCCC1=CC=CO1 Z5525 [1,0,0,0,0,0|1,0,1]=3 42 B8R1.8 CCNC1=CC=CS1 W4294 [1,0,0,0,0,0|2,1,0]=4 43 B8R1.8 CNCC1=CC=CO1 7008AC [1,0,0,0,0,0|1,0,1]=3 44 B8R1.8 CNCC1=CC=NO1 4172AJ [1,0,0,0,0,0|2,0,1]=4 45 B10R1.6 CNS(=O)(=O)C1=CC=CS1 5098AE [0,1,0,0,0,0|2,1,0]=4 46 B10R1.11 CCCC(=O)C1=CC=CO1 Z5524 [0,1,0,0,0,0|1,0,0]=2 47 B10R1.11 CCOC(=O)C1=CN=NS1 5606AB [0,1,0,0,0,0|2,1,0]=4 48 B10R1.11 CCOC(=O)C1=CNC=C1 Z4680 [0,1,0,0,0,0|2,0,0]=3 49 B10R1.11 CCOC(=O)C1=CON=C1 V2359 [0,1,0,0,0,0|3,0,0]=4 50 B10R1.11 CCOC(=O)C1=CSN=N1 W6026 [0,1,0,0,0,0|3,0,0]=4 51 B10R1.14 CC1=CC=C(C(=O)CCl)S1 V5115 [0,1,0,0,0,0|2,1,0]=4 52 B10R1.14 CCC(=O)C1=CC=C(C)S1 6348AE [0,1,0,0,0,0|1,1,0]=3 53 B10R1.14 CCC(N)C1=CC=C(C)O1 9845AB [0,1,0,0,0,0|2,0,1]=4 54 B10R1.14 CC[C@@H](N)C1=CC=C(C)O1 2910AH [0,1,0,0,0,0|2,0,1]=4 55 B10R1.14 CC[C@H](N)C1=CC=C(C)O1 6453AB [0,1,0,0,0,0|2,0,1]=4 56 B10R1.14 COC(=O)C1=CC(C)=CN1 0966AE [0,1,0,0,0,0|1,0,0]=2 57 B10R1.14 COC(=O)C1=CC(C)=NO1 0210AA [0,1,0,0,0,0|1,0,0]=2 58 B10R1.14 COC(=O)C1=CC(F)=CS1 0106AP [0,1,0,0,0,0|0,1,0]=2 59 B10R1.14 COC(=O)C1=CC(O)=NN1 X6430 [0,1,0,0,0,0|2,0,0]=3 60 B10R1.14 COC(=O)C1=CC=C(Cl)O1 7113AJ [0,1,0,0,0,0|0,0,0]=1 61 B10R1.14 COC(=O)C1=NN(C)N=C1 1175AA [0,1,0,0,0,0|3,0,0]=4 62 B10R1.14 COC(=O)C1=NN=C(C)O1 Z4673 [0,1,0,0,0,0|2,0,0]=3 63 B10R1.14 COC(=O)C1=NNC(=O)N1 4315AJ [0,1,0,0,0,0|3,0,0]=4 64 B10R1.14 COC(=O)C1=NNC(Cl)=N1 1039AB [0,1,0,0,0,0|3,0,0]=4 65 B10R1.14 COC(=O)[C@@H]1C=C[C@H](N)C1 Z2033 [0,1,0,0,0,0|1,0,2]=4 66 B10R1.14 COC(=O)[C@@H]1C=C[C@H](N)C1 Z2034 [0,1,0,0,0,0|1,0,2]=4 67 B10R1.14 O=C(CCl)C1=CC=C(Cl)S1 1639AJ [0,1,0,0,0,0|2,1,0]=4 68 B10R1.23 CN(C)C(=O)C1=CC=CN1 8576AE [0,1,0,0,0,0|2,0,0]=3 69 B10R1.149 CN1C=CC=C1C(=O)CCl 8011AD [0,1,0,0,0,0|3,0,0]=4 70 B10R1.149 CNC(=O)C1=C(N)C=CS1 4490AD [0,1,0,0,0,0|1,1,0]=3 71 B10R1.149 CNC(=O)C1=CC=CN1C 1103AC [0,1,0,0,0,0|2,0,0]=3 72 B10R1.149 COC(=O)C1=C(Br)NC=N1 1835AA [0,1,0,0,0,0|2,0,0]=3 73 B10R1.149 COC(=O)C1=C(Br)NN=N1 7108AJ [0,1,0,0,0,0|3,0,0]=4 74 B10R1.149 COC(=O)C1=C(Br)OC=C1 0182AB [0,1,0,0,0,0|2,0,0]=3 75 B10R1.149 COC(=O)C1=C(C)C=NO1 8607AD [0,1,0,0,0,0|1,0,0]=2 76 B10R1.149 COC(=O)C1=C(C)N=CO1 1472AB [0,1,0,0,0,0|1,0,0]=2 77 B10R1.149 COC(=O)C1=C(C)N=NS1 6151AD [0,1,0,0,0,0|2,1,0]=4 78 B10R1.149 COC(=O)C1=C(C)NN=N1 6526AE [0,1,0,0,0,0|3,0,0]=4 79 B10R1.149 COC(=O)C1=C(C)ON=C1 0060AA [0,1,0,0,0,0|3,0,0]=4 80 B10R1.149 COC(=O)C1=C(C)SC=N1 V7296 [0,1,0,0,0,0|2,0,0]=3 81 B10R1.149 COC(=O)C1=C(Cl)NN=N1 1785AF [0,1,0,0,0,0|3,0,0]=4 82 B10R1.149 COC(=O)C1=C(N)C=NN1 Z4528 [0,1,0,0,0,0|2,0,0]=3 83 B10R1.149 COC(=O)C1=C(N)ON=C1 Z3256 [0,1,0,0,0,0|3,0,0]=4 84 B10R1.149 COC(=O)C1=C(O)C=CN1 2368AC [0,1,0,0,0,0|1,0,0]=2 85 B10R1.149 COC(=O)C1=CC=CN1N 4226AA [0,1,0,0,0,0|1,0,0]=2 86 B10R1.149 COC(=O)C1=NC=NN1C 5828AE [0,1,0,0,0,0|3,0,0]=4 87 B10R1.149 COC(=O)C1=NNC=C1C 0628AC [0,1,0,0,0,0|2,0,0]=3 88 B10R1.149 COC(=O)C1=NNC=C1F X3413 [0,1,0,0,0,0|2,0,0]=3 89 B10R1.149 COC(=O)C1=NNC=C1I 6533AA [0,1,0,0,0,0|2,0,0]=3 90 B10R1.149 COC(=O)C1=NNC=C1N 4526AB [0,1,0,0,0,0|2,0,0]=3 91 B10R1.149 O=C(CBr)C1=C(Br)C=CS1 0045AF [0,1,0,0,0,0|2,1,0]=4 92 B8R0.3 C=CCC(N)C(=O)OC 4218AJ [0,0,1,0,0,0|1,0,2]=4 93 B8R0.3 C=CCC(N)C(=O)OC 4219AJ [0,0,1,0,0,0|1,0,2]=4 94 B8R0.6 C=CCCCC(=O)OC 6778AL [0,0,1,0,0,0|1,0,2]=4 95 B10R1.15 C#CC(=O)C1=CC=CC=C1 0047AQ [0,0,0,0,0,1|2,0,1]=4 96 B10R1.15 CCC(=O)C1=CC=NC=C1 8726AA [0,0,0,0,0,1|2,0,0]=3 97 B10R1.15 CCC(=O)C1=NC=CN=C1 7151AB [0,0,0,0,0,1|2,0,0]=3 98 B10R1.15 COC(=N)C1=NC=CN=C1 9109AE [0,0,0,0,0,1|2,0,0]=3 99 B10R1.15 COC(=O)C1=CCCCO1 5478AA [0,0,0,0,0,1|0,0,2]=3 100 B10R1.15 COC(=O)C1=CCOCC1 1300AA [0,0,0,0,0,1|1,0,2]=4 101 B10R1.15 COC(=O)C1CC=CCC1 9933AB [0,0,0,0,0,1|1,0,2]=4 102 B10R1.15 COC(=O)N1C=CC=CC1 3960AB [0,0,0,0,0,1|2,0,0]=3 103 B10R1.15 NCC(=O)C1=CN=CC=C1 1455AJ [0,0,0,0,0,1|3,0,0]=4 104 B10R1.15 NNC(=O)C1=CC=NC=N1 Y5417 [0,0,0,0,0,1|3,0,0]=4 105 B10R1.15 O=C(CBr)C1=CC=NC=C1 9348AB [0,0,0,0,0,1|3,0,0]=4 106 B10R1.15 O=C(CBr)C1=CN=CC=C1 9347AB [0,0,0,0,0,1|3,0,0]=4 107 B10R1.15 O=C(CBr)C1=NC=CN=C1 Z2340 [0,0,0,0,0,1|3,0,0]=4 108 B10R1.15 O=C(CCl)C1=CC=NC=C1 5498AJ [0,0,0,0,0,1|3,0,0]=4 109 B10R1.15 O=C(N[O-])C1=CC=CC=C1 8985AL [0,0,0,0,0,1|3,0,0]=4 110 B10R1.27 COC(=O)CC1=CSC=C1 3590AL [0,0,0,0,0,1|2,0,0]=3 111 B10R1.27 COC(=O)CN1C=NC=N1 8315AC [0,0,0,0,0,1|3,0,0]=4 112 B7R0.3 C=CCCC(=O)OC 0026AQ [1,0,1,0,0,0|0,0,2]=4 113 B7R0.3 CO\C=C\C(=O)OC W5649 [1,0,1,0,0,0|1,0,1]=4 114 B7R0.3 C\C=C\CC(=O)OC 9761AJ [1,0,1,0,0,0|0,0,2]=4 115 B7R0.7 C=COC(=O)\C=C\C E081 [1,0,1,0,0,0|2,0,0]=4 116 B7R0.10 C=C(CCl)C(=O)OC X7009 [1,0,1,0,0,0|1,0,1]=4 117 B7R0.10 COC(=O)\C(C)=C\Br 1158AL [1,0,1,0,0,0|1,0,1]=4 118 B7R0.10 C\C=C(\C)C(=O)OC 7087AL [1,0,1,0,0,0|0,0,2]=4 119 B7R0.4 C\C=C\C=C\C(=O)Cl Y2082 [1,0,1,0,0,0|2,0,0]=4 120 B7R1.1 CCC1=CC=NO1 3273AB [2,0,0,0,0,0|1,0,1]=4 121 B7R1.1 CNC1=NC=CO1 6947AC [2,0,0,0,0,0|2,0,0]=4 122 B7R1.1 COC1=CC=CO1 2109AL [2,0,0,0,0,0|0,0,0]=2 123 B7R1.1 CSC1=NC=CO1 6777AD [2,0,0,0,0,0|1,1,0]=4 124 B7R1.1 O=CC1=CC=C[Se]1 5634AL [2,0,0,0,0,0|0,1,0]=3 125 B7R1.1 O=CC1=NC=CO1 7478AE [2,0,0,0,0,0|1,0,0]=3 126 B7R1.1 OCC1=CC=NO1 6850AC [2,0,0,0,0,0|1,0,1]=4 127 B9R1.19 CC(C)(C)C1=CC=CO1 0781AQ [1,1,0,0,0,0|1,0,1]=4 128 B9R1.35 CC(=O)C1=CC(Cl)=CS1 W5634 [1,1,0,0,0,0|0,1,0]=3 129 B9R1.35 CC(=O)C1=CC=C(Br)O1 3520AB [1,1,0,0,0,0|0,0,0]=2 130 B9R1.35 CC(=O)C1=NC(C)=CN1 2011AB [1,1,0,0,0,0|2,0,0]=4 131 B9R1.35 CC(=O)C1=NC(C)=CO1 5140AC [1,1,0,0,0,0|1,0,0]=3 132 B9R1.35 CC(=O)C1=NC=C(Br)S1 2132AC [1,1,0,0,0,0|1,1,0]=4 133 B9R1.35 CC1=CC(C(=O)O)=CN1 X8465 [1,1,0,0,0,0|2,0,0]=4 134 B9R1.35 CC1=CC=C(C(=O)O)N1 4808AB [1,1,0,0,0,0|1,0,0]=3 135 B9R1.35 CC1=CN=C(C(=O)O)O1 X6429 [1,1,0,0,0,0|1,0,0]=3 136 B9R1.35 CC1=CNC(C(=O)O)=C1 V0508 [1,1,0,0,0,0|1,0,0]=3 137 B9R1.35 CC1=CNC(C(=O)O)=N1 Y9876 [1,1,0,0,0,0|2,0,0]=4 138 B9R1.35 CC1=COC(C(=O)O)=N1 X6324 [1,1,0,0,0,0|1,0,0]=3 139 B9R1.35 CC1=NN=C(C(=O)O)O1 7252AB [1,1,0,0,0,0|2,0,0]=4 140 B9R1.35 NC(=O)C1=CC(Br)=NO1 4565AA [1,1,0,0,0,0|2,0,0]=4 141 B9R1.35 NC(=O)C1=CC=C(Br)N1 9191AA [1,1,0,0,0,0|2,0,0]=4 142 B9R1.35 NC1=CSC(C(=O)O)=C1 6089AJ [1,1,0,0,0,0|0,1,0]=3 143 B9R1.35 NC1=NC(C(=O)O)=CS1 Y7076 [1,1,0,0,0,0|2,0,0]=4 144 B9R1.35 NC1=NC=C(C(=O)O)O1 V8587 [1,1,0,0,0,0|1,0,0]=3 145 B9R1.35 O=C(O)C1=CC(Cl)=NO1 0612AB [1,1,0,0,0,0|1,0,0]=3 146 B9R1.35 O=C(O)C1=CC(F)=CS1 3617AB [1,1,0,0,0,0|0,1,0]=3 147 B9R1.35 O=C(O)C1=CC=C(I)O1 6244AD [1,1,0,0,0,0|0,0,0]=2 148 B9R1.35 O=C(O)C1=COC(Cl)=N1 Y9881 [1,1,0,0,0,0|2,0,0]=4 149 B9R1.35 O=C(O)C1=COC(I)=N1 4876AA [1,1,0,0,0,0|2,0,0]=4 150 B9R1.35 O=C(O)C1=NC(Br)=CO1 X6341 [1,1,0,0,0,0|1,0,0]=3 151 B9R1.35 O=C(O)C1=NC=C(Cl)S1 Y6782 [1,1,0,0,0,0|1,1,0]=4 152 B9R1.35 O=C1C=C(C(=O)O)CC1 Y5171 [1,1,0,0,0,0|1,0,1]=4 153 B9R1.35 O=[N+]([O-])C1=CC=C(Br)O1 5524AL [1,1,0,0,0,0|1,0,1]=4 154 B9R1.41 CC(=O)C1=C(C)C=CS1 Z5455 [1,1,0,0,0,0|0,1,0]=3 155 B9R1.41 CC(=O)C1=C(N)C=CS1 3514AB [1,1,0,0,0,0|0,1,0]=3 156 B9R1.41 CC(=O)N1C=CC=C1Br 5036AJ [1,1,0,0,0,0|2,0,0]=4 157 B9R1.41 CC1=C(C(=O)O)NC=C1 W9332 [1,1,0,0,0,0|1,0,0]=3 158 B9R1.41 CC1=C(C(=O)O)ON=C1 2244AB [1,1,0,0,0,0|1,0,0]=3 159 B9R1.41 CC1=CON=C1C(=O)O 0980AB [1,1,0,0,0,0|2,0,0]=4 160 B9R1.41 NC1=C(C(=O)O)NC=N1 6671AB [1,1,0,0,0,0|2,0,0]=4 161 B9R1.41 O=C(O)C1=C(Br)OC=C1 Z5486 [1,1,0,0,0,0|2,0,0]=4 162 B9R1.41 O=C(O)C1=C(I)C=NN1 W7746 [1,1,0,0,0,0|2,0,0]=4 163 B9R1.7 CNCC1=CC=C(Br)O1 2148AF [1,1,0,0,0,0|1,0,1]=4 164 B9R1.12 CCCCC1=CC=CO1 5552AL [1,1,0,0,0,0|1,0,1]=4 165 B9R1.12 CCNCC1=CC=CO1 7158AA [1,1,0,0,0,0|1,0,1]=4 166 B9R1.12 N#C\C=C\C1=CC=CO1 0767AQ [1,1,0,0,0,0|1,0,1]=4 167 B9R1.12 NCCCC1=CC=CO1 3731AE [1,1,0,0,0,0|1,0,1]=4 168 B9R1.13 CC(N)CC1=CC=CO1 8493AB [1,1,0,0,0,0|1,0,1]=4 169 B9R1.13 CC(O)CC1=CC=CO1 6519AJ [1,1,0,0,0,0|1,0,1]=4 170 B9R1.13 CN(C)C=C1C=CC=C1 0768AC [1,1,0,0,0,0|2,0,0]=4 171 B11R1.16 CCOC(=N)C1=CC=NC=C1 Y9045 [0,1,0,0,0,1|2,0,0]=4 172 B11R1.16 CCOC(=O)C1=CC=NN=C1 5094AB [0,1,0,0,0,1|2,0,0]=4 173 B11R1.16 C\C=C\C(=O)C1=CC=CC=C1 6705AB [0,1,0,0,0,1|2,0,0]=4 174 B11R1.22 CCC(=O)C1=CC=C(I)C=C1 1437AL [0,1,0,0,0,1|2,0,0]=4 175 B11R1.22 CCC(=O)C1=NC=C(Br)C=N1 Y3142 [0,1,0,0,0,1|2,0,0]=4 176 B11R1.22 CNC(=O)C1=CC=C(O)C=C1 2642AB [0,1,0,0,0,1|2,0,0]=4 177 B11R1.22 COC(=O)C1=CC=C(N)C=C1 3562AL [0,1,0,0,0,1|1,0,0]=3 178 B11R1.22 COC(=O)C1=CN=C(C)N=C1 5600AE [0,1,0,0,0,1|2,0,0]=4 179 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 W5141 [0,1,0,0,0,1|2,0,0]=4 180 B11R1.22 COC(=O)C1=CN=C(I)C=C1 V3781 [0,1,0,0,0,1|1,0,0]=3 181 B11R1.22 COC(=O)C1=CNC(=O)N=C1 6987AB [0,1,0,0,0,1|2,0,0]=4 182 B11R1.22 COC(=O)C1=NC=C(F)C=N1 7118AJ [0,1,0,0,0,1|1,0,0]=3 183 B11R1.22 COC(=O)C1=NC=C(N)C=N1 3573AL [0,1,0,0,0,1|1,0,0]=3 184 B11R1.22 COC(=O)C1=NN=C(C)C=C1 8321AC [0,1,0,0,0,1|1,0,0]=3 185 B11R1.23 CNC(=O)C1=CC(Br)=NC=C1 V5272 [0,1,0,0,0,1|2,0,0]=4 186 B11R1.23 CNC(=O)C1=CC(Cl)=CC=C1 8051AJ [0,1,0,0,0,1|2,0,0]=4 187 B11R1.23 CNC(=O)C1=CC=CC(O)=C1 2288AJ [0,1,0,0,0,1|2,0,0]=4 188 B11R1.23 CNC(=O)C1=NC(Br)=CC=C1 V5271 [0,1,0,0,0,1|2,0,0]=4 189 B11R1.23 COC(=O)C1=CC(N)=NC=N1 2200AC [0,1,0,0,0,1|1,0,0]=3 190 B11R1.23 COC(=O)C1=CN=CC(O)=C1 7119AJ [0,1,0,0,0,1|1,0,0]=3 191 B11R1.23 COC(=O)C1=NC(N)=NC=C1 1008AB [0,1,0,0,0,1|1,0,0]=3 192 B11R1.23 COC(=O)C1=NC=CC(C)=N1 Z4587 [0,1,0,0,0,1|1,0,0]=3 193 B11R1.23 COC(=O)C1=NC=CC(O)=C1 4279AJ [0,1,0,0,0,1|1,0,0]=3 194 B11R1.222 CCC(=O)C1=CC=CN=C1Cl 5775AA [0,1,0,0,0,1|2,0,0]=4 195 B11R1.222 CCC(=O)C1=NC=CC=C1C V9138 [0,1,0,0,0,1|2,0,0]=4 196 B11R1.222 CNC(=O)C1=NC=CN=C1N 4576AB [0,1,0,0,0,1|2,0,0]=4 197 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 9708AB [0,1,0,0,0,1|1,0,0]=3 198 B11R1.222 COC(=O)C1=CC=CN=C1S 9094AE [0,1,0,0,0,1|1,0,0]=3 199 B11R1.222 COC(=O)C1=CN=CC=C1Cl X9905 [0,1,0,0,0,1|1,0,0]=3 200 B11R1.222 COC(=O)C1=CN=CC=C1O V7225 [0,1,0,0,0,1|1,0,0]=3 201 B11R1.222 COC(=O)C1=NC=CN=C1I W3780 [0,1,0,0,0,1|1,0,0]=3 202 B11R1.30 CCOC(=O)CC1=CSC=N1 6665AJ [0,1,0,0,0,1|2,0,0]=4 203 B11R1.30 CCOC(=O)CC1=NC=CS1 W3087 [0,1,0,0,0,1|1,1,0]=4 204 B11R1.30 CCOC(=O)CC1=NNC=C1 8330AH [0,1,0,0,0,1|2,0,0]=4 205 B11R1.30 CCOC(=O)CN1C=CC=N1 0534AA [0,1,0,0,0,1|2,0,0]=4 206 B11R1.30 CCOC(=O)NC1=CC=CS1 5602AJ [0,1,0,0,0,1|0,1,0]=3 207 B11R1.39 COC(=O)CC1=CSC(N)=N1 1935AC [0,1,0,0,0,1|2,0,0]=4 208 B11R1.39 COC(=O)CN1C=CC(N)=N1 8617AC [0,1,0,0,0,1|2,0,0]=4 209 B11R1.15 CCCC(=O)C1=CC=C(Br)S1 8324AC [0,2,0,0,0,0|1,1,0]=4 210 B11R1.15 CCNC(=O)C1=CC=C(Br)O1 5338AE [0,2,0,0,0,0|1,0,0]=3 211 B11R1.15 CCNC(=O)C1=CC=C(Br)S1 2837AF [0,2,0,0,0,0|1,1,0]=4 212 B11R1.15 CCOC(=O)C1=CN=C(N)S1 8264AA [0,2,0,0,0,0|1,1,0]=4 213 B11R1.15 CCOC(=O)C1=CNC(=O)O1 Z7610 [0,2,0,0,0,0|1,0,0]=3 214 B11R1.15 CCOC(=O)C1=COC(=O)N1 V8514 [0,2,0,0,0,0|2,0,0]=4 215 B11R1.15 CCOC(=O)C1=CSC(F)=N1 7677AA [0,2,0,0,0,0|2,0,0]=4 216 B11R1.15 CCOC(=O)C1=CSC(N)=N1 Y4999 [0,2,0,0,0,0|2,0,0]=4 217 B11R1.15 CCOC(=O)C1=NC(Br)=CS1 6713AC [0,2,0,0,0,0|1,1,0]=4 218 B11R1.15 CCOC(=O)C1=NC(Br)=NO1 3932AA [0,2,0,0,0,0|2,0,0]=4 219 B11R1.15 CCOC(=O)C1=NC(C)=CO1 5141AC [0,2,0,0,0,0|1,0,0]=3 220 B11R1.15 CCOC(=O)C1=NC(C)=CS1 Y9909 [0,2,0,0,0,0|1,1,0]=4 221 B11R1.15 CCOC(=O)C1=NC=C(Br)S1 3499AA [0,2,0,0,0,0|1,1,0]=4 222 B11R1.15 CCOC(=O)C1=NC=C(C)S1 8637AB [0,2,0,0,0,0|1,1,0]=4 223 B11R1.15 CCOC(=O)C1=NOC(N)=C1 6626AB [0,2,0,0,0,0|2,0,0]=4 224 B11R1.29 CCCCC(=O)C1=CC=CO1 Z5508 [0,2,0,0,0,0|1,0,0]=3 225 B11R1.29 CCCCC(=O)C1=CC=CS1 Z5534 [0,2,0,0,0,0|1,1,0]=4 226 B11R1.29 CCSCC(=O)C1=CC=CS1 5708AB [0,2,0,0,0,0|0,2,0]=4 227 B11R1.29 NCCNC(=O)C1=CC=CO1 0052AF [0,2,0,0,0,0|1,0,0]=3 228 B11R1.29 NCCNC(=O)C1=CC=CS1 8732AB [0,2,0,0,0,0|1,1,0]=4 229 B11R1.199 CCOC(=O)C1=C(Br)C=CS1 9350AB [0,2,0,0,0,0|0,1,0]=3 230 B11R1.199 CCOC(=O)C1=C(C)C=CS1 4299AD [0,2,0,0,0,0|0,1,0]=3 231 B11R1.199 CCOC(=O)C1=C(C)OC=C1 5584AJ [0,2,0,0,0,0|2,0,0]=4 232 B11R1.199 CCOC(=O)C1=C(Cl)SC=N1 5872AB [0,2,0,0,0,0|2,0,0]=4 233 B11R1.199 CCOC(=O)C1=C(F)C=CN1 8581AA [0,2,0,0,0,0|1,0,0]=3 234 B11R1.199 CCOC(=O)C1=C(N)N=CS1 7640AA [0,2,0,0,0,0|1,1,0]=4 235 B11R1.199 CCOC(=O)C1=C(N)NC=C1 X6512 [0,2,0,0,0,0|2,0,0]=4 236 B11R1.199 CCOC(=O)C1=C(O)C=CS1 0981AB [0,2,0,0,0,0|0,1,0]=3 237 B11R1.199 CCOC(=O)C1=CC=CN1N 9521AB [0,2,0,0,0,0|1,0,0]=3 238 B11R1.199 CCOC(=O)C1=NOC=C1C W5882 [0,2,0,0,0,0|2,0,0]=4 239 B11R1.199 CCOC(=O)N1C=CC=C1Br 6686AJ [0,2,0,0,0,0|2,0,0]=4 240 B11R1.199 COCC(=O)C1=CC=NN1C 7960AJ [0,2,0,0,0,0|2,0,0]=4 241 B11R1.44 CCC1=NNC(C(=O)OC)=C1 W8669 [0,2,0,0,0,0|2,0,0]=4 242 B11R1.44 CCN1C=CC(C(=O)OC)=N1 Y4614 [0,2,0,0,0,0|2,0,0]=4 243 B11R1.44 COC(=O)C1=CC(C#N)=CO1 4470AB [0,2,0,0,0,0|0,0,0]=2 244 B11R1.44 COC(=O)C1=CC(CBr)=CS1 7965AB [0,2,0,0,0,0|0,1,0]=3 245 B11R1.44 COC(=O)C1=CC(CO)=CS1 2656AC [0,2,0,0,0,0|0,1,0]=3 246 B11R1.44 COC(=O)C1=CC=C(CBr)S1 8495AC [0,2,0,0,0,0|0,1,0]=3 247 B11R1.44 COC(=O)C1=CC=C(CN)N1 2327AB [0,2,0,0,0,0|1,0,0]=3 248 B11R1.44 COC(=O)C1=CSC(C=O)=C1 F178 [0,2,0,0,0,0|2,0,0]=4 249 B11R1.225 COC(=O)C1=C(Br)C=C(Br)S1 Z0735 [0,2,0,0,0,0|0,1,0]=3 250 B11R1.225 COC(=O)C1=C(Br)C=C(C)S1 Z8977 [0,2,0,0,0,0|0,1,0]=3 251 B11R1.225 COC(=O)C1=C(Br)OC(Br)=C1 Z7611 [0,2,0,0,0,0|2,0,0]=4 252 B11R1.225 COC(=O)C1=C(Br)SC(C)=C1 Y4795 [0,2,0,0,0,0|2,0,0]=4 253 B11R1.225 COC(=O)C1=C(C)C=C(Br)S1 7112AJ [0,2,0,0,0,0|0,1,0]=3 254 B11R1.225 COC(=O)C1=C(C)SC(Br)=N1 Y5789 [0,2,0,0,0,0|2,0,0]=4 255 B11R1.225 COC(=O)C1=C(F)C=C(Br)S1 0105AP [0,2,0,0,0,0|0,1,0]=3 256 B11R1.225 COC(=O)C1=C(N)SC(Cl)=C1 0111AP [0,2,0,0,0,0|2,0,0]=4 257 B11R1.225 COC(=O)C1=C(O)C=C(Cl)S1 6409AC [0,2,0,0,0,0|0,1,0]=3 258 B11R1.225 COC(=O)C1=CC(=O)NN1C 7480AB [0,2,0,0,0,0|2,0,0]=4 259 B11R1.225 COC(=O)C1=CC(C)=NN1C W9909 [0,2,0,0,0,0|2,0,0]=4 260 B11R1.225 COC(=O)C1=CC(I)=CN1C 2802AE [0,2,0,0,0,0|1,0,0]=3 261 B11R1.226 CCC(=O)C1=CC(Br)=C(C)S1 V8713 [0,2,0,0,0,0|1,1,0]=4 262 B11R1.226 COC(=O)C1=CC(Br)=C(Br)N1 V9305 [0,2,0,0,0,0|1,0,0]=3 263 B11R1.226 COC(=O)C1=CC(Br)=C(Br)S1 Y6332 [0,2,0,0,0,0|0,1,0]=3 264 B11R1.226 COC(=O)C1=CC(Br)=C(Cl)O1 7066AJ [0,2,0,0,0,0|0,0,0]=2 265 B11R1.314 CC(C)C(=O)C1=CC=C(Br)S1 V9424 [0,2,0,0,0,0|1,1,0]=4 266 B11R1.865 COC(=O)C1=C(F)C(Br)=CS1 5183AB [0,2,0,0,0,0|0,1,0]=3 267 B11R1.865 COC(=O)C1=C(O)C(Cl)=CS1 0034AC [0,2,0,0,0,0|0,1,0]=3 268 B11R1.865 COC(=O)C1=CSC(C)=C1N 2645AC [0,2,0,0,0,0|2,0,0]=4 269 B11R1.865 COC(=O)C1=NNC(Br)=C1Br Z7250 [0,2,0,0,0,0|2,0,0]=4 270 B11R1.865 COC(=O)C1=NNC(C)=C1Br 4448AA [0,2,0,0,0,0|2,0,0]=4 271 B11R1.357 CC(C)(C)C(=O)C1=CC=CS1 0753AQ [0,2,0,0,0,0|1,1,0]=4 272 B11R1.357 O=C(C1=CC=CO1)C(F)(F)F 9541AA [0,2,0,0,0,0|2,0,0]=4 273 B11R1.59 CCC1=C(C(=O)OC)N=CS1 2649AC [0,2,0,0,0,0|2,0,0]=4 274 B11R1.59 CNC1=C(C(=O)OC)C=CS1 6248AC [0,2,0,0,0,0|2,0,0]=4 275 B11R1.59 COC(=O)C1=C(C=O)C=NN1 1373AE [0,2,0,0,0,0|2,0,0]=4 276 B11R1.59 COC(=O)C1=CC=NN1CCl 7110AC [0,2,0,0,0,0|2,0,0]=4 277 B11R1.875 COC(=O)C1=C(C)SC=C1O 0012AC [0,2,0,0,0,0|2,0,0]=4 278 B11R1.875 COC(=O)C1=C(N)C=NN1C 0753AD [0,2,0,0,0,0|2,0,0]=4 279 B9R1.15 COC1=C(O)C=NC=C1 7687AA [0,0,1,1,0,0|2,0,0]=4 280 B9R1.15 COC1=CN=CC=C1O 9525AB [0,0,1,1,0,0|2,0,0]=4 281 B9R1.15 COC1=NC=CC=C1F Z7565 [0,0,1,1,0,0|2,0,0]=4 282 B9R1.2 CSC1=CC=CC(O)=C1 1026AE [0,0,1,1,0,0|1,1,0]=4 283 B11R2.1 O=C1CCC2=NC=CC=C12 4182AA [0,0,0,1,0,1|2,0,0]=4 284 B11R2.1 O=C1NCC2=C1C=CN=C2 1363AJ [0,0,0,1,0,1|2,0,0]=4 285 B11R2.106 O=C1NC=NC2=C1OC=C2 Z5001 [0,1,0,1,0,0|1,0,1]=4 286 B11R2.106 O=C1NCCC2=C1SC=C2 Y7543 [0,1,0,1,0,0|1,1,0]=4 287 B7R1.18 CC(=O)N1C=CC1 6529AA [1,0,0,0,1,0|1,0,1]=4 288 B9R1.6 CS(=O)C1=NC=CC=C1 7769AJ [1,0,0,0,0,1|2,0,0]=4 289 B9R1.6 CS(=O)C1=NC=CC=N1 7770AJ [1,0,0,0,0,1|2,0,0]=4 290 B9R1.6 NC(=O)C1=CN=CC=C1 1853AE [1,0,0,0,0,1|2,0,0]=4 291 B9R1.6 NC(=O)C1=NC=CC=N1 Z3390 [1,0,0,0,0,1|2,0,0]=4 292 B9R1.6 O=C(O)C1=CCCOC1 X8488 [1,0,0,0,0,1|0,0,2]=4 293 B9R1.6 O=C(O)C1C=CCC=C1 Y5447 [1,0,0,0,0,1|1,0,1]=4 294 B9R1.6 O=C(S)C1=CN=CC=C1 9152AL [1,0,0,0,0,1|1,1,0]=4 295 B9R1.6 O=C([O-])C1=CC=NC=N1 2020AH [1,0,0,0,0,1|1,0,1]=4 296 B9R1.6 O=C([O-])C1=NC=CC=C1 8839AL [1,0,0,0,0,1|1,0,1]=4 297 B9R1.8 C\C=C\C1=CC=CC=C1 7209AE [1,0,0,0,0,1|2,0,0]=4 298 B11R1.40 CCC(=O)OC1=CC=CC=C1 8795AL [0,0,0,0,0,2|2,0,0]=4 299 B11R1.40 CNC(=O)CC1=CN=CC=C1 8304AC [0,0,0,0,0,2|2,0,0]=4 300 B11R1.40 COC(=O)CC1=CC=CN=C1 7040AJ [0,0,0,0,0,2|1,0,0]=3 301 B11R1.40 COC(=O)CC1=NC=NC=C1 Y1676 [0,0,0,0,0,2|1,0,0]=3 302 B11R1.25 COC(=O)CCC1=CC=CS1 8609AA [0,0,0,0,0,2|0,1,0]=3 303 B11R1.25 NCC(=O)NCC1=CC=CO1 0043AD [0,0,0,0,0,2|2,0,0]=4