0 B12R2.27 O=C[C@@H]1C[C@H]1C2=CC=CC=C2 SC-54076 [0,1,0,0,0,0|1,0,0]=2 1 B12R2.92 ClC1(Cl)CC1C2=CC=CC=C2 SC-27126 [0,1,0,0,0,0|1,0,0]=2 2 B10R1.15 BrCC(Br)C1=CC=CC=C1 SC-22066 [0,0,1,0,0,0|2,0,0]=3 3 B10R1.15 C=C(CBr)C1=CC=CC=C1 SC-34618 [0,0,1,0,0,0|1,0,2]=4 4 B10R1.15 C=C(CN)C1=CC=CC=C1 SC-35691 [0,0,1,0,0,0|0,0,2]=3 5 B10R1.15 C=CC(N)C1=CC=CC=C1 SC-32934 [0,0,1,0,0,0|2,0,1]=4 6 B10R1.15 CC(NN)C1=CC=CC=C1 SC-51769 [0,0,1,0,0,0|1,0,0]=2 7 B10R1.15 CC(NN)C1=CC=NC=C1 SC-38975 [0,0,1,0,0,0|2,0,0]=3 8 B10R1.15 CC(NN)C1=CN=CC=C1 SC-38743 [0,0,1,0,0,0|2,0,0]=3 9 B10R1.15 CC(NN)C1=NC=CN=C1 SC-39028 [0,0,1,0,0,0|3,0,0]=4 10 B10R1.15 C\C(=N/N)C1=CC=CC=C1 SC-50298 [0,0,1,0,0,0|1,0,1]=3 11 B10R1.15 N#CC(N)C1=CC=CC=C1 SC-51010 [0,0,1,0,0,0|1,0,2]=4 12 B10R1.15 NCC(=O)C1=CC=NC=C1 SC-31354 [0,0,1,0,0,0|2,0,1]=4 13 B10R1.15 NCC(=O)C1=CN=CC=C1 SC-45557 [0,0,1,0,0,0|2,0,1]=4 14 B10R1.15 NCC(=O)C1=NC=CC=C1 SC-30538 [0,0,1,0,0,0|2,0,1]=4 15 B10R1.15 OCC(O)C1=CC=CC=C1 SC-02935 [0,0,1,0,0,0|2,0,0]=3 16 B10R1.15 OC[C@H](O)C1=CC=CC=C1 SC-01512 [0,0,1,0,0,0|2,0,0]=3 17 B10R1.17 BrCCOC1=CC=CC=C1 SC-05561 [0,0,1,0,0,0|2,0,0]=3 18 B10R1.17 BrCCSC1=CC=CC=C1 SC-51881 [0,0,1,0,0,0|2,0,0]=3 19 B10R1.17 BrC\C=C\C1=CC=CC=C1 SC-48169 [0,0,1,0,0,0|1,0,2]=4 20 B10R1.17 C=CCNC1=CC=CC=C1 SC-52014 [0,0,1,0,0,0|2,0,1]=4 21 B10R1.17 CCCCC1=NC=CC=C1 SC-52456 [0,0,1,0,0,0|2,0,0]=3 22 B10R1.17 CNCCC1=CC=NC=C1 SC-25785 [0,0,1,0,0,0|3,0,0]=4 23 B10R1.17 ClCC#CC1=CC=CC=C1 SC-15354 [0,0,1,0,0,0|1,0,2]=4 24 B10R1.17 ClCCCC1=CC=NC=C1 SC-54620 [0,0,1,0,0,0|2,0,0]=3 25 B10R1.17 ClCCCC1=CN=CC=C1 SC-54619 [0,0,1,0,0,0|2,0,0]=3 26 B10R1.17 ClC\C=C\C1=CC=CC=C1 SC-17418 [0,0,1,0,0,0|1,0,2]=4 27 B10R1.17 N#CCCC1=CC=CC=N1 SC-58537 [0,0,1,0,0,0|1,0,2]=4 28 B10R1.17 N#CCCC1=CC=NC=C1 SC-54416 [0,0,1,0,0,0|1,0,2]=4 29 B10R1.17 N#CCCC1=CN=CC=C1 SC-58524 [0,0,1,0,0,0|1,0,2]=4 30 B10R1.17 NCCCC1=CC=CC=N1 SC-49860 [0,0,1,0,0,0|1,0,0]=2 31 B10R1.17 NCCCC1=CC=CN=C1 SC-49861 [0,0,1,0,0,0|1,0,0]=2 32 B10R1.17 NCCOC1=CC=CN=C1 SC-53576 [0,0,1,0,0,0|2,0,0]=3 33 B10R1.17 NCCOC1=CC=NC=C1 SC-43788 [0,0,1,0,0,0|2,0,0]=3 34 B10R1.17 NCCSC1=CC=CC=C1 SC-40816 [0,0,1,0,0,0|1,0,0]=2 35 B10R1.17 NNCCC1=CC=CC=N1 SC-58990 [0,0,1,0,0,0|2,0,0]=3 36 B10R1.17 NNCCC1=NC=CC=C1 SC-41708 [0,0,1,0,0,0|2,0,0]=3 37 B10R1.17 O=CCCC1=CC=NC=C1 SC-31224 [0,0,1,0,0,0|2,0,1]=4 38 B10R1.17 O=CCCC1=NC=CC=C1 SC-31288 [0,0,1,0,0,0|2,0,1]=4 39 B10R1.17 OCC#CC1=CC=CC=C1 SC-46226 [0,0,1,0,0,0|1,0,2]=4 40 B10R1.17 OCCCC1=NC=CC=C1 SC-27298 [0,0,1,0,0,0|2,0,0]=3 41 B10R1.17 OCCCC1=NC=CC=N1 SC-87505 [0,0,1,0,0,0|3,0,0]=4 42 B10R1.17 SCCOC1=CC=CC=C1 SC-66414 [0,0,1,0,0,0|2,0,0]=3 43 B10R1.18 CC(=O)CC1=CC=NC=C1 SC-22966 [0,0,1,0,0,0|2,0,1]=4 44 B10R1.18 CC(=S)CC1=CC=NC=C1 SC-42368 [0,0,1,0,0,0|2,0,1]=4 45 B10R1.18 CC(C)OC1=CC=NC=C1 SC-48093 [0,0,1,0,0,0|3,0,0]=4 46 B10R1.18 CC(C)OC1=CN=CC=C1 SC-66373 [0,0,1,0,0,0|3,0,0]=4 47 B10R1.18 N=C(N)CC1=CC=CC=N1 SC-58528 [0,0,1,0,0,0|2,0,1]=4 48 B10R1.18 N=C(N)CC1=CC=CN=C1 SC-58527 [0,0,1,0,0,0|2,0,1]=4 49 B10R1.18 N=C(N)CC1=CC=NC=C1 SC-58526 [0,0,1,0,0,0|2,0,1]=4 50 B10R1.18 NC(=O)CC1=CC=CC=C1 SC-19149 [0,0,1,0,0,0|1,0,1]=3 51 B10R1.18 NC(=O)CC1=CC=CN=C1 SC-52723 [0,0,1,0,0,0|2,0,1]=4 52 B10R1.18 NC(=S)NC1=CC=CC=C1 SC-64640 [0,0,1,0,0,0|2,0,1]=4 53 B12R2.22 N[C@H]1C[C@@H](C2=CC=CC=C2)C1 SC-87898 [0,0,0,0,0,1|0,0,0]=1 54 B12R2.22 N[C@H]1C[C@@H](C2=NC=CC=C2)C1 SC-51413 [0,0,0,0,0,1|1,0,0]=2 55 B9R1.6 CC(=O)C1=CC=CC=C1 SC-32943 [1,0,1,0,0,0|1,0,1]=4 56 B9R1.6 CC(Br)C1=CC=CC=C1 SC-52813 [1,0,1,0,0,0|1,0,0]=3 57 B9R1.6 CC(C)C1=CC=NC=C1 SC-13724 [1,0,1,0,0,0|1,0,0]=3 58 B9R1.6 CC(C)C1=NC=CC=C1 SC-49043 [1,0,1,0,0,0|1,0,0]=3 59 B9R1.6 CC(N)C1=CN=CC=C1 SC-27088 [1,0,1,0,0,0|1,0,0]=3 60 B9R1.6 CC(N)C1=NC=CC=C1 SC-65575 [1,0,1,0,0,0|1,0,0]=3 61 B9R1.6 CC(O)C1=NC=CC=C1 SC-23601 [1,0,1,0,0,0|2,0,0]=4 62 B9R1.6 CN(C)C1=CC=CC=C1 SC-22778 [1,0,1,0,0,0|1,0,0]=3 63 B9R1.6 CN(C)C1=CC=NC=C1 SC-52345 [1,0,1,0,0,0|2,0,0]=4 64 B9R1.6 C[C@H](Br)C1=CC=CC=C1 SC-51542 [1,0,1,0,0,0|1,0,0]=3 65 B9R1.8 CCCC1=NC=CN=C1 SC-54534 [1,0,1,0,0,0|2,0,0]=4 66 B9R1.8 CNCC1=CC=CC=C1 SC-00152 [1,0,1,0,0,0|1,0,0]=3 67 B9R1.8 CNCC1=CC=CN=C1 SC-23209 [1,0,1,0,0,0|2,0,0]=4 68 B9R1.8 CNCC1=CC=NC=C1 SC-27517 [1,0,1,0,0,0|2,0,0]=4 69 B9R1.8 C\C=C/C1=CC=CC=C1 SC-22137 [1,0,1,0,0,0|0,0,2]=4 70 B9R1.8 ClCCC1=NC=CC=C1 SC-26329 [1,0,1,0,0,0|2,0,0]=4 71 B9R1.8 NNCC1=CC=CC=C1 SC-58205 [1,0,1,0,0,0|1,0,0]=3 72 B9R1.8 NNCC1=CC=NC=C1 SC-41216 [1,0,1,0,0,0|2,0,0]=4 73 B9R1.8 OCCC1=NC=CC=C1 SC-00153 [1,0,1,0,0,0|2,0,0]=4 74 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 SC-51234 [1,0,1,0,0,0|1,0,1]=4 75 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 SC-23027 [0,1,1,0,0,0|0,0,2]=4 76 B11R1.7 CC(F)(CBr)C1=CC=CC=C1 SC-31522 [0,1,1,0,0,0|1,0,0]=3 77 B11R1.7 FC(F)(CBr)C1=CC=CC=C1 SC-00307 [0,1,1,0,0,0|2,0,0]=4 78 B11R1.12 CCC(CBr)C1=CC=CC=C1 SC-41300 [0,1,1,0,0,0|1,0,0]=3 79 B11R1.12 CCC(CCl)C1=CC=CC=C1 SC-41120 [0,1,1,0,0,0|1,0,0]=3 80 B11R1.12 CCC(CN)C1=CC=CC=C1 SC-40307 [0,1,1,0,0,0|0,0,0]=2 81 B11R1.12 CCC(NN)C1=CC=CC=C1 SC-38705 [0,1,1,0,0,0|1,0,0]=3 82 B11R1.12 CCC(NN)C1=CC=CN=C1 SC-40041 [0,1,1,0,0,0|2,0,0]=4 83 B11R1.12 CCC(NN)C1=CC=NC=C1 SC-42125 [0,1,1,0,0,0|2,0,0]=4 84 B11R1.12 COC(CBr)C1=CC=CC=C1 SC-52464 [0,1,1,0,0,0|1,0,0]=3 85 B11R1.16 C=CC[C@@H](O)C1=CC=CC=C1 SC-31320 [0,1,1,0,0,0|2,0,0]=4 86 B11R1.16 C=CC[C@H](O)C1=CC=CC=C1 SC-14275 [0,1,1,0,0,0|2,0,0]=4 87 B11R1.16 CC(CCBr)C1=CC=CC=C1 SC-67580 [0,1,1,0,0,0|1,0,0]=3 88 B11R1.16 CC(CNN)C1=CC=CC=C1 SC-12389 [0,1,1,0,0,0|0,0,0]=2 89 B11R1.16 CC(CNN)C1=CC=CC=C1 SC-42306 [0,1,1,0,0,0|0,0,0]=2 90 B11R1.16 COC[C@H](N)C1=CC=CC=C1 SC-70086 [0,1,1,0,0,0|2,0,0]=4 91 B11R1.22 CC(NN)C1=CC=C(Br)C=C1 SC-38738 [0,1,1,0,0,0|1,0,0]=3 92 B11R1.22 CC(NN)C1=CC=C(Br)N=C1 SC-38700 [0,1,1,0,0,0|2,0,0]=4 93 B11R1.22 CC(NN)C1=CC=C(F)C=C1 SC-39113 [0,1,1,0,0,0|1,0,0]=3 94 B11R1.22 CC(NN)C1=CC=C(O)C=C1 SC-38663 [0,1,1,0,0,0|1,0,0]=3 95 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 SC-48513 [0,1,1,0,0,0|1,0,1]=4 96 B11R1.22 CC1=CC=C(C(C)NN)C=C1 SC-39012 [0,1,1,0,0,0|1,0,0]=3 97 B11R1.22 CC1=CC=C(C(C)NN)C=N1 SC-38542 [0,1,1,0,0,0|2,0,0]=4 98 B11R1.22 CCC(C)C1=CC=C(N)C=C1 SC-47018 [0,1,1,0,0,0|1,0,0]=3 99 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 SC-51979 [0,1,1,0,0,0|2,0,0]=4 100 B11R1.22 NCC(O)C1=CC=C(O)C=C1 SC-45433 [0,1,1,0,0,0|1,0,0]=3 101 B11R1.22 NC[C@H](O)C1=CC=C(Cl)C=C1 SC-42542 [0,1,1,0,0,0|1,0,0]=3 102 B11R1.23 CC(CO)C1=CC=CC(Cl)=C1 SC-53936 [0,1,1,0,0,0|1,0,0]=3 103 B11R1.23 CC(NN)C1=CC=CC(Br)=C1 SC-39256 [0,1,1,0,0,0|1,0,0]=3 104 B11R1.23 CC(NN)C1=CC=CC(Cl)=C1 SC-39205 [0,1,1,0,0,0|1,0,0]=3 105 B11R1.23 CC(NN)C1=CC=CC(F)=C1 SC-39206 [0,1,1,0,0,0|1,0,0]=3 106 B11R1.23 CC(NN)C1=CC=CC(F)=C1 SC-41531 [0,1,1,0,0,0|1,0,0]=3 107 B11R1.23 CC(NN)C1=CC=CC(I)=C1 SC-40161 [0,1,1,0,0,0|1,0,0]=3 108 B11R1.23 CC(NN)C1=CC=CC(O)=C1 SC-40227 [0,1,1,0,0,0|1,0,0]=3 109 B11R1.23 CC(NN)C1=NC(Br)=CC=C1 SC-40199 [0,1,1,0,0,0|2,0,0]=4 110 B11R1.23 CC1=CC(C(C)NN)=CC=C1 SC-39013 [0,1,1,0,0,0|1,0,0]=3 111 B11R1.23 CC1=CC(C(O)CN)=CC=C1 SC-45787 [0,1,1,0,0,0|1,0,0]=3 112 B11R1.23 NCC(=O)C1=CC=CC(Br)=C1 SC-30995 [0,1,1,0,0,0|1,0,1]=4 113 B11R1.36 CC(C(=N)N)C1=CC=CC=C1 SC-39385 [0,1,1,0,0,0|0,0,1]=3 114 B11R1.36 N=C(N)C(O)C1=CC=CC=C1 SC-39292 [0,1,1,0,0,0|1,0,1]=4 115 B11R1.222 CC(C#N)C1=CC=CC=C1Br SC-50905 [0,1,1,0,0,0|0,0,2]=4 116 B11R1.222 CC(NN)C1=CC=CC=C1Cl SC-39111 [0,1,1,0,0,0|1,0,0]=3 117 B11R1.222 CC(NN)C1=CC=CC=C1F SC-38540 [0,1,1,0,0,0|1,0,0]=3 118 B11R1.222 CC(NN)C1=CC=CC=C1I SC-38543 [0,1,1,0,0,0|1,0,0]=3 119 B11R1.222 CC(NN)C1=CC=CC=C1O SC-38970 [0,1,1,0,0,0|1,0,0]=3 120 B11R1.222 CC(NN)C1=CC=CN=C1Cl SC-41894 [0,1,1,0,0,0|2,0,0]=4 121 B11R1.222 CC1=CC=CC=C1C(=O)CN SC-32279 [0,1,1,0,0,0|1,0,1]=4 122 B11R1.222 CC1=CC=CC=C1C(C)NN SC-38665 [0,1,1,0,0,0|1,0,0]=3 123 B11R1.222 NCC(=O)C1=CC=CC=C1Cl SC-21628 [0,1,1,0,0,0|1,0,1]=4 124 B11R1.222 NCC(=O)C1=CC=CC=C1Cl SC-31068 [0,1,1,0,0,0|1,0,1]=4 125 B11R1.222 NCC(=O)C1=CC=CC=C1F SC-31380 [0,1,1,0,0,0|1,0,1]=4 126 B11R1.222 OC[C@@H](O)C1=CC=CC=C1Cl SC-25196 [0,1,1,0,0,0|2,0,0]=4 127 B11R1.1 CC1=CC=C(CCNN)C=C1 SC-60098 [0,1,1,0,0,0|1,0,0]=3 128 B11R1.1 CC1=CC=C(CCNN)C=C1 SC-62629 [0,1,1,0,0,0|1,0,0]=3 129 B11R1.1 CC1=CN=C(CCCN)C=N1 SC-21802 [0,1,1,0,0,0|2,0,0]=4 130 B11R1.1 CCCCC1=CC=C(Br)C=C1 SC-80745 [0,1,1,0,0,0|1,0,0]=3 131 B11R1.1 CCCCC1=CC=C(I)C=C1 SC-69412 [0,1,1,0,0,0|1,0,0]=3 132 B11R1.1 CCCNC1=CC=C(Br)C=C1 SC-61709 [0,1,1,0,0,0|2,0,0]=4 133 B11R1.1 CCCNC1=CC=C(C)C=C1 SC-61694 [0,1,1,0,0,0|2,0,0]=4 134 B11R1.1 CCCNC1=CC=C(Cl)C=C1 SC-61710 [0,1,1,0,0,0|2,0,0]=4 135 B11R1.1 CCCNC1=CC=C(F)C=C1 SC-61703 [0,1,1,0,0,0|2,0,0]=4 136 B11R1.1 CCCNC1=CC=C(O)C=C1 SC-41240 [0,1,1,0,0,0|2,0,0]=4 137 B11R1.1 CCNCC1=CC=C(Cl)C=C1 SC-27569 [0,1,1,0,0,0|2,0,0]=4 138 B11R1.1 CCNCC1=CC=C(F)C=C1 SC-24598 [0,1,1,0,0,0|2,0,0]=4 139 B11R1.1 CCOCC1=CC=C(Br)C=C1 SC-34265 [0,1,1,0,0,0|2,0,0]=4 140 B11R1.1 COCCC1=CC=C(O)C=C1 SC-17787 [0,1,1,0,0,0|2,0,0]=4 141 B11R1.1 N#CCCC1=CC=C(O)C=C1 SC-16578 [0,1,1,0,0,0|0,0,2]=4 142 B11R1.1 NCCCC1=CC=C(Cl)C=C1 SC-13089 [0,1,1,0,0,0|0,0,0]=2 143 B11R1.1 NCCSC1=CC=C(Br)C=C1 SC-48868 [0,1,1,0,0,0|1,0,0]=3 144 B11R1.1 NCCSC1=CC=C(Cl)C=C1 SC-40142 [0,1,1,0,0,0|1,0,0]=3 145 B11R1.1 NNCCC1=CC=C(Br)C=C1 SC-42604 [0,1,1,0,0,0|1,0,0]=3 146 B11R1.1 NNCCC1=CC=C(Br)C=C1 SC-60068 [0,1,1,0,0,0|1,0,0]=3 147 B11R1.1 NNCCC1=CC=C(Cl)C=C1 SC-59970 [0,1,1,0,0,0|1,0,0]=3 148 B11R1.1 NNCCC1=CC=C(Cl)C=C1 SC-60072 [0,1,1,0,0,0|1,0,0]=3 149 B11R1.1 NNCCC1=CC=C(F)C=C1 SC-59961 [0,1,1,0,0,0|1,0,0]=3 150 B11R1.1 NNCCC1=CC=C(F)C=C1 SC-62637 [0,1,1,0,0,0|1,0,0]=3 151 B11R1.1 OCCNC1=CC=C(Cl)C=C1 SC-51269 [0,1,1,0,0,0|2,0,0]=4 152 B11R1.17 CC1=CC=CC=C1CCCO SC-70922 [0,1,1,0,0,0|1,0,0]=3 153 B11R1.17 CC1=CC=CC=C1CCNN SC-60002 [0,1,1,0,0,0|1,0,0]=3 154 B11R1.17 CC1=CC=CC=C1CCNN SC-62630 [0,1,1,0,0,0|1,0,0]=3 155 B11R1.17 CCCNC1=C(Cl)C=CC=C1 SC-61712 [0,1,1,0,0,0|2,0,0]=4 156 B11R1.17 CCCNC1=CC=CC=C1Br SC-61707 [0,1,1,0,0,0|2,0,0]=4 157 B11R1.17 CCCNC1=CC=CC=C1C SC-61693 [0,1,1,0,0,0|2,0,0]=4 158 B11R1.17 CCCNC1=CC=CC=C1F SC-61700 [0,1,1,0,0,0|2,0,0]=4 159 B11R1.17 CNCCC1=CC=CC=C1F SC-27203 [0,1,1,0,0,0|2,0,0]=4 160 B11R1.17 ClCCCC1=C(Cl)C=CC=C1 SC-65322 [0,1,1,0,0,0|1,0,0]=3 161 B11R1.17 NCCCC1=CC=CC=C1Br SC-34132 [0,1,1,0,0,0|0,0,0]=2 162 B11R1.17 NCCOC1=CC=CC=C1Br SC-42440 [0,1,1,0,0,0|1,0,0]=3 163 B11R1.17 NNCCC1=CC=CC=C1Br SC-42551 [0,1,1,0,0,0|1,0,0]=3 164 B11R1.17 NNCCC1=CC=CC=C1Cl SC-62688 [0,1,1,0,0,0|1,0,0]=3 165 B11R1.17 NNCCC1=CC=CC=C1F SC-62635 [0,1,1,0,0,0|1,0,0]=3 166 B11R1.17 O=CCCC1=CC=CC=C1Cl SC-31469 [0,1,1,0,0,0|1,0,1]=4 167 B11R1.24 CC1=CC(CCNN)=CC=C1 SC-62631 [0,1,1,0,0,0|1,0,0]=3 168 B11R1.24 CC1=CC(CCNN)=CC=C1 SC-62692 [0,1,1,0,0,0|1,0,0]=3 169 B11R1.24 CCCC[N+]1=CC=CC(C)=C1 SC-66269 [0,1,1,0,0,0|2,0,0]=4 170 B11R1.24 CCCNC1=CC(Cl)=CC=C1 SC-61711 [0,1,1,0,0,0|2,0,0]=4 171 B11R1.24 CCCNC1=CC(O)=CC=C1 SC-40621 [0,1,1,0,0,0|2,0,0]=4 172 B11R1.24 CCCNC1=CC=CC(Br)=C1 SC-61708 [0,1,1,0,0,0|2,0,0]=4 173 B11R1.24 CCCNC1=CC=CC(F)=C1 SC-61701 [0,1,1,0,0,0|2,0,0]=4 174 B11R1.24 CNCCC1=CC=CC(F)=C1 SC-27898 [0,1,1,0,0,0|2,0,0]=4 175 B11R1.24 NCCNC1=CC=CC(Br)=C1 SC-87827 [0,1,1,0,0,0|1,0,0]=3 176 B11R1.24 NNCCC1=CC=CC(Br)=C1 SC-60112 [0,1,1,0,0,0|1,0,0]=3 177 B11R1.24 NNCCC1=CC=CC(Cl)=C1 SC-59906 [0,1,1,0,0,0|1,0,0]=3 178 B11R1.24 NNCCC1=CC=CC(F)=C1 SC-62636 [0,1,1,0,0,0|1,0,0]=3 179 B11R1.24 O=CCCC1=CC(Br)=CC=C1 SC-61920 [0,1,1,0,0,0|1,0,1]=4 180 B11R1.24 OCCCC1=CC=CC(Br)=C1 SC-61919 [0,1,1,0,0,0|1,0,0]=3 181 B11R1.24 OCCNC1=CC=CC(Cl)=C1 SC-51268 [0,1,1,0,0,0|2,0,0]=4 182 B11R1.28 CCCCCC1=NC=CC=C1 SC-57942 [0,1,1,0,0,0|2,0,0]=4 183 B11R1.28 CCCCOC1=CC=CC=C1 SC-69204 [0,1,1,0,0,0|1,0,0]=3 184 B11R1.28 ClCCNCC1=CC=CC=C1 SC-73457 [0,1,1,0,0,0|1,0,0]=3 185 B11R1.28 N#CCCCC1=CC=NC=C1 SC-65473 [0,1,1,0,0,0|1,0,1]=4 186 B11R1.28 N#CCCNC1=CC=CC=C1 SC-00279 [0,1,1,0,0,0|0,0,2]=4 187 B11R1.28 NCCCOC1=CC=CC=C1 SC-40255 [0,1,1,0,0,0|0,0,0]=2 188 B11R1.28 NNCCCC1=CC=CN=C1 SC-41332 [0,1,1,0,0,0|1,0,0]=3 189 B11R1.28 NNCCCC1=CC=NC=C1 SC-42046 [0,1,1,0,0,0|1,0,0]=3 190 B11R1.28 NNCCCC1=NC=CC=C1 SC-41331 [0,1,1,0,0,0|1,0,0]=3 191 B11R1.28 NNCCOC1=CC=CC=C1 SC-59918 [0,1,1,0,0,0|1,0,0]=3 192 B11R1.28 NNC\C=C\C1=CC=CC=C1 SC-41340 [0,1,1,0,0,0|0,0,2]=4 193 B11R1.40 CC(CC1=CC=CC=C1)NN SC-39255 [0,1,1,0,0,0|1,0,0]=3 194 B11R1.40 CC(CN)CC1=CC=CC=C1 SC-14752 [0,1,1,0,0,0|0,0,0]=2 195 B11R1.40 NCC(=O)NC1=CC=CC=C1 SC-10461 [0,1,1,0,0,0|1,0,1]=4 196 B11R1.91 CC(N)CCC1=CC=CC=C1 SC-62200 [0,1,1,0,0,0|0,0,0]=2 197 B11R1.91 N=C(N)CCC1=CC=CC=C1 SC-39335 [0,1,1,0,0,0|0,0,1]=3 198 B11R1.91 N=C(N)CCC1=CC=CN=C1 SC-55394 [0,1,1,0,0,0|1,0,1]=4 199 B11R1.91 N=C(N)CCC1=CC=NC=C1 SC-62572 [0,1,1,0,0,0|1,0,1]=4 200 B11R1.91 N=C(N)CCC1=NC=CC=C1 SC-58525 [0,1,1,0,0,0|1,0,1]=4 201 B11R1.91 N=C(N)COC1=CC=CC=C1 SC-27806 [0,1,1,0,0,0|1,0,1]=4 202 B11R1.91 N=C(N)CSC1=CC=CC=C1 SC-40895 [0,1,1,0,0,0|1,0,1]=4 203 B11R1.91 O=C(O)CCC1=CC=CC=C1 SC-04862 [0,1,1,0,0,0|1,0,1]=4 204 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 SC-68717 [0,1,1,0,0,0|2,0,0]=4 205 B11R1.91 OB(O)CCC1=CC=CC=C1 SC-86482 [0,1,1,0,0,0|2,0,0]=4 206 B11R1.20 CC(=O)CC1=CC=C(N)C=C1 SC-69577 [0,1,1,0,0,0|1,0,1]=4 207 B11R1.20 CC1=CC=C(CC(=N)N)C=C1 SC-40675 [0,1,1,0,0,0|1,0,1]=4 208 B11R1.20 N=C(N)CC1=CC=C(Br)C=C1 SC-59656 [0,1,1,0,0,0|1,0,1]=4 209 B11R1.20 N=C(N)CC1=CC=C(Cl)C=C1 SC-12259 [0,1,1,0,0,0|1,0,1]=4 210 B11R1.20 N=C(N)CC1=CC=C(F)C=C1 SC-66419 [0,1,1,0,0,0|1,0,1]=4 211 B11R1.20 N=C(N)CC1=CC=C(I)C=C1 SC-40135 [0,1,1,0,0,0|1,0,1]=4 212 B11R1.20 N=C(N)CC1=CC=C(O)C=C1 SC-40367 [0,1,1,0,0,0|1,0,1]=4 213 B11R1.20 NC(=O)CC1=CC=C(Br)C=C1 SC-71656 [0,1,1,0,0,0|1,0,1]=4 214 B11R1.86 CC(=O)CC1=CC=CC=C1Br SC-62739 [0,1,1,0,0,0|1,0,1]=4 215 B11R1.86 CC(C)OC1=CC=CC=C1N SC-33822 [0,1,1,0,0,0|2,0,0]=4 216 B11R1.86 CC(N)CC1=CC=CC=C1O SC-60629 [0,1,1,0,0,0|0,0,0]=2 217 B11R1.86 CC1=CC=CC=C1CC(=N)N SC-40850 [0,1,1,0,0,0|1,0,1]=4 218 B11R1.86 CC1=CC=CC=C1CC(C)N SC-60647 [0,1,1,0,0,0|0,0,0]=2 219 B11R1.86 N=C(N)CC1=CC=CC=C1Br SC-39559 [0,1,1,0,0,0|1,0,1]=4 220 B11R1.86 N=C(N)CC1=CC=CC=C1Cl SC-24836 [0,1,1,0,0,0|1,0,1]=4 221 B11R1.86 N=C(N)CC1=CC=CC=C1F SC-40585 [0,1,1,0,0,0|1,0,1]=4 222 B11R1.86 N=C(N)CC1=CC=CC=C1I SC-38612 [0,1,1,0,0,0|1,0,1]=4 223 B11R1.157 CC(=S)CC1=CC=CC(Br)=C1 SC-42717 [0,1,1,0,0,0|1,0,1]=4 224 B11R1.157 CC(=S)CC1=CC=CC(Cl)=C1 SC-42467 [0,1,1,0,0,0|1,0,1]=4 225 B11R1.157 CC(N)CC1=CC(O)=CC=C1 SC-60630 [0,1,1,0,0,0|0,0,0]=2 226 B11R1.157 CC1=CC(CC(=N)N)=CC=C1 SC-40767 [0,1,1,0,0,0|1,0,1]=4 227 B11R1.157 N=C(N)CC1=CC(Cl)=CC=C1 SC-54617 [0,1,1,0,0,0|1,0,1]=4 228 B11R1.157 N=C(N)CC1=CC=CC(Br)=C1 SC-39099 [0,1,1,0,0,0|1,0,1]=4 229 B11R1.157 N=C(N)CC1=CC=CC(F)=C1 SC-40591 [0,1,1,0,0,0|1,0,1]=4 230 B11R1.157 N=C(N)CC1=CC=CC(I)=C1 SC-41590 [0,1,1,0,0,0|1,0,1]=4 231 B11R1.157 NC(=O)CC1=CC=CC(Br)=C1 SC-70178 [0,1,1,0,0,0|1,0,1]=4 232 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SC-19169 [0,1,1,0,0,0|2,0,0]=4 233 B11R2.34 BrC1=CC=C(C2CC2)C=C1 SC-37144 [1,1,0,0,0,0|0,0,0]=2 234 B11R2.34 BrC1=CC=C(C2CO2)C=C1 SC-08768 [1,1,0,0,0,0|1,0,0]=3 235 B11R2.34 FC1=CC=C([C@@H]2CO2)C=C1 SC-48526 [1,1,0,0,0,0|1,0,0]=3 236 B11R2.34 FC1=CC=C([C@@H]2CO2)C=C1 SC-65914 [1,1,0,0,0,0|1,0,0]=3 237 B11R2.35 BrC1=CC(C2CC2)=NC=C1 SC-52593 [1,1,0,0,0,0|1,0,0]=3 238 B11R2.35 BrC1=CC=CC(C2CC2)=C1 SC-35808 [1,1,0,0,0,0|0,0,0]=2 239 B11R2.35 ClC1=CC=CC(C2CO2)=C1 SC-00466 [1,1,0,0,0,0|1,0,0]=3 240 B11R2.35 IC1=CC(C2CC2)=CC=C1 SC-36741 [1,1,0,0,0,0|0,0,0]=2 241 B11R2.40 NC1(C2=CC=CC=N2)CC1 SC-24383 [1,1,0,0,0,0|1,0,0]=3 242 B11R2.40 NC1(C2=NC=CC=C2)CC1 SC-53605 [1,1,0,0,0,0|1,0,0]=3 243 B11R2.55 NC1=CC=CC=C1C2CC2 SC-37470 [1,1,0,0,0,0|0,0,0]=2 244 B13R2.147 CC1=CC=C(C2CC(=O)C2)C=C1 SC-36009 [0,1,0,0,0,1|1,0,1]=4 245 B13R2.147 O=C1CC(C2=CC=C(Br)C=C2)C1 SC-35818 [0,1,0,0,0,1|1,0,1]=4 246 B13R2.147 O=C1CC(C2=CC=C(F)C=C2)C1 SC-36161 [0,1,0,0,0,1|1,0,1]=4 247 B13R2.151 CC1=CC(C2CC(=O)C2)=CC=C1 SC-36042 [0,1,0,0,0,1|1,0,1]=4 248 B13R2.151 O=C1CC(C2=CC(Cl)=CC=C2)C1 SC-35976 [0,1,0,0,0,1|1,0,1]=4 249 B13R2.151 O=C1CC(C2=CC=CC(F)=C2)C1 SC-36160 [0,1,0,0,0,1|1,0,1]=4 250 B13R2.216 O=C1CC(C2=CC=CC=C2Br)C1 SC-36014 [0,1,0,0,0,1|1,0,1]=4 251 B13R2.216 O=C1CC(C2=CC=CC=C2Cl)C1 SC-36056 [0,1,0,0,0,1|1,0,1]=4 252 B13R2.216 O=C1CC(C2=CC=CC=C2F)C1 SC-35892 [0,1,0,0,0,1|1,0,1]=4 253 B13R2.373 O=C1N[C@@H](C2=CC=CC=C2)[C@H]1O SC-53659 [0,1,0,0,0,1|1,0,1]=4 254 B13R2.423 O=C(Cl)[C@H]1C[C@H]1C2=CC=CC=C2 SC-60997 [0,2,0,0,0,0|1,0,0]=3 255 B13R2.2988 ClC1=CC=C(C2CC2(Br)Br)C=C1 SC-73808 [0,2,0,0,0,0|1,0,0]=3 256 B11R2.1 BrC1CCC2=C1C=CC=C2 SC-87562 [0,0,1,1,0,0|2,0,0]=4 257 B11R2.1 CC1=NNC2=C1C=CC=C2 SC-03389 [0,0,1,1,0,0|1,0,1]=4 258 B11R2.1 NC1CCC2=C1C=CC=C2 SC-18671 [0,0,1,1,0,0|2,0,0]=4 259 B11R2.1 NC1CCC2=C1C=CC=C2 SC-19649 [0,0,1,1,0,0|2,0,0]=4 260 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 SC-19800 [0,0,1,1,0,0|2,0,0]=4 261 B11R2.239 C1=CN=CC(C2CNC2)=C1 SC-70782 [0,0,1,1,0,0|1,0,0]=3 262 B11R2.20 C1=CC2=C(C=C1)CCCC2 SC-79751 [0,0,1,1,0,0|1,0,0]=3 263 B11R2.20 C1=CC2=C(C=C1)NCCC2 SC-05980 [0,0,1,1,0,0|0,0,0]=2 264 B11R2.20 C1=CC2=C(C=N1)CCCN2 SC-32602 [0,0,1,1,0,0|1,0,0]=3 265 B11R2.20 C1=CC2=C(C=N1)NCCC2 SC-29993 [0,0,1,1,0,0|1,0,0]=3 266 B11R2.20 C1=CC2=C(N=C1)NCCC2 SC-14758 [0,0,1,1,0,0|1,0,0]=3 267 B11R2.20 C1=CC2=C(N=C1)NCCO2 SC-32974 [0,0,1,1,0,0|2,0,0]=4 268 B11R2.20 C1=CC=C2OCCOC2=C1 SC-73561 [0,0,1,1,0,0|2,0,0]=4 269 B11R2.20 C1=CN=C2CCCOC2=C1 SC-49047 [0,0,1,1,0,0|2,0,0]=4 270 B11R2.20 C1=NC=C2OCCNC2=C1 SC-51252 [0,0,1,1,0,0|2,0,0]=4 271 B11R2.10 CC1=CC2=C(C=CC=C2)N1 SC-25318 [0,0,1,1,0,0|0,0,2]=4 272 B11R2.10 S=C1CC2=CC=CC=C2N1 SC-53242 [0,0,1,1,0,0|1,0,1]=4 273 B9R1.11 CC(NN)C1=CC=CN1 SC-39030 [0,0,1,0,1,0|2,0,0]=4 274 B9R1.11 CC(NN)C1=CC=CO1 SC-38756 [0,0,1,0,1,0|2,0,0]=4 275 B9R1.11 CC(NN)C1=CC=CS1 SC-38803 [0,0,1,0,1,0|2,0,0]=4 276 B9R1.11 NCC(O)C1=CC=CO1 SC-22230 [0,0,1,0,1,0|2,0,0]=4 277 B9R1.12 CCCCN1C=CC=C1 SC-52526 [0,0,1,0,1,0|2,0,0]=4 278 B9R1.12 NCCCN1C=CC=C1 SC-39927 [0,0,1,0,1,0|1,0,0]=3 279 B9R1.12 NNCCC1=CC=CS1 SC-59916 [0,0,1,0,1,0|2,0,0]=4 280 B9R1.12 OCCCC1=CC=CS1 SC-26610 [0,0,1,0,1,0|2,0,0]=4 281 B13R2.17 NC1CC1OCC2=CC=CC=C2 SC-66099 [0,0,0,0,0,2|0,0,0]=2 282 B13R2.31 O=C1CC(CC2=CC=CC=C2)C1 SC-36029 [0,0,0,0,0,2|1,0,1]=4 283 B13R2.10 CC1COC(C2=CC=CC=C2)O1 SC-93541 [0,0,0,0,0,2|1,0,0]=3 284 B13R2.10 O=C1NCC(C2=CC=CC=C2)N1 SC-89145 [0,0,0,0,0,2|1,0,1]=4 285 B13R2.10 O=C1NCC(C2=CC=CC=C2)O1 SC-49190 [0,0,0,0,0,2|1,0,1]=4 286 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CO1 SC-17369 [0,0,0,0,0,2|1,0,1]=4 287 B13R2.10 [C@@H]1(C2=CC=CC=C2)COC(=S)N1 SC-25816 [0,0,0,0,0,2|1,0,1]=4 288 B13R2.10 [C@H]1(C2=CC=CC=C2)CSC(=S)N1 SC-17058 [0,0,0,0,0,2|1,0,1]=4 289 B13R2.15 O=C1CCCC1C2=CC=CC=C2 SC-36875 [0,0,0,0,0,2|1,0,1]=4 290 B13R2.15 O=C1OCCC1C2=CC=CC=C2 SC-36254 [0,0,0,0,0,2|1,0,1]=4