0 B10R1.17 C#CCNC1=NC=CC=C1 CS-0094837 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.17 C=COCC1=CC=CC=C1 CS-0049793 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.17 CCNCC1=CC=CN=C1 CS-0088368 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.17 NCCOC1=CC=NC=C1 CS-0096297 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.17 O=CCSC1=CC=CC=C1 CS-0102366 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.17 O=CNCC1=CC=CC=C1 CS-0009966 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.17 OCCCC1=CCC=CC1 CS-0015961 [0,0,0,0,0,0|2,0,2]=4 7 B9R1.8 C#CCC1=CC=CC=C1 CS-0112571 [1,0,0,0,0,0|0,0,2]=3 8 B9R1.8 CCNC1=CC=CN=C1 CS-0089664 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.8 CNCC1=CC=CC=C1 CS-W007426 [1,0,0,0,0,0|0,0,0]=1 10 B9R1.8 CNCC1=CC=CN=C1 CS-0020099 [1,0,0,0,0,0|1,0,0]=2 11 B9R1.8 CNCC1=CN=CN=C1 CS-0048870 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.8 CNCC1=NC=CC=C1 CS-0038433 [1,0,0,0,0,0|1,0,0]=2 13 B9R1.8 CNCC1=NC=CC=N1 CS-0048864 [1,0,0,0,0,0|2,0,0]=3 14 B9R1.8 ClCCC1=NC=CC=C1 CS-0096286 [1,0,0,0,0,0|2,0,0]=3 15 B9R1.8 NCCC1=NC=NC=C1 CS-0057455 [1,0,0,0,0,0|2,0,0]=3 16 B9R1.8 NNCC1=CC=NC=C1 CS-0051151 [1,0,0,0,0,0|2,0,0]=3 17 B9R1.8 NNCC1=CN=CC=C1 CS-0051688 [1,0,0,0,0,0|2,0,0]=3 18 B9R1.8 NNCC1=NC=CC=C1 CS-0052228 [1,0,0,0,0,0|2,0,0]=3 19 B9R1.8 OCCC1=NN=CC=C1 CS-0112570 [1,0,0,0,0,0|3,0,0]=4 20 B11R1.1 C#CCCC1=CC=C(Cl)C=C1 CS-0094865 [0,1,0,0,0,0|1,0,1]=3 21 B11R1.1 C#CCNC1=CC=C(Cl)C=C1 CS-0094915 [0,1,0,0,0,0|2,0,1]=4 22 B11R1.1 CC1=CC=C(CSC#N)C=C1 CS-0036549 [0,1,0,0,0,0|3,0,0]=4 23 B11R1.1 CC1=NC=C(CCCN)C=C1 CS-0036094 [0,1,0,0,0,0|3,0,0]=4 24 B11R1.1 N#CCOC1=CC=C(Cl)C=C1 CS-0052273 [0,1,0,0,0,0|3,0,0]=4 25 B11R1.1 NC1=CC=C(CCCO)C=C1 CS-0112322 [0,1,0,0,0,0|2,0,0]=3 26 B11R1.1 NCCOC1=CC=C(F)C=C1 CS-0060259 [0,1,0,0,0,0|3,0,0]=4 27 B11R1.1 O=CCCC1=CC=C(O)C=C1 CS-0001404 [0,1,0,0,0,0|2,0,0]=3 28 B11R1.1 OCCCC1=CN=C(Br)C=C1 CS-0035533 [0,1,0,0,0,0|3,0,0]=4 29 B11R1.16 NCCC(=O)C1=CC=CC=C1 CS-0105553 [0,1,0,0,0,0|2,0,1]=4 30 B11R1.16 OCCC(O)C1=CC=NC=C1 CS-0105365 [0,1,0,0,0,0|3,0,0]=4 31 B11R1.16 OCC[C@H](O)C1=CC=NC=C1 CS-0113180 [0,1,0,0,0,0|3,0,0]=4 32 B11R1.17 OCCCC1=C(O)C=CN=C1 CS-0081574 [0,1,0,0,0,0|3,0,0]=4 33 B11R1.24 C#CCCC1=CC=CC(Cl)=C1 CS-0094867 [0,1,0,0,0,0|1,0,1]=3 34 B11R1.24 CC1=CC(CCC=O)=CC=C1 CS-B1501 [0,1,0,0,0,0|2,0,0]=3 35 B11R1.24 NCCCC1=CC(O)=CC=C1 CS-0044503 [0,1,0,0,0,0|2,0,0]=3 36 B11R1.24 OCCCC1=CC=CC(F)=C1 CS-0111676 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.28 C#CCNCC1=CC=CN=C1 CS-0100753 [0,1,0,0,0,0|2,0,1]=4 38 B11R1.28 CC#CCOC1=CC=CC=C1 CS-0059947 [0,1,0,0,0,0|1,0,1]=3 39 B11R1.28 CCCC#CC1=CC=CC=C1 CS-0066389 [0,1,0,0,0,0|1,0,1]=3 40 B11R1.28 CNCCOC1=CC=CC=C1 CS-0096259 [0,1,0,0,0,0|0,0,0]=1 41 B11R1.28 NCCCOC1=CC=CC=C1 CS-0046980 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.40 CCC(=O)CC1=CC=CC=C1 CS-0112591 [0,1,0,0,0,0|1,0,1]=3 43 B11R1.40 CNC(=O)NC1=CC=CC=C1 CS-0112589 [0,1,0,0,0,0|1,0,1]=3 44 B11R1.40 N#CC(N)CC1=CC=CC=C1 CS-0104822 [0,1,0,0,0,0|2,0,0]=3 45 B11R1.40 N#C[C@@H](N)CC1=CC=CC=C1 CS-0112121 [0,1,0,0,0,0|2,0,0]=3 46 B11R1.40 NNC(=O)CC1=NC=CC=C1 CS-0093823 [0,1,0,0,0,0|2,0,1]=4 47 B11R1.40 NNC(=O)C[N+]1=CC=CC=C1 CS-0113182 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.40 NNC(=O)NC1=CC=CC=C1 CS-0100039 [0,1,0,0,0,0|2,0,1]=4 49 B11R1.91 NC(=O)CCC1=CC=CC=C1 CS-0037177 [0,1,0,0,0,0|2,0,0]=3 50 B11R1.91 O=C(O)CCC1=CC=CC=N1 CS-0060616 [0,1,0,0,0,0|3,0,0]=4 51 B11R2.1 CN1C=NC2=C1N=CC=C2 CS-0081071 [0,0,0,1,0,0|2,0,1]=4 52 B11R2.1 C[N+]1=CSC2=CC=CC=C21 CS-0112720 [0,0,0,1,0,0|1,0,2]=4 53 B11R2.1 NC1CCC2=CC=NC=C21 CS-0077310 [0,0,0,1,0,0|3,0,0]=4 54 B11R2.1 NC1CCC2=NC=CC=C21 CS-0084861 [0,0,0,1,0,0|3,0,0]=4 55 B11R2.1 NN1N=CC2=CC=CC=C21 CS-0060586 [0,0,0,1,0,0|2,0,1]=4 56 B11R2.1 OC1CCC2=C1C=CC=N2 CS-0060663 [0,0,0,1,0,0|3,0,0]=4 57 B11R2.1 O[C@H]1CCC2=C1C=CC=N2 CS-0069940 [0,0,0,1,0,0|3,0,0]=4 58 B11R2.1 O[C@H]1CCC2=C1C=CN=C2 CS-0069933 [0,0,0,1,0,0|3,0,0]=4 59 B11R2.4 NC1CC1C2=CC=CC=C2 CS-0091206 [0,0,0,1,0,0|2,0,0]=3 60 B11R2.4 N[C@@H]1C[C@@H]1C2=CC=CC=C2 CS-0049739 [0,0,0,1,0,0|2,0,0]=3 61 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 CS-0012736 [0,0,0,1,0,0|2,0,0]=3 62 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 CS-0020035 [0,0,0,1,0,0|2,0,0]=3 63 B11R2.20 C1=CC2=C(CNCC2)N=C1 CS-0050731 [0,0,0,1,0,0|1,0,0]=2 64 B11R2.20 C1=CC=C2CONCC2=C1 CS-0079743 [0,0,0,1,0,0|1,0,0]=2 65 B11R2.20 C1=NC=C2NCCCC2=C1 CS-0099940 [0,0,0,1,0,0|3,0,0]=4 66 B11R2.238 C1=CC=C(CC2CO2)C=C1 CS-0106157 [0,0,0,1,0,0|1,0,0]=2 67 B11R2.239 C1=CN=C(C2CNC2)N=C1 CS-0029549 [0,0,0,1,0,0|2,0,0]=3 68 B9R1.12 CNCCN1C=NC=N1 CS-0106199 [0,0,0,0,1,0|3,0,0]=4 69 B8R1.2 CNC1=CN=CN=C1 CS-0048860 [2,0,0,0,0,0|2,0,0]=4 70 B8R1.2 CNC1=CN=NC=C1 CS-0061786 [2,0,0,0,0,0|2,0,0]=4 71 B8R1.2 FCC1=CC=NC=C1 CS-0084824 [2,0,0,0,0,0|2,0,0]=4 72 B8R1.2 NCC1=CC=CC=C1 CS-0005944 [2,0,0,0,0,0|0,0,0]=2 73 B8R1.2 NCC1=CC=CN=N1 CS-0048737 [2,0,0,0,0,0|2,0,0]=4 74 B8R1.2 NCC1=CC=NC=N1 CS-0048728 [2,0,0,0,0,0|2,0,0]=4 75 B8R1.2 NCC1=CC=NN=C1 CS-0048736 [2,0,0,0,0,0|2,0,0]=4 76 B8R1.2 NCC1=CN=CN=C1 CS-0053092 [2,0,0,0,0,0|2,0,0]=4 77 B8R1.2 NCC1=NC=CC=N1 CS-W008578 [2,0,0,0,0,0|2,0,0]=4 78 B8R1.2 NCC1=NC=CN=C1 CS-W018519 [2,0,0,0,0,0|2,0,0]=4 79 B8R1.2 NCC1=NC=NC=C1 CS-0048729 [2,0,0,0,0,0|2,0,0]=4 80 B8R1.2 NCC1=NN=CC=C1 CS-W006277 [2,0,0,0,0,0|2,0,0]=4 81 B8R1.2 NNC1=CC=CN=C1 CS-0022347 [2,0,0,0,0,0|2,0,0]=4 82 B10R1.1 BrC1=CC=C(CCI)C=C1 CS-0060220 [1,1,0,0,0,0|1,0,0]=3 83 B10R1.1 C#CCC1=CC=C(Cl)C=C1 CS-0094847 [1,1,0,0,0,0|0,0,2]=4 84 B10R1.1 CC1=CC=C(CC=O)C=C1 CS-0019984 [1,1,0,0,0,0|1,0,1]=4 85 B10R1.1 CCOC1=CC=C(Cl)C=N1 CS-0061649 [1,1,0,0,0,0|2,0,0]=4 86 B10R1.1 CCOC1=CC=C(O)C=N1 CS-0090994 [1,1,0,0,0,0|2,0,0]=4 87 B10R1.1 CCOC1=NC=C(F)C=C1 CS-0090644 [1,1,0,0,0,0|2,0,0]=4 88 B10R1.1 FC1=CC=C(CCBr)C=C1 CS-D1609 [1,1,0,0,0,0|1,0,0]=3 89 B10R1.1 NCCC1=CC=C(Br)C=N1 CS-0052266 [1,1,0,0,0,0|1,0,0]=3 90 B10R1.1 NNCC1=CC=C(Br)C=C1 CS-0053038 [1,1,0,0,0,0|1,0,0]=3 91 B10R1.1 NNCC1=CC=C(Cl)C=C1 CS-0037878 [1,1,0,0,0,0|1,0,0]=3 92 B10R1.1 NNCC1=CC=C(F)C=C1 CS-0053037 [1,1,0,0,0,0|1,0,0]=3 93 B10R1.1 NNCC1=CN=C(Cl)C=C1 CS-0060453 [1,1,0,0,0,0|2,0,0]=4 94 B10R1.1 O=CCC1=CC=C(Br)C=C1 CS-W019773 [1,1,0,0,0,0|1,0,1]=4 95 B10R1.1 OCCC1=CC=C(Br)C=N1 CS-0052265 [1,1,0,0,0,0|2,0,0]=4 96 B10R1.4 CC1=CC=CC=C1CC=O CS-0038162 [1,1,0,0,0,0|1,0,1]=4 97 B10R1.4 CC1=CC=CC=C1CON CS-0080700 [1,1,0,0,0,0|1,0,0]=3 98 B10R1.4 CCNC1=CC=CC=C1O CS-0061529 [1,1,0,0,0,0|1,0,0]=3 99 B10R1.4 CCOC1=C(Cl)C=CC=N1 CS-0061644 [1,1,0,0,0,0|2,0,0]=4 100 B10R1.4 CCOC1=C(Cl)N=CC=C1 CS-0061645 [1,1,0,0,0,0|2,0,0]=4 101 B10R1.4 NCCC1=NC=CC=C1Br CS-0052284 [1,1,0,0,0,0|1,0,0]=3 102 B10R1.4 NNCC1=C(Br)C=CC=C1 CS-0053075 [1,1,0,0,0,0|1,0,0]=3 103 B10R1.4 NNCC1=C(Cl)C=CC=C1 CS-0053073 [1,1,0,0,0,0|1,0,0]=3 104 B10R1.4 NNCC1=C(F)C=CC=C1 CS-0053072 [1,1,0,0,0,0|1,0,0]=3 105 B10R1.4 NNCC1=CC=CC=C1Cl CS-0036680 [1,1,0,0,0,0|1,0,0]=3 106 B10R1.4 O=CCC1=CC=CC=C1Br CS-0038248 [1,1,0,0,0,0|1,0,1]=4 107 B10R1.4 O=CCC1=CC=CC=C1Cl CS-0038107 [1,1,0,0,0,0|1,0,1]=4 108 B10R1.4 O=CCC1=CC=CC=C1F CS-0038111 [1,1,0,0,0,0|1,0,1]=4 109 B10R1.4 OCCC1=C(Br)C=NC=C1 CS-0112722 [1,1,0,0,0,0|2,0,0]=4 110 B10R1.4 OCCC1=NC=CC=C1F CS-0052281 [1,1,0,0,0,0|2,0,0]=4 111 B10R1.10 C#CCC1=CC(Cl)=CC=C1 CS-0094861 [1,1,0,0,0,0|0,0,2]=4 112 B10R1.10 CC1=CC(CC=O)=CC=C1 CS-0038249 [1,1,0,0,0,0|1,0,1]=4 113 B10R1.10 CC1=CC(CCO)=CC=C1 CS-0038545 [1,1,0,0,0,0|1,0,0]=3 114 B10R1.10 CC1=CC(CON)=CC=C1 CS-0080701 [1,1,0,0,0,0|1,0,0]=3 115 B10R1.10 CCCC1=CC=CC(Br)=C1 CS-0060101 [1,1,0,0,0,0|0,0,0]=2 116 B10R1.10 CCCC1=NC=CC(Br)=C1 CS-0038070 [1,1,0,0,0,0|1,0,0]=3 117 B10R1.10 CCNC1=NC(Br)=CC=C1 CS-0112949 [1,1,0,0,0,0|2,0,0]=4 118 B10R1.10 CCOC1=CC(N)=NC=C1 CS-0005491 [1,1,0,0,0,0|2,0,0]=4 119 B10R1.10 CCOC1=CC=CC(=N)N1 CS-0061653 [1,1,0,0,0,0|2,0,0]=4 120 B10R1.10 CCOC1=NC=CC(Cl)=C1 CS-0037856 [1,1,0,0,0,0|2,0,0]=4 121 B10R1.10 COCC1=CC(Br)=CN=C1 CS-0062025 [1,1,0,0,0,0|2,0,0]=4 122 B10R1.10 CSCC1=CC(Br)=CC=C1 CS-0037537 [1,1,0,0,0,0|1,0,0]=3 123 B10R1.10 NNCC1=CC(Cl)=CC=C1 CS-0053053 [1,1,0,0,0,0|1,0,0]=3 124 B10R1.10 NNCC1=CC(F)=CC=C1 CS-0053051 [1,1,0,0,0,0|1,0,0]=3 125 B10R1.10 O=CCC1=CC(Br)=CC=C1 CS-0038245 [1,1,0,0,0,0|1,0,1]=4 126 B10R1.10 O=CCC1=CC(F)=CC=C1 CS-0038688 [1,1,0,0,0,0|1,0,1]=4 127 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 CS-0109601 [1,1,0,0,0,0|0,0,2]=4 128 B10R1.15 C#C[C@H](O)C1=CC=CC=C1 CS-0109874 [1,1,0,0,0,0|0,0,2]=4 129 B10R1.15 CC(ON)C1=CC=CC=C1 CS-0080699 [1,1,0,0,0,0|1,0,0]=3 130 B10R1.15 CC(ON)C1=NC=CC=C1 CS-0079738 [1,1,0,0,0,0|2,0,0]=4 131 B10R1.15 CCC(Br)C1=CC=CC=C1 CS-0037459 [1,1,0,0,0,0|0,0,0]=2 132 B10R1.15 COC(=N)C1=CC=CC=C1 CS-0037087 [1,1,0,0,0,0|1,0,1]=4 133 B10R1.15 NC(CO)C1=CC=CC=N1 CS-0089917 [1,1,0,0,0,0|2,0,0]=4 134 B10R1.15 NC(CO)C1=CC=NC=C1 CS-0089931 [1,1,0,0,0,0|2,0,0]=4 135 B10R1.15 NC(CO)C1=NC=CC=C1 CS-0091444 [1,1,0,0,0,0|2,0,0]=4 136 B10R1.15 N[C@H](CF)C1=CC=CC=C1 CS-0035746 [1,1,0,0,0,0|1,0,0]=3 137 B10R1.15 O=C(CF)C1=CC=CC=C1 CS-0037091 [1,1,0,0,0,0|1,0,1]=4 138 B10R1.15 OCC(O)C1=CC=CC=C1 CS-W016504 [1,1,0,0,0,0|1,0,0]=3 139 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 CS-W011049 [1,1,0,0,0,0|1,0,0]=3 140 B10R1.18 FC(F)SC1=CC=CC=C1 CS-0060568 [1,1,0,0,0,0|2,0,0]=4 141 B10R1.29 CCCCC1=C(Br)SC=C1 CS-0106562 [0,1,0,0,1,0|2,0,0]=4 142 B10R1.29 CNCCN1C=CN=C1C CS-0098940 [0,1,0,0,1,0|2,0,0]=4 143 B12R1.1 COCCOC1=CC=C(N)C=C1 CS-W008998 [0,2,0,0,0,0|1,0,0]=3 144 B12R1.1 COCCOC1=NC=C(F)C=C1 CS-0088292 [0,2,0,0,0,0|2,0,0]=4 145 B12R1.1 NC1=CC=C(CCCCO)C=C1 CS-0099969 [0,2,0,0,0,0|1,0,0]=3 146 B12R1.1 NCCCCC1=CC=C(Cl)C=C1 CS-0059809 [0,2,0,0,0,0|1,0,0]=3 147 B12R1.1 OCCCCC1=CC=C(Br)C=C1 CS-0100034 [0,2,0,0,0,0|1,0,0]=3 148 B12R1.21 NC(=O)CCC1=CC=C(N)C=C1 CS-0096223 [0,2,0,0,0,0|2,0,0]=4 149 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 CS-0072209 [0,2,0,0,0,0|2,0,0]=4 150 B12R1.49 CNC(=O)CC1=CC=C(O)C=C1 CS-0061780 [0,2,0,0,0,0|0,0,1]=3 151 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 CS-0099715 [0,2,0,0,0,0|1,0,1]=4 152 B12R1.71 C#CC1=CC=C(OCCC)C=C1 CS-0061507 [0,2,0,0,0,0|2,0,0]=4 153 B12R1.71 C#CCCC1=CC=C(OC)C=C1 CS-0094866 [0,2,0,0,0,0|1,0,1]=4 154 B12R1.71 C=CC1=CC=C(CCCN)C=C1 CS-0059914 [0,2,0,0,0,0|2,0,0]=4 155 B12R1.71 CCNCC1=CC=C(OC)C=C1 CS-D0539 [0,2,0,0,0,0|2,0,0]=4 156 B12R1.71 COC1=CC=C(CCCCl)C=C1 CS-0097097 [0,2,0,0,0,0|2,0,0]=4 157 B12R1.385 COCOC1=CC=C(C)C(Br)=C1 CS-0095769 [0,2,0,0,0,0|2,0,0]=4 158 B12R1.17 OCC[C@H](O)C1=CC=CC(Cl)=C1 CS-0112889 [0,2,0,0,0,0|2,0,0]=4 159 B12R1.30 CCOC[C@H](N)C1=CC=CC=C1 CS-0093638 [0,2,0,0,0,0|1,0,0]=3 160 B12R1.30 CCOC[C@H](N)C1=CC=CC=C1 CS-0093641 [0,2,0,0,0,0|1,0,0]=3 161 B12R1.34 COC(=O)C(Br)C1=CC=CC=C1 CS-M0641 [0,2,0,0,0,0|1,0,1]=4 162 B12R1.34 COC(=O)[C@H](C)C1=CC=CC=C1 CS-0061793 [0,2,0,0,0,0|1,0,1]=4 163 B12R1.107 C[C@@H](CC(=O)O)C1=CC=CC=C1 CS-0106072 [0,2,0,0,0,0|2,0,0]=4 164 B12R1.107 C[C@H](CC(=O)O)C1=CC=CC=C1 CS-0066979 [0,2,0,0,0,0|2,0,0]=4 165 B12R1.25 COCOC1=C(Br)C(F)=CC=C1 CS-0095771 [0,2,0,0,0,0|2,0,0]=4 166 B12R1.25 COCOC1=CC=CC(C)=C1Br CS-0095710 [0,2,0,0,0,0|2,0,0]=4 167 B12R1.125 CC(=O)SCC1=CC=CC=C1Cl CS-0036273 [0,2,0,0,0,0|2,0,0]=4 168 B12R1.125 CC(C)=CCC1=C(N)C=CC=C1 CS-0112107 [0,2,0,0,0,0|1,0,1]=4 169 B12R1.125 CC(C)CCC1=CC=CC=C1N CS-0106461 [0,2,0,0,0,0|1,0,0]=3 170 B12R1.125 CC1=C(CNC(C)C)C=CC=C1 CS-0061043 [0,2,0,0,0,0|2,0,0]=4 171 B12R1.267 N#CCCOC1=CC=CC=C1Br CS-0060464 [0,2,0,0,0,0|2,0,0]=4 172 B12R1.371 CNC(=O)CC1=C(Br)C=CC=C1 CS-0035872 [0,2,0,0,0,0|0,0,1]=3 173 B12R1.371 CNC(=O)CC1=CC=CC=C1Cl CS-0037557 [0,2,0,0,0,0|0,0,1]=3 174 B12R1.371 COC(=O)CC1=CC=CC=C1F CS-0061879 [0,2,0,0,0,0|1,0,1]=4 175 B12R1.371 NNC(=O)CC1=C(F)C=CC=C1 CS-0099915 [0,2,0,0,0,0|1,0,1]=4 176 B12R1.374 CCCOC1=CC(N)=CC=C1F CS-0093474 [0,2,0,0,0,0|2,0,0]=4 177 B12R1.374 CCNCC1=CC(Br)=CC=C1O CS-0061530 [0,2,0,0,0,0|2,0,0]=4 178 B12R1.50 COC(=O)CC1=CC(N)=CC=C1 CS-W004989 [0,2,0,0,0,0|1,0,1]=4 179 B12R1.50 N=C(CC1=CC=CC(Br)=C1)NO CS-0037376 [0,2,0,0,0,0|1,0,1]=4 180 B12R1.226 CC(=O)NCC1=CC(N)=CC=C1 CS-0098160 [0,2,0,0,0,0|2,0,0]=4 181 B12R1.382 C#CCCC1=CC=CC(OC)=C1 CS-0094863 [0,2,0,0,0,0|1,0,1]=4 182 B12R1.8 C#CCNCCC1=CC=CC=C1 CS-0094897 [0,2,0,0,0,0|0,0,0]=2 183 B12R1.8 C=CCCNCC1=CC=CC=C1 CS-0035925 [0,2,0,0,0,0|1,0,1]=4 184 B12R1.8 NCCCCCC1=CC=CC=C1 CS-0096226 [0,2,0,0,0,0|1,0,0]=3 185 B12R1.8 OCCCNCC1=CC=CC=C1 CS-0038216 [0,2,0,0,0,0|1,0,0]=3 186 B12R1.8 OCCC\C=C\C1=CC=CC=C1 CS-0078210 [0,2,0,0,0,0|1,0,1]=4 187 B12R1.27 NCC(F)CCC1=CC=CC=C1 CS-0106176 [0,2,0,0,0,0|1,0,0]=3 188 B12R1.32 CCOC(=O)CC1=CC=CC=C1 CS-W016087 [0,2,0,0,0,0|1,0,1]=4 189 B12R1.32 NCCC(F)CC1=CC=CC=C1 CS-0106177 [0,2,0,0,0,0|1,0,0]=3 190 B12R1.252 [C@@H](C)(O)COCC1=CC=CC=C1 CS-W017736 [0,2,0,0,0,0|1,0,0]=3 191 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O CS-0106156 [0,2,0,0,0,0|2,0,0]=4 192 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 CS-0060520 [0,2,0,0,0,0|2,0,0]=4 193 B12R1.194 C#CC(C)(C)CC1=CC=CC=C1 CS-0053540 [0,2,0,0,0,0|1,0,1]=4 194 B10R2.7 C1=CC2=C(C=N1)CCO2 CS-0091894 [1,0,0,1,0,0|2,0,0]=4 195 B10R2.7 C1=CC2=C(C=N1)CNC2 CS-D0313 [1,0,0,1,0,0|1,0,0]=3 196 B10R2.7 C1=CC2=C(CNC2)N=C1 CS-W005091 [1,0,0,1,0,0|1,0,0]=3 197 B10R2.7 C1=CN=C2CNCC2=N1 CS-0060730 [1,0,0,1,0,0|2,0,0]=4 198 B10R2.7 C1=NC=C2CNCC2=N1 CS-0038833 [1,0,0,1,0,0|2,0,0]=4 199 B12R2.24 BrC1=CC2=C(C=C1)CNCC2 CS-W019599 [0,1,0,1,0,0|0,0,0]=2 200 B12R2.24 BrC1=CC2=C(C=N1)CCCC2 CS-0105670 [0,1,0,1,0,0|2,0,0]=4 201 B12R2.24 BrC1=CC=C2CCCOC2=C1 CS-0028282 [0,1,0,1,0,0|2,0,0]=4 202 B12R2.24 BrC1=CN=C2CCNCC2=C1 CS-0041451 [0,1,0,1,0,0|1,0,0]=3 203 B12R2.24 BrC1=NC2=C(C=C1)CCCC2 CS-0102429 [0,1,0,1,0,0|2,0,0]=4 204 B12R2.24 BrC1=NC2=C(C=C1)CNCC2 CS-0099546 [0,1,0,1,0,0|1,0,0]=3 205 B12R2.24 CC1=CC2=C(CCCC2)N=C1 CS-0102418 [0,1,0,1,0,0|2,0,0]=4 206 B12R2.24 CC1=NC2=C(C=N1)CNCC2 CS-0092013 [0,1,0,1,0,0|2,0,0]=4 207 B12R2.24 CC1CNC2=CC=CC=C2S1 CS-0094330 [0,1,0,1,0,0|2,0,0]=4 208 B12R2.24 CC1COC2=C(C=CC=C2)N1 CS-0037800 [0,1,0,1,0,0|2,0,0]=4 209 B12R2.24 CC1CSC2=CC=CC=C2N1 CS-0100717 [0,1,0,1,0,0|2,0,0]=4 210 B12R2.24 ClC1=CC2=C(C=N1)CCCC2 CS-0105671 [0,1,0,1,0,0|2,0,0]=4 211 B12R2.24 ClC1=CC=C2CCNCC2=C1 CS-0036914 [0,1,0,1,0,0|0,0,0]=2 212 B12R2.24 ClC1=NC2=C(C=C1)CCNC2 CS-0105502 [0,1,0,1,0,0|1,0,0]=3 213 B12R2.24 ClC1=NC2=C(C=C1)CCNC2 CS-0105504 [0,1,0,1,0,0|1,0,0]=3 214 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 CS-0099551 [0,1,0,1,0,0|1,0,0]=3 215 B12R2.24 ClC1=NC=C2CNCCC2=C1 CS-0112252 [0,1,0,1,0,0|1,0,0]=3 216 B12R2.24 ClC1=NC=C2CNCCC2=N1 CS-0051952 [0,1,0,1,0,0|2,0,0]=4 217 B12R2.24 ClC1=NC=C2CNCCC2=N1 CS-D0302 [0,1,0,1,0,0|2,0,0]=4 218 B12R2.24 NC1=NC2=C(C=C1)CCCC2 CS-0102425 [0,1,0,1,0,0|2,0,0]=4 219 B12R2.24 NC1=NC2=C(C=N1)CNCC2 CS-0084392 [0,1,0,1,0,0|2,0,0]=4 220 B12R2.24 NC1CCC2=C(C1)N=CC=C2 CS-0102430 [0,1,0,1,0,0|2,0,0]=4 221 B12R2.24 NC1CNC2=CC=CC=C2C1 CS-W021270 [0,1,0,1,0,0|2,0,0]=4 222 B12R2.24 O=C1C=CC2=C(CCNC2)N1 CS-0080603 [0,1,0,1,0,0|1,0,0]=3 223 B12R2.24 O=C1CCC2=C(C=CC=N2)C1 CS-0102419 [0,1,0,1,0,0|2,0,0]=4 224 B12R2.24 OC1=CC2=C(C=C1)CCNC2 CS-0096274 [0,1,0,1,0,0|0,0,0]=2 225 B12R2.24 OC1=CC2=C(CCCC2)N=C1 CS-0102443 [0,1,0,1,0,0|2,0,0]=4 226 B12R2.24 OC1=CN=C2CCNCC2=C1 CS-0060819 [0,1,0,1,0,0|1,0,0]=3 227 B12R2.24 O[C@@H]1CNC2=C(C=CC=C2)C1 CS-0053286 [0,1,0,1,0,0|2,0,0]=4 228 B12R2.24 O[C@H]1CNC2=C(C=CC=C2)C1 CS-0053347 [0,1,0,1,0,0|2,0,0]=4 229 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(F)C=C2 CS-0008704 [0,1,0,1,0,0|2,0,0]=4 230 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(O)C=C2 CS-0051085 [0,1,0,1,0,0|2,0,0]=4 231 B12R2.132 CC1=CC2=C(C=C1)CCC2=O CS-W014350 [0,1,0,1,0,0|2,0,0]=4 232 B12R2.132 CC1=CC2=C(C=C1)N=CN2C CS-0061343 [0,1,0,1,0,0|1,0,1]=4 233 B12R2.132 CN1C=NC2=C1C=C(Br)C=C2 CS-0050308 [0,1,0,1,0,0|1,0,1]=4 234 B12R2.132 N[C@@H]1CCC2=C1C=C(O)C=C2 CS-0053332 [0,1,0,1,0,0|2,0,0]=4 235 B12R2.294 BrC1=CC=C(OC2CC2)C=C1 CS-0037584 [0,1,0,1,0,0|2,0,0]=4 236 B12R2.1728 N#CC1CC2=CC=C(F)C=C21 CS-0106603 [0,1,0,1,0,0|2,0,0]=4 237 B12R2.2302 BrC1=CC=C(C2CCC2)C=C1 CS-0093710 [0,1,0,1,0,0|1,0,0]=3 238 B12R2.2302 BrC1=CC=C(C2COC2)C=C1 CS-0051747 [0,1,0,1,0,0|1,0,0]=3 239 B12R2.2302 BrC1=NC=C(C2CCC2)C=C1 CS-0107003 [0,1,0,1,0,0|2,0,0]=4 240 B12R2.2302 BrC1=NC=C(C2COC2)C=C1 CS-0111644 [0,1,0,1,0,0|2,0,0]=4 241 B12R2.2302 OC1=CC=C(C2CNC2)C=C1 CS-0093950 [0,1,0,1,0,0|0,0,0]=2 242 B12R2.2302 OC1=CC=C(C2COC2)C=C1 CS-0111760 [0,1,0,1,0,0|1,0,0]=3 243 B12R2.2 C1=CC=C(C2CCCO2)C=C1 CS-0051806 [0,1,0,1,0,0|1,0,0]=3 244 B12R2.2 C1=CC=C([C@@H]2CCNC2)C=C1 CS-0043303 [0,1,0,1,0,0|0,0,0]=2 245 B12R2.22 NC1CC(C2=CC=CC=C2)C1 CS-0051224 [0,1,0,1,0,0|1,0,0]=3 246 B12R2.22 N[C@H]1C[C@H](C2=CC=CC=C2)C1 CS-0054864 [0,1,0,1,0,0|1,0,0]=3 247 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 CS-0054863 [0,1,0,1,0,0|1,0,0]=3 248 B12R2.22 OC1CN(C2=CC=CC=C2)C1 CS-0052409 [0,1,0,1,0,0|2,0,0]=4 249 B12R2.116 NC1(C2=CC=CC=C2)COC1 CS-0046177 [0,1,0,1,0,0|1,0,0]=3 250 B12R2.116 NC1(C2=CC=CN=C2)COC1 CS-0051660 [0,1,0,1,0,0|2,0,0]=4 251 B12R2.1081 BrC1=C2CCCCC2=CC=N1 CS-0052589 [0,1,0,1,0,0|2,0,0]=4 252 B12R2.1081 BrC1=CC=CC2=C1CCCN2 CS-0018846 [0,1,0,1,0,0|2,0,0]=4 253 B12R2.1081 BrC1=CC=CC2=C1CNCC2 CS-W005890 [0,1,0,1,0,0|0,0,0]=2 254 B12R2.1081 BrC1=CN=CC2=C1CNCC2 CS-0049966 [0,1,0,1,0,0|1,0,0]=3 255 B12R2.1081 CC1=CC=CC2=C1CCNC2 CS-0038084 [0,1,0,1,0,0|0,0,0]=2 256 B12R2.1081 CC1=CC=NC2=C1CCCC2 CS-0102388 [0,1,0,1,0,0|2,0,0]=4 257 B12R2.1081 CC1CCCC2=C1C=CC=N2 CS-0102351 [0,1,0,1,0,0|2,0,0]=4 258 B12R2.1081 CC1CNCC2=C1C=CC=C2 CS-0038270 [0,1,0,1,0,0|0,0,0]=2 259 B12R2.1081 CC1CNCC2=CC=CC=C21 CS-0036832 [0,1,0,1,0,0|0,0,0]=2 260 B12R2.1081 ClC1=CC=NC2=C1CCCC2 CS-0102375 [0,1,0,1,0,0|2,0,0]=4 261 B12R2.1081 ClC1=CC=NC2=C1CCNC2 CS-0106986 [0,1,0,1,0,0|1,0,0]=3 262 B12R2.1081 ClC1=NC=NC2=C1CCNC2 CS-0077282 [0,1,0,1,0,0|2,0,0]=4 263 B12R2.1081 ClC1CCCC2=C1C=CC=N2 CS-0106276 [0,1,0,1,0,0|2,0,0]=4 264 B12R2.1081 ClC1CCCC2=C1C=CN=C2 CS-0104563 [0,1,0,1,0,0|2,0,0]=4 265 B12R2.1081 ClC1CCCC2=C1N=CC=C2 CS-0102432 [0,1,0,1,0,0|2,0,0]=4 266 B12R2.1081 N=C1NC=CC2=C1CCCC2 CS-0038609 [0,1,0,1,0,0|2,0,0]=4 267 B12R2.1081 NC1CCCC2=CC=CC=C21 CS-W007739 [0,1,0,1,0,0|1,0,0]=3 268 B12R2.1081 NC1COCC2=CC=CC=C21 CS-0018940 [0,1,0,1,0,0|1,0,0]=3 269 B12R2.1081 N[C@@H]1CCCC2=CC=CN=C21 CS-D0824 [0,1,0,1,0,0|2,0,0]=4 270 B12R2.1081 N[C@@H]1CCOC2=C1C=CC=C2 CS-0060637 [0,1,0,1,0,0|2,0,0]=4 271 B12R2.1081 N[C@H]1CCCC2=C1N=CC=C2 CS-0002127 [0,1,0,1,0,0|2,0,0]=4 272 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 CS-0005279 [0,1,0,1,0,0|2,0,0]=4 273 B12R2.1081 O=C1CCNC2=CC=CC=C12 CS-W005292 [0,1,0,1,0,0|2,0,0]=4 274 B12R2.1081 O=C1N=CNC2=C1CCNC2 CS-0066143 [0,1,0,1,0,0|2,0,0]=4 275 B12R2.1081 O=C1NCCC2=C1N=CC=C2 CS-W019035 [0,1,0,1,0,0|1,0,1]=4 276 B12R2.1081 OB1OCCC2=CC=CC=C12 CS-0100855 [0,1,0,1,0,0|2,0,0]=4 277 B12R2.1081 O[C@@H]1CCCC2=C1N=CC=C2 CS-0102397 [0,1,0,1,0,0|2,0,0]=4 278 B12R2.1081 O[C@H]1CCCC2=C1N=CC=C2 CS-0102424 [0,1,0,1,0,0|2,0,0]=4 279 B12R2.2028 O=C1CC(O)C2=C1C=CC=C2 CS-0113155 [0,1,0,1,0,0|2,0,0]=4 280 B12R2.2075 NC(C1=CC=NC=C1)C2CC2 CS-0100934 [0,1,0,1,0,0|2,0,0]=4 281 B12R2.32 BrCC1CC2=C(C=CC=C2)C1 CS-D0073 [0,1,0,1,0,0|2,0,0]=4 282 B12R2.196 CN1C=NC2=C(Br)C=CC=C21 CS-0037180 [0,1,0,1,0,0|1,0,1]=4 283 B12R2.196 CN1N=CC2=C(I)C=CC=C21 CS-0050831 [0,1,0,1,0,0|1,0,1]=4 284 B12R2.196 NC1CCC2=C1C=CC=C2Br CS-0051005 [0,1,0,1,0,0|2,0,0]=4 285 B12R2.196 NC1CCC2=C1C=CC=C2F CS-0104995 [0,1,0,1,0,0|2,0,0]=4 286 B12R2.196 N[C@H]1CCC2=C1C=CC=C2F CS-0060662 [0,1,0,1,0,0|2,0,0]=4 287 B12R2.196 O[C@H]1CCC2=C1C=CC=C2Br CS-0047467 [0,1,0,1,0,0|2,0,0]=4 288 B12R2.203 CC1=C2C(=O)CCC2=CC=C1 CS-0061213 [0,1,0,1,0,0|2,0,0]=4 289 B12R2.203 NC1=C2C(=O)CCC2=CC=C1 CS-0001936 [0,1,0,1,0,0|2,0,0]=4 290 B12R2.612 NC1=CC=C2C(=O)CCC2=C1 CS-W008688 [0,1,0,1,0,0|2,0,0]=4 291 B12R2.612 N[C@@H]1CCC2=C1C=CC(Br)=C2 CS-0104999 [0,1,0,1,0,0|2,0,0]=4 292 B12R2.2313 BrC1=CC(C2CCN2)=CC=C1 CS-0077239 [0,1,0,1,0,0|2,0,0]=4 293 B12R2.2313 BrC1=CC(C2CNC2)=CC=C1 CS-0051766 [0,1,0,1,0,0|0,0,0]=2 294 B12R2.2313 BrC1=CC(C2COC2)=CC=C1 CS-0051763 [0,1,0,1,0,0|1,0,0]=3 295 B12R2.1 CON1C=CC2=C1C=CC=C2 CS-0106939 [0,1,0,1,0,0|0,0,2]=4 296 B12R2.23 O=C1CCC1C2=CC=CC=C2 CS-0051808 [0,1,0,1,0,0|1,0,1]=4 297 B12R2.2058 C1=CC(NC2CCC2)=CC=N1 CS-0088888 [0,1,0,1,0,0|2,0,0]=4 298 B12R2.2058 C1=CC=C(NC2CCC2)C=C1 CS-0036898 [0,1,0,1,0,0|1,0,0]=3 299 B12R2.2058 C1=CC=C(OC2CNC2)C=C1 CS-0051226 [0,1,0,1,0,0|0,0,0]=2 300 B12R2.2058 C1=CN=C(NC2CCC2)C=C1 CS-0088883 [0,1,0,1,0,0|2,0,0]=4 301 B12R2.2058 C1=CN=CC(CC2CNC2)=C1 CS-0088890 [0,1,0,1,0,0|1,0,0]=3 302 B12R2.2058 C1=CN=CC(CC2CNC2)=C1 CS-0088894 [0,1,0,1,0,0|1,0,0]=3 303 B12R2.2058 C1=CN=CC(NC2CCC2)=C1 CS-0088885 [0,1,0,1,0,0|2,0,0]=4 304 B12R2.18 CC1=CC2=CC=CC=C2N1C CS-W010998 [0,1,0,1,0,0|0,0,2]=4 305 B12R2.18 CN1C(=O)CC2=CC=CN=C21 CS-0052473 [0,1,0,1,0,0|1,0,1]=4 306 B12R2.94 NC1(CC2=CC=CC=C2)CC1 CS-0088458 [0,1,0,1,0,0|1,0,0]=3 307 B12R2.2403 CC1(C)CNC2=CC=CC=C21 CS-0051621 [0,1,0,1,0,0|2,0,0]=4 308 B12R2.2403 CC1(C)NCC2=CC=CC=C21 CS-0052761 [0,1,0,1,0,0|2,0,0]=4 309 B8R1.8 CNCC1=NOC=C1 CS-0085265 [1,0,0,0,1,0|2,0,0]=4