0 B12R1.252 CC(C)CNCC1=CC=CC=C1 SC-51577 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.252 C[C@H](N)COCC1=CC=CC=C1 SC-09293 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.252 N=C(N)CCCC1=CC=CC=C1 SC-39290 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.252 N=C(N)CCCC1=CC=CC=N1 SC-12263 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.252 N=C(N)CCCC1=CC=NC=C1 SC-12261 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.252 N=C(N)CCCC1=CN=CC=C1 SC-12262 [0,0,0,0,0,0|3,0,0]=3 6 B12R1.252 N=C(N)CCOC1=CC=CC=C1 SC-41366 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.252 N=C(N)COCC1=CC=CC=C1 SC-52537 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.252 N=C(N)NCCC1=CC=CC=C1 SC-60341 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.252 O=C(Cl)CCCC1=CC=CC=C1 SC-71520 [0,0,0,0,0,0|1,0,0]=1 10 B12R1.252 O=C(Cl)COCC1=CC=CC=C1 SC-20864 [0,0,0,0,0,0|2,0,0]=2 11 B12R1.252 O=C(O)CCCC1=CC=CC=C1 SC-22740 [0,0,0,0,0,0|0,0,0]=0 12 B12R1.252 O=C(O)CCCC1=CC=NC=C1 SC-70148 [0,0,0,0,0,0|1,0,0]=1 13 B12R1.252 O=C(O)COCC1=CC=CC=C1 SC-11831 [0,0,0,0,0,0|1,0,0]=1 14 B11R1.28 BrCCCCC1=CC=CC=C1 SC-13820 [1,0,0,0,0,0|1,0,1]=3 15 B11R1.28 BrCCCOC1=CC=CC=C1 SC-76960 [1,0,0,0,0,0|2,0,1]=4 16 B11R1.28 BrCCOCC1=CC=CC=C1 SC-57855 [1,0,0,0,0,0|2,0,1]=4 17 B11R1.28 C#CCOCC1=CC=CC=C1 SC-14312 [1,0,0,0,0,0|2,0,1]=4 18 B11R1.28 CCCCCC1=NC=CC=C1 SC-57942 [1,0,0,0,0,0|2,0,1]=4 19 B11R1.28 CCCNCC1=CC=CC=C1 SC-65059 [1,0,0,0,0,0|2,0,1]=4 20 B11R1.28 CNCCCC1=CC=CC=C1 SC-92122 [1,0,0,0,0,0|2,0,0]=3 21 B11R1.28 ClCCCCC1=CC=NC=C1 SC-99954 [1,0,0,0,0,0|2,0,1]=4 22 B11R1.28 ClCCNCC1=CC=CC=C1 SC-73457 [1,0,0,0,0,0|2,0,1]=4 23 B11R1.28 ClCCOCC1=CC=CC=C1 SC-12134 [1,0,0,0,0,0|2,0,1]=4 24 B11R1.28 ICCOCC1=CC=CC=C1 SC-A2944 [1,0,0,0,0,0|2,0,1]=4 25 B11R1.28 N#CCCCC1=CC=NC=C1 SC-65473 [1,0,0,0,0,0|2,0,1]=4 26 B11R1.28 N#CCCCC1=CN=CC=C1 SC-12264 [1,0,0,0,0,0|2,0,1]=4 27 B11R1.28 N#CCCNC1=CC=CC=C1 SC-00279 [1,0,0,0,0,0|2,0,1]=4 28 B11R1.28 NCCCOC1=CC=CC=C1 SC-40255 [1,0,0,0,0,0|2,0,1]=4 29 B11R1.28 NCCNCC1=CC=CC=C1 SC-46980 [1,0,0,0,0,0|2,0,1]=4 30 B11R1.28 NCCOCC1=CC=CC=C1 SC-49737 [1,0,0,0,0,0|2,0,1]=4 31 B11R1.28 NNCCCC1=CC=CC=C1 SC-45618 [1,0,0,0,0,0|2,0,0]=3 32 B11R1.28 NNCCCC1=CC=CN=C1 SC-41332 [1,0,0,0,0,0|3,0,0]=4 33 B11R1.28 NNCCCC1=CC=NC=C1 SC-42046 [1,0,0,0,0,0|3,0,0]=4 34 B11R1.28 NNCCCC1=NC=CC=C1 SC-41331 [1,0,0,0,0,0|3,0,0]=4 35 B11R1.28 NNCCOC1=CC=CC=C1 SC-59918 [1,0,0,0,0,0|3,0,0]=4 36 B11R1.28 O=CCCCC1=CC=CC=C1 SC-59796 [1,0,0,0,0,0|0,0,0]=1 37 B11R1.28 O=CCOCC1=CC=CC=C1 SC-47403 [1,0,0,0,0,0|1,0,0]=2 38 B11R1.28 OCCCCC1=CC=CC=C1 SC-03572 [1,0,0,0,0,0|0,0,1]=2 39 B11R1.28 OCCOCC1=CC=CC=C1 SC-05822 [1,0,0,0,0,0|1,0,1]=3 40 B11R1.28 OCCSCC1=CC=CC=C1 SC-46194 [1,0,0,0,0,0|1,0,1]=3 41 B11R1.28 S=C=NCCC1=CC=CC=C1 SC-75540 [1,0,0,0,0,0|1,1,1]=4 42 B13R1.45 O=C(O)CCC(=O)C1=NC=CC=C1 SC-50011 [0,1,0,0,0,0|1,0,1]=3 43 B13R1.45 O=C(O)CNC(=O)C1=CC=CC=C1 SC-A5865 [0,1,0,0,0,0|1,0,1]=3 44 B13R1.45 O=C(O)\C=C\C(=O)C1=CC=CC=C1 SC-14183 [0,1,0,0,0,0|0,0,3]=4 45 B13R1.45 O=C([O-])CNC(=O)C1=CC=CC=C1 SC-40764 [0,1,0,0,0,0|1,0,2]=4 46 B13R1.149 O=C(O)CCCC1=CC=CC(Br)=C1 SC-25268 [0,1,0,0,0,0|0,0,0]=1 47 B13R1.158 N=C(N)NCCC1=CC=CC=C1Br SC-60343 [0,1,0,0,0,0|3,0,0]=4 48 B13R1.158 O=C(O)CCCC1=CC=CC=C1F SC-11471 [0,1,0,0,0,0|0,0,0]=1 49 B13R1.348 CC(CC(=O)O)CC1=CC=CC=C1 SC-87963 [0,1,0,0,0,0|0,0,0]=1 50 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 SC-12427 [0,1,0,0,0,0|0,0,0]=1 51 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 SC-46101 [0,1,0,0,0,0|0,0,0]=1 52 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 SC-48872 [0,1,0,0,0,0|0,0,0]=1 53 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 SC-77068 [0,1,0,0,0,0|0,0,0]=1 54 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 SC-46102 [0,1,0,0,0,0|0,0,0]=1 55 B13R1.351 CC(=O)C(=O)OCC1=CC=CC=C1 SC-A3376 [0,1,0,0,0,0|2,0,1]=4 56 B13R1.351 CC(COC1=CC=CC=C1)C(=O)O SC-58598 [0,1,0,0,0,0|1,0,0]=2 57 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O SC-10977 [0,1,0,0,0,0|0,0,0]=1 58 B13R1.351 NC(CCC1=CC=NC=C1)C(=O)O SC-31254 [0,1,0,0,0,0|1,0,0]=2 59 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O SC-78855 [0,1,0,0,0,0|0,0,0]=1 60 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O SC-76550 [0,1,0,0,0,0|1,0,0]=2 61 B13R1.351 O=C(O)C(=O)OCC1=CC=CC=C1 SC-32761 [0,1,0,0,0,0|1,0,1]=3 62 B13R1.351 O=C(O)[C@H](O)CCC1=CC=CC=C1 SC-44640 [0,1,0,0,0,0|0,0,0]=1 63 B13R1.351 [C@@H](N)(CCC1=CC=CC=C1)C(=O)O SC-10978 [0,1,0,0,0,0|0,0,0]=1 64 B13R1.513 CC(=O)NCCC1=CC=C(O)C=C1 SC-83302 [0,1,0,0,0,0|2,0,0]=3 65 B13R1.513 N=C(N)CCOC1=CC=C(F)C=C1 SC-41174 [0,1,0,0,0,0|3,0,0]=4 66 B13R1.513 N=C(N)NCCC1=CC=C(Cl)C=C1 SC-60374 [0,1,0,0,0,0|3,0,0]=4 67 B13R1.513 N=C(N)NCCC1=CC=C(F)C=C1 SC-60375 [0,1,0,0,0,0|3,0,0]=4 68 B13R1.513 O=C(O)CCCC1=CC=C(Br)C=C1 SC-49268 [0,1,0,0,0,0|0,0,0]=1 69 B13R1.718 C#CC(=O)COCC1=CC=CC=C1 SC-32478 [0,1,0,0,0,0|2,0,0]=3 70 B13R1.718 C=CC(O)CNCC1=CC=CC=C1 SC-86967 [0,1,0,0,0,0|2,0,1]=4 71 B13R1.718 CC(CO)COCC1=CC=CC=C1 SC-A5296 [0,1,0,0,0,0|2,0,1]=4 72 B13R1.718 COC(=O)CNCC1=CC=CC=C1 SC-73836 [0,1,0,0,0,0|1,0,0]=2 73 B13R1.718 NC(CO)CCOC1=CC=CC=C1 SC-33038 [0,1,0,0,0,0|2,0,1]=4 74 B13R1.718 NC(CO)CSCC1=CC=CC=C1 SC-69758 [0,1,0,0,0,0|2,0,1]=4 75 B13R1.718 N[C@@H](CO)COCC1=CC=CC=C1 SC-50632 [0,1,0,0,0,0|2,0,1]=4 76 B13R1.718 N[C@H](CO)COCC1=CC=CC=C1 SC-50633 [0,1,0,0,0,0|2,0,1]=4 77 B13R1.718 O=C(CCl)COCC1=CC=CC=C1 SC-33013 [0,1,0,0,0,0|2,0,0]=3 78 B13R1.718 OCC(O)COCC1=CC=CC=C1 SC-76775 [0,1,0,0,0,0|1,0,2]=4 79 B13R1.3523 O=S(=O)(Cl)CCOC1=CC=CC=C1 SC-22014 [0,1,0,0,0,0|2,0,1]=4 80 B13R2.10 CC1COC(C2=CC=CC=C2)O1 SC-93541 [0,0,0,1,0,0|2,0,1]=4 81 B13R2.10 O=C1CC(C2=CC=CC=C2)CN1 SC-A2649 [0,0,0,1,0,0|2,0,0]=3 82 B13R2.10 O=C1CC=C(C2=CC=CC=C2)O1 SC-52586 [0,0,0,1,0,0|0,0,2]=3 83 B13R2.10 O=C1CN=C(C2=CC=CC=C2)O1 SC-21225 [0,0,0,1,0,0|1,0,1]=3 84 B13R2.10 O=C1NCC(C2=CC=CC=C2)N1 SC-89145 [0,0,0,1,0,0|2,0,0]=3 85 B13R2.10 O=C1NCC(C2=CC=CC=C2)O1 SC-49190 [0,0,0,1,0,0|1,0,0]=2 86 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 SC-07544 [0,0,0,1,0,0|2,0,0]=3 87 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 SC-07250 [0,0,0,1,0,0|2,0,0]=3 88 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CO1 SC-17369 [0,0,0,1,0,0|2,1,0]=4 89 B13R2.10 [C@@H]1(C2=CC=CC=C2)COC(=S)N1 SC-25816 [0,0,0,1,0,0|2,1,0]=4 90 B13R2.10 [C@@H]1(C2=CC=CC=C2)CSC(=S)N1 SC-17069 [0,0,0,1,0,0|2,1,0]=4 91 B13R2.10 [C@H]1(C2=CC=CC=C2)CSC(=S)N1 SC-17058 [0,0,0,1,0,0|2,1,0]=4 92 B13R2.31 O=C1CC(CC2=CC=CC=C2)C1 SC-36029 [0,0,0,1,0,0|1,0,0]=2 93 B13R2.31 OC1CN(CC2=CC=CC=C2)C1 SC-40411 [0,0,0,1,0,0|2,0,1]=4 94 B13R2.72 CC(=O)N1CCC2=C1C=CC=C2 SC-01460 [0,0,0,1,0,0|2,0,0]=3 95 B13R2.72 O=C(O)C1=CSC2=CC=CC=C21 SC-46218 [0,0,0,1,0,0|1,0,2]=4 96 B13R2.72 O=C(O)C1=NOC2=CC=CC=C21 SC-26583 [0,0,0,1,0,0|2,0,1]=4 97 B13R2.72 O=C(O)C1CCC2=C1C=CC=C2 SC-21633 [0,0,0,1,0,0|0,0,0]=1 98 B13R2.72 O=C(O)C1NCC2=C1C=CC=C2 SC-49419 [0,0,0,1,0,0|1,0,0]=2 99 B13R2.72 O=C(O)[C@H]1NCC2=C1C=CC=C2 SC-70901 [0,0,0,1,0,0|1,0,0]=2 100 B13R2.163 O=C1CC2=CC=CC=C2CCN1 SC-A3624 [0,0,0,1,0,0|2,0,0]=3 101 B13R2.163 O=C1CCCC2=CC=CC=C2C1 SC-48284 [0,0,0,1,0,0|1,0,0]=2 102 B13R2.163 O=C1NCCC2=CC=CC=C2N1 SC-49030 [0,0,0,1,0,0|2,0,0]=3 103 B13R2.423 O=C(Cl)[C@H]1C[C@H]1C2=CC=CC=C2 SC-60997 [0,0,0,1,0,0|1,0,0]=2 104 B13R2.423 O=C(O)C1CC1C2=CC=CC=C2 SC-71542 [0,0,0,1,0,0|0,0,0]=1 105 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 SC-52795 [0,0,0,1,0,0|0,0,0]=1 106 B13R2.2382 C1=CC=C(COCC2CO2)C=C1 SC-82731 [0,0,0,1,0,0|2,0,1]=4 107 B13R2.2382 C1=CC=C(COC[C@@H]2CO2)C=C1 SC-01544 [0,0,0,1,0,0|2,0,1]=4 108 B13R2.2382 C1=CC=C(COC[C@H]2CO2)C=C1 SC-01157 [0,0,0,1,0,0|2,0,1]=4 109 B11R1.91 CC(=N)NCC1=CC=CC=C1 SC-62048 [0,0,0,0,1,0|3,0,0]=4 110 B11R1.91 CC(=O)NCC1=CC=NC=C1 SC-54472 [0,0,0,0,1,0|3,0,0]=4 111 B11R1.91 CC(=O)NCC1=CN=CC=C1 SC-65166 [0,0,0,0,1,0|3,0,0]=4 112 B11R1.91 CC(=O)NCC1=NC=CC=C1 SC-54471 [0,0,0,0,1,0|3,0,0]=4 113 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 SC-80359 [0,0,0,0,1,0|1,0,2]=4 114 B11R1.91 CC(=S)CSC1=CC=CC=C1 SC-42706 [0,0,0,0,1,0|2,1,0]=4 115 B11R1.91 C[C@H](O)CCC1=CC=CC=C1 SC-A2296 [0,0,0,0,1,0|1,0,1]=3 116 B11R1.91 N=C(N)CCC1=CC=CC=C1 SC-39335 [0,0,0,0,1,0|2,0,0]=3 117 B11R1.91 N=C(N)CCC1=CC=CN=C1 SC-55394 [0,0,0,0,1,0|3,0,0]=4 118 B11R1.91 N=C(N)CCC1=CC=NC=C1 SC-62572 [0,0,0,0,1,0|3,0,0]=4 119 B11R1.91 N=C(N)CCC1=NC=CC=C1 SC-58525 [0,0,0,0,1,0|3,0,0]=4 120 B11R1.91 N=C(N)COC1=CC=CC=C1 SC-27806 [0,0,0,0,1,0|3,0,0]=4 121 B11R1.91 N=C(N)CSC1=CC=CC=C1 SC-40895 [0,0,0,0,1,0|3,0,0]=4 122 B11R1.91 N=C(N)NCC1=CC=CC=C1 SC-A4867 [0,0,0,0,1,0|3,0,0]=4 123 B11R1.91 NC(=O)OCC1=CC=CC=C1 SC-47828 [0,0,0,0,1,0|2,0,0]=3 124 B11R1.91 O=C(Cl)C#CC1=CC=CC=C1 SC-45729 [0,0,0,0,1,0|1,0,2]=4 125 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 SC-11289 [0,0,0,0,1,0|2,0,0]=3 126 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 SC-26692 [0,0,0,0,1,0|1,0,2]=4 127 B11R1.91 O=C(O)C#CC1=CC=CC=C1 SC-13741 [0,0,0,0,1,0|0,0,2]=3 128 B11R1.91 O=C(O)CCC1=CC=NC=C1 SC-50418 [0,0,0,0,1,0|1,0,0]=2 129 B11R1.91 O=C(O)CCC1=NC=CC=C1 SC-50767 [0,0,0,0,1,0|1,0,0]=2 130 B11R1.91 O=C(O)CCC1=NC=CC=N1 SC-22039 [0,0,0,0,1,0|2,0,0]=3 131 B11R1.91 O=C(O)CNC1=CC=CC=C1 SC-75650 [0,0,0,0,1,0|1,0,0]=2 132 B11R1.91 O=C(O)CNC1=CC=CN=C1 SC-A2839 [0,0,0,0,1,0|2,0,0]=3 133 B11R1.91 O=C(O)COC1=CC=CN=C1 SC-47923 [0,0,0,0,1,0|2,0,0]=3 134 B11R1.91 O=C(O)COC1=NC=CC=C1 SC-50472 [0,0,0,0,1,0|2,0,0]=3 135 B11R1.91 O=C(O)CSC1=NC=CC=N1 SC-77923 [0,0,0,0,1,0|3,0,0]=4 136 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 SC-24646 [0,0,0,0,1,0|0,0,2]=3 137 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 SC-05126 [0,0,0,0,1,0|1,0,2]=4 138 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 SC-39613 [0,0,0,0,1,0|1,0,2]=4 139 B11R1.91 O=C(O)\C=C\C1=CN=CC=C1 SC-57973 [0,0,0,0,1,0|1,0,2]=4 140 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 SC-62388 [0,0,0,0,1,0|1,0,2]=4 141 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 SC-68717 [0,0,0,0,1,0|1,0,1]=3 142 B11R1.91 OB(O)CCC1=CC=CC=C1 SC-86482 [0,0,0,0,1,0|1,0,1]=3 143 B13R1.337 CC(=O)CCCCC1=CC=CC=C1 SC-70636 [0,0,0,0,0,1|1,0,0]=2 144 B13R1.337 N=C(N)NCCCC1=CC=CC=C1 SC-60373 [0,0,0,0,0,1|2,0,0]=3 145 B13R1.337 O=C(Cl)OCCOC1=CC=CC=C1 SC-86178 [0,0,0,0,0,1|2,0,0]=3 146 B13R1.337 O=C(O)CCCCC1=CC=CC=C1 SC-15647 [0,0,0,0,0,1|0,0,0]=1 147 B13R1.337 O=C(O)CCSSC1=NC=CC=C1 SC-95019 [0,0,0,0,0,1|2,0,0]=3 148 B13R1.337 O=C(O)\C=C\C=C\C1=CC=CC=C1 SC-A4073 [0,0,0,0,0,1|0,0,3]=4 149 B10R1.17 C=CCSC1=CC=CC=C1 SC-A2865 [2,0,0,0,0,0|1,0,1]=4 150 B10R1.17 CCCCC1=NC=CC=C1 SC-52456 [2,0,0,0,0,0|1,0,1]=4 151 B10R1.17 CCCC[N+]1=CC=CC=C1 SC-07618 [2,0,0,0,0,0|1,0,1]=4 152 B10R1.17 CCCC[N+]1=CC=CC=C1 SC-62348 [2,0,0,0,0,0|1,0,1]=4 153 B10R1.17 CCNCC1=CC=CC=C1 SC-18916 [2,0,0,0,0,0|1,0,1]=4 154 B10R1.17 CNCCC1=CC=CC=C1 SC-19824 [2,0,0,0,0,0|1,0,1]=4 155 B10R1.17 ClCCCC1=CC=CC=N1 SC-54618 [2,0,0,0,0,0|2,0,0]=4 156 B10R1.17 ClCCCC1=CC=NC=C1 SC-54620 [2,0,0,0,0,0|2,0,0]=4 157 B10R1.17 ClCCCC1=CN=CC=C1 SC-54619 [2,0,0,0,0,0|2,0,0]=4 158 B10R1.17 ClCOCC1=CC=CC=C1 SC-03811 [2,0,0,0,0,0|2,0,0]=4 159 B10R1.17 ClCSCC1=CC=CC=C1 SC-A5669 [2,0,0,0,0,0|2,0,0]=4 160 B10R1.17 ICCCC1=CC=CC=C1 SC-54412 [2,0,0,0,0,0|1,0,0]=3 161 B10R1.17 NCCCC1=CC=CC=N1 SC-49860 [2,0,0,0,0,0|2,0,0]=4 162 B10R1.17 NCCCC1=CC=CN=C1 SC-49861 [2,0,0,0,0,0|2,0,0]=4 163 B10R1.17 NCCCC1=CC=NC=C1 SC-34013 [2,0,0,0,0,0|2,0,0]=4 164 B10R1.17 NCCCC1=CC=NC=C1 SC-41628 [2,0,0,0,0,0|2,0,0]=4 165 B10R1.17 NCCSC1=CC=CC=C1 SC-40816 [2,0,0,0,0,0|2,0,0]=4 166 B10R1.17 NOCCC1=CC=CC=C1 SC-99889 [2,0,0,0,0,0|2,0,0]=4 167 B10R1.17 O=C=NCC1=CC=CC=C1 SC-27328 [2,0,0,0,0,0|1,0,1]=4 168 B10R1.17 O=CC#CC1=CC=CC=C1 SC-89627 [2,0,0,0,0,0|0,0,2]=4 169 B10R1.17 O=CCCC1=NC=CC=C1 SC-31288 [2,0,0,0,0,0|1,0,0]=3 170 B10R1.17 O=C\C=C\C1=CC=CC=C1 SC-19143 [2,0,0,0,0,0|0,0,2]=4 171 B10R1.17 OCCCC1=CC=CC=C1 SC-26828 [2,0,0,0,0,0|0,0,0]=2 172 B10R1.17 OCCCC1=CC=CN=C1 SC-20277 [2,0,0,0,0,0|1,0,0]=3 173 B10R1.17 OCCCC1=NC=CC=C1 SC-27298 [2,0,0,0,0,0|1,0,0]=3 174 B10R1.17 OCCCC1=NC=CC=N1 SC-87505 [2,0,0,0,0,0|2,0,0]=4 175 B10R1.17 SCCOC1=CC=CC=C1 SC-66414 [2,0,0,0,0,0|1,1,0]=4 176 B12R1.1 CC1=CC=C(CCCC=O)C=C1 SC-57736 [1,1,0,0,0,0|0,0,0]=2 177 B12R1.1 CC1=CC=C(CCCCO)C=C1 SC-54522 [1,1,0,0,0,0|0,0,1]=3 178 B12R1.1 NNCCCC1=CC=C(Cl)C=C1 SC-42096 [1,1,0,0,0,0|2,0,0]=4 179 B12R1.1 O=CCCCC1=CC=C(Cl)C=C1 SC-57729 [1,1,0,0,0,0|0,0,0]=2 180 B12R1.1 OCCCCC1=CC=C(Br)C=C1 SC-50344 [1,1,0,0,0,0|0,0,1]=3 181 B12R1.8 BrCCCCOC1=CC=CC=C1 SC-19422 [1,1,0,0,0,0|1,0,1]=4 182 B12R1.8 BrCCCOCC1=CC=CC=C1 SC-23991 [1,1,0,0,0,0|1,0,1]=4 183 B12R1.8 CNCCOCC1=CC=CC=C1 SC-52436 [1,1,0,0,0,0|2,0,0]=4 184 B12R1.8 NCCCNCC1=CC=CC=C1 SC-21184 [1,1,0,0,0,0|1,0,1]=4 185 B12R1.8 NNCCCOC1=CC=CC=C1 SC-59953 [1,1,0,0,0,0|2,0,0]=4 186 B12R1.8 O=CCCCCC1=CC=CC=C1 SC-68672 [1,1,0,0,0,0|0,0,0]=2 187 B12R1.8 O=CCCOCC1=CC=CC=C1 SC-33984 [1,1,0,0,0,0|0,0,0]=2 188 B12R1.8 O=COC\C=C\C1=CC=CC=C1 SC-68028 [1,1,0,0,0,0|0,0,2]=4 189 B12R1.8 OCCCNCC1=CC=CC=C1 SC-13547 [1,1,0,0,0,0|0,0,1]=3 190 B12R1.8 OCCCOCC1=CC=CC=C1 SC-22056 [1,1,0,0,0,0|0,0,1]=3 191 B12R1.27 C[C@@H](CO)OCC1=CC=CC=C1 SC-45126 [1,1,0,0,0,0|1,0,1]=4 192 B12R1.27 C[C@H](CO)OCC1=CC=CC=C1 SC-44214 [1,1,0,0,0,0|1,0,1]=4 193 B12R1.27 N=C(CCC1=CC=CC=C1)NO SC-56238 [1,1,0,0,0,0|1,0,1]=4 194 B12R1.27 NC(CO)CCC1=CC=CC=C1 SC-41147 [1,1,0,0,0,0|0,0,1]=3 195 B12R1.27 N[C@@H](CO)CCC1=CC=CC=C1 SC-13097 [1,1,0,0,0,0|0,0,1]=3 196 B12R1.27 OCC(O)COC1=CC=CC=C1 SC-16362 [1,1,0,0,0,0|1,0,1]=4 197 B12R1.28 CC1=CC(CCCCO)=CC=C1 SC-57733 [1,1,0,0,0,0|0,0,1]=3 198 B12R1.30 CCCCC(C)C1=CC=CC=C1 SC-36177 [1,1,0,0,0,0|1,0,1]=4 199 B12R1.30 CNCCC(O)C1=CC=CC=C1 SC-25550 [1,1,0,0,0,0|2,0,0]=4 200 B12R1.267 CC1=CC=CC=C1CCCC=O SC-57735 [1,1,0,0,0,0|0,0,0]=2 201 B12R1.267 CC1=CC=CC=C1CCCCO SC-57734 [1,1,0,0,0,0|0,0,1]=3 202 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 SC-01266 [0,1,0,0,1,0|0,0,0]=2 203 B12R1.21 CC1=CC=C(OCC(=O)Cl)C=C1 SC-91235 [0,1,0,0,1,0|2,0,0]=4 204 B12R1.21 CC1=CC=C(OCC(=O)O)C=C1 SC-50222 [0,1,0,0,1,0|1,0,0]=3 205 B12R1.21 N=C(N)CCC1=CC=C(Br)C=C1 SC-38868 [0,1,0,0,1,0|2,0,0]=4 206 B12R1.21 N=C(N)CCC1=CC=C(Cl)C=C1 SC-54614 [0,1,0,0,1,0|2,0,0]=4 207 B12R1.21 N=C(N)CCC1=CC=C(O)C=C1 SC-41086 [0,1,0,0,1,0|2,0,0]=4 208 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 SC-43817 [0,1,0,0,1,0|0,0,0]=2 209 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 SC-65225 [0,1,0,0,1,0|0,0,2]=4 210 B12R1.21 O=C(Cl)COC1=CC=C(F)C=C1 SC-97746 [0,1,0,0,1,0|2,0,0]=4 211 B12R1.21 O=C(O)C#CC1=CC=C(Cl)C=C1 SC-14663 [0,1,0,0,1,0|0,0,2]=4 212 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 SC-26484 [0,1,0,0,1,0|0,0,0]=2 213 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 SC-25794 [0,1,0,0,1,0|0,0,0]=2 214 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 SC-45457 [0,1,0,0,1,0|0,0,0]=2 215 B12R1.21 O=C(O)CNC1=CC=C(Cl)C=C1 SC-48332 [0,1,0,0,1,0|1,0,0]=3 216 B12R1.21 O=C(O)CNC1=CC=C(F)C=C1 SC-25784 [0,1,0,0,1,0|1,0,0]=3 217 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 SC-48863 [0,1,0,0,1,0|1,0,0]=3 218 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 SC-17666 [0,1,0,0,1,0|1,0,0]=3 219 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 SC-00565 [0,1,0,0,1,0|0,0,2]=4 220 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 SC-39491 [0,1,0,0,1,0|0,0,2]=4 221 B12R1.21 O=C(O)\C=C\C1=CC=C(I)C=C1 SC-50375 [0,1,0,0,1,0|0,0,2]=4 222 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 SC-25929 [0,1,0,0,1,0|0,0,2]=4 223 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O SC-21936 [0,1,0,0,1,0|0,0,1]=3 224 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O SC-22789 [0,1,0,0,1,0|0,0,1]=3 225 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 SC-24697 [0,1,0,0,1,0|1,0,0]=3 226 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 SC-09787 [0,1,0,0,1,0|1,0,0]=3 227 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O SC-11174 [0,1,0,0,1,0|1,0,0]=3 228 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O SC-11171 [0,1,0,0,1,0|1,0,0]=3 229 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O SC-09766 [0,1,0,0,1,0|0,0,0]=2 230 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O SC-09765 [0,1,0,0,1,0|0,0,0]=2 231 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O SC-10967 [0,1,0,0,1,0|0,0,0]=2 232 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O SC-03978 [0,1,0,0,1,0|1,0,0]=3 233 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 SC-45736 [0,1,0,0,1,0|0,0,0]=2 234 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 SC-96045 [0,1,0,0,1,0|0,0,0]=2 235 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 SC-02277 [0,1,0,0,1,0|0,0,0]=2 236 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 SC-06556 [0,1,0,0,1,0|0,0,0]=2 237 B12R1.43 O=C(O)\C(F)=C\C1=CC=CC=C1 SC-21162 [0,1,0,0,1,0|0,0,2]=4 238 B12R1.43 O=C([O-])C(=O)CC1=CC=CC=C1 SC-77590 [0,1,0,0,1,0|0,0,2]=4 239 B12R1.43 [C@H](N)(CC1=CC=NC=C1)C(=O)O SC-19508 [0,1,0,0,1,0|1,0,0]=3 240 B12R1.107 C[C@H](CC(=O)O)C1=CC=CC=C1 SC-A2836 [0,1,0,0,1,0|0,0,0]=2 241 B12R1.107 NC(=O)CC(=O)C1=CC=CC=C1 SC-84768 [0,1,0,0,1,0|1,0,1]=4 242 B12R1.107 NC(=O)CC(N)C1=NC=CC=C1 SC-59231 [0,1,0,0,1,0|2,0,0]=4 243 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 SC-46779 [0,1,0,0,1,0|0,0,0]=2 244 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 SC-46780 [0,1,0,0,1,0|0,0,0]=2 245 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 SC-45519 [0,1,0,0,1,0|0,0,0]=2 246 B12R1.107 O=C(O)CC(=O)C1=CC=CC=C1 SC-19254 [0,1,0,0,1,0|0,0,1]=3 247 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 SC-46433 [0,1,0,0,1,0|0,0,2]=4 248 B12R1.125 CC1=CC=CC=C1CCC(=O)O SC-27982 [0,1,0,0,1,0|0,0,0]=2 249 B12R1.125 CC1=CC=CC=C1OCC(=O)O SC-73996 [0,1,0,0,1,0|1,0,0]=3 250 B12R1.125 N=C(N)CCC1=CC=CC=C1Cl SC-65323 [0,1,0,0,1,0|2,0,0]=4 251 B12R1.125 O=C(O)CCC1=CC=CC=C1Br SC-17877 [0,1,0,0,1,0|0,0,0]=2 252 B12R1.125 O=C(O)CCC1=CC=CC=C1Cl SC-49196 [0,1,0,0,1,0|0,0,0]=2 253 B12R1.125 O=C(O)CCC1=CC=CC=C1F SC-76672 [0,1,0,0,1,0|0,0,0]=2 254 B12R1.125 O=C(O)CNC1=CC=CC=C1F SC-92918 [0,1,0,0,1,0|1,0,0]=3 255 B12R1.125 O=C(O)COC1=CC=CC=C1F SC-50195 [0,1,0,0,1,0|1,0,0]=3 256 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Br SC-81630 [0,1,0,0,1,0|0,0,2]=4 257 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1I SC-41296 [0,1,0,0,1,0|0,0,2]=4 258 B12R1.226 CC1=CC(OCC(=O)O)=CC=C1 SC-73698 [0,1,0,0,1,0|1,0,0]=3 259 B12R1.226 CC1=CC(\C=C\C(=O)O)=CC=C1 SC-27466 [0,1,0,0,1,0|0,0,2]=4 260 B12R1.226 N=C(N)CCC1=CC(Cl)=CC=C1 SC-54616 [0,1,0,0,1,0|2,0,0]=4 261 B12R1.226 NC1=CC(CCC(=O)O)=CC=C1 SC-73734 [0,1,0,0,1,0|0,0,0]=2 262 B12R1.226 O=C(O)CCC1=CC(O)=CC=C1 SC-13620 [0,1,0,0,1,0|0,0,0]=2 263 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 SC-13720 [0,1,0,0,1,0|0,0,0]=2 264 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 SC-28105 [0,1,0,0,1,0|0,0,0]=2 265 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 SC-54326 [0,1,0,0,1,0|0,0,0]=2 266 B12R1.226 O=C(O)COC1=CC=CC(Br)=C1 SC-84996 [0,1,0,0,1,0|1,0,0]=3 267 B12R1.226 O=C(O)COC1=CC=CC(F)=C1 SC-50193 [0,1,0,0,1,0|1,0,0]=3 268 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 SC-92718 [0,1,0,0,1,0|0,0,2]=4 269 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 SC-02327 [0,1,0,0,1,0|0,0,2]=4 270 B12R1.226 O=C(O)\C=C\C1=CC=CC(I)=C1 SC-41212 [0,1,0,0,1,0|0,0,2]=4 271 B12R1.891 O=S(=O)(Cl)CCC1=CC=CC=C1 SC-21967 [0,1,0,0,1,0|1,0,1]=4 272 B12R1.260 C[C@@H](CC(=O)O)SC1=CC=CS1 SC-19807 [0,1,0,0,1,0|2,0,0]=4 273 B12R1.264 N[C@H](CCC1=CN=CN1)C(=O)O SC-49292 [0,1,0,0,1,0|2,0,0]=4 274 B14R1.420 O=C(O)CCCC(=O)C1=CC=CC=C1 SC-46406 [0,1,0,0,0,1|0,0,0]=2 275 B14R1.423 N[C@@H](CCC(=O)O)CC1=CC=CC=C1 SC-69776 [0,1,0,0,0,1|0,0,0]=2 276 B14R1.716 COC(=O)CCNCC1=CC=CC=C1 SC-71276 [0,1,0,0,0,1|0,0,0]=2 277 B14R1.716 COC(=O)CCSCC1=CC=CC=C1 SC-34564 [0,1,0,0,0,1|0,0,0]=2 278 B14R1.818 CC(=O)OC(C)CCC1=CC=CC=C1 SC-94020 [0,1,0,0,0,1|1,0,0]=3 279 B14R1.818 CC(CC(=O)O)NCC1=CC=CC=C1 SC-41290 [0,1,0,0,0,1|0,0,0]=2 280 B14R1.818 NC(CCC1=CC=CC=C1)CC(=O)O SC-59365 [0,1,0,0,0,1|0,0,0]=2 281 B14R1.818 O=C(O)CC(=O)OCC1=CC=CC=C1 SC-66833 [0,1,0,0,0,1|0,0,1]=3 282 B14R1.6449 CC(CNCC1=CC=CC=C1)C(=O)O SC-40707 [0,1,0,0,0,1|0,0,0]=2 283 B14R1.6449 NC(CCCC1=CC=CC=C1)C(=O)O SC-53096 [0,1,0,0,0,1|0,0,0]=2 284 B14R1.6449 NC(CCOC1=CC=CC=C1)C(=O)O SC-33082 [0,1,0,0,0,1|0,0,0]=2 285 B14R1.6449 NC(COCC1=CC=CC=C1)C(=O)O SC-21032 [0,1,0,0,0,1|0,0,0]=2 286 B14R1.6449 NC(CSCC1=CC=CC=C1)C(=O)O SC-09465 [0,1,0,0,0,1|0,0,0]=2 287 B14R1.6449 N[C@@H](COCC1=CC=CC=C1)C(=O)O SC-09857 [0,1,0,0,0,1|0,0,0]=2 288 B14R1.6449 [C@@H](N)(COCC1=CC=CC=C1)C(=O)O SC-09856 [0,1,0,0,0,1|0,0,0]=2 289 B14R1.149 O=C(O)NCC(O)C1=CC=CC(Br)=C1 SC-61957 [0,2,0,0,0,0|1,0,0]=3 290 B14R1.160 O=C(O)NCC(O)C1=CC=CC=C1Br SC-61959 [0,2,0,0,0,0|1,0,0]=3 291 B14R1.160 O=C(O)NCC(O)C1=CC=CC=C1Cl SC-61951 [0,2,0,0,0,0|1,0,0]=3 292 B14R1.415 CC(CC(N)C(=O)O)C1=CC=CC=C1 SC-59421 [0,2,0,0,0,0|0,0,0]=2 293 B14R1.415 CN(CC(N)C1=CC=CC=C1)C(=O)O SC-72183 [0,2,0,0,0,0|1,0,0]=3 294 B14R1.417 CC(C1=CC=CC=C1)C(N)CC(=O)O SC-59361 [0,2,0,0,0,0|0,0,0]=2 295 B14R1.678 CC1=CC=C(C(=O)CCC(=O)O)C=C1 SC-45842 [0,2,0,0,0,0|0,0,1]=3 296 B14R1.678 NC1=CC=C(C(=O)NCC(=O)O)C=C1 SC-81289 [0,2,0,0,0,0|1,0,1]=4 297 B14R1.678 O=C(O)CCC(=O)C1=CC=C(Cl)C=C1 SC-52657 [0,2,0,0,0,0|0,0,1]=3 298 B14R1.678 O=C(O)NCC(O)C1=CC=C(Br)C=C1 SC-61955 [0,2,0,0,0,0|1,0,0]=3 299 B14R1.678 O=C(O)NCC(O)C1=CC=C(F)C=C1 SC-61963 [0,2,0,0,0,0|1,0,0]=3 300 B14R1.813 O=C(O)CCS(=O)(=O)C1=CC=CC=C1 SC-A2963 [0,2,0,0,0,0|1,0,0]=3 301 B14R1.154 O=C(O)CCCC1=CC=CC(O)=C1O SC-51738 [0,2,0,0,0,0|0,0,0]=2 302 B14R1.687 O=C(O)CCCC1=CC=C(O)C(O)=C1 SC-51735 [0,2,0,0,0,0|0,0,0]=2 303 B14R1.5978 N[C@@H](CC(=O)O)CC1=CC=CC(Br)=C1 SC-A1246 [0,2,0,0,0,0|0,0,0]=2 304 B14R1.5978 N[C@@H](CC(=O)O)CC1=CC=CC(F)=C1 SC-A1235 [0,2,0,0,0,0|0,0,0]=2 305 B14R1.161 NC(CCC1=CC=CC=C1Cl)C(=O)O SC-31572 [0,2,0,0,0,0|0,0,0]=2 306 B14R1.161 NC(CCC1=NC=CC=C1Cl)C(=O)O SC-31047 [0,2,0,0,0,0|1,0,0]=3 307 B14R1.337 CC1=CC=CC=C1CC(N)CC(=O)O SC-21177 [0,2,0,0,0,0|0,0,0]=2 308 B14R1.337 N[C@@H](CC(=O)O)CC1=CC=CC=C1Br SC-A1242 [0,2,0,0,0,0|0,0,0]=2 309 B14R1.337 N[C@@H](CC(=O)O)CC1=CC=CC=C1Cl SC-66010 [0,2,0,0,0,0|0,0,0]=2 310 B14R1.337 N[C@@H](CC(=O)O)CC1=CC=CC=C1F SC-A1230 [0,2,0,0,0,0|0,0,0]=2 311 B14R1.337 N[C@H](CC(=O)O)CC1=CC=CC=C1Br SC-A1239 [0,2,0,0,0,0|0,0,0]=2 312 B14R1.337 N[C@H](CC(=O)O)CC1=CC=CC=C1F SC-A1227 [0,2,0,0,0,0|0,0,0]=2 313 B14R1.4464 O=C(O)CCCC1=CC=C(Cl)C=C1Cl SC-13057 [0,2,0,0,0,0|0,0,0]=2 314 B14R1.698 CC(CC1=CC=C(O)C=C1)NC(=O)O SC-60631 [0,2,0,0,0,0|1,0,0]=3 315 B14R1.698 NC(CC(=O)O)CC1=CC=C(Cl)C=C1 SC-20837 [0,2,0,0,0,0|0,0,0]=2 316 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(Br)C=C1 SC-A1251 [0,2,0,0,0,0|0,0,0]=2 317 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(Cl)C=C1 SC-A1225 [0,2,0,0,0,0|0,0,0]=2 318 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(F)C=C1 SC-A1237 [0,2,0,0,0,0|0,0,0]=2 319 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(Br)C=C1 SC-A1249 [0,2,0,0,0,0|0,0,0]=2 320 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(Cl)C=C1 SC-A1224 [0,2,0,0,0,0|0,0,0]=2 321 B14R1.743 COC(=O)CC(=O)CC1=CC=CC=C1 SC-25807 [0,2,0,0,0,0|0,0,1]=3 322 B14R1.4 CCC1=CC=C(CCCC(=O)O)C=C1 SC-50579 [0,2,0,0,0,0|0,0,0]=2 323 B14R1.4 COC1=CC=C(COCC(=O)O)C=C1 SC-53236 [0,2,0,0,0,0|1,0,0]=3 324 B14R1.13 COC(=O)CCCC1=CC=C(Br)C=C1 SC-50343 [0,2,0,0,0,0|0,0,0]=2 325 B14R1.520 CCOC(=N)CCCC1=CC=CC=N1 SC-65492 [0,2,0,0,0,0|2,0,0]=4 326 B14R1.520 CCOC(=N)CCCC1=CC=NC=C1 SC-65490 [0,2,0,0,0,0|2,0,0]=4 327 B14R1.520 CCOC(=N)CCCC1=CN=CC=C1 SC-65491 [0,2,0,0,0,0|2,0,0]=4 328 B14R1.520 CCOC(=O)CCNC1=NC=CC=C1 SC-44413 [0,2,0,0,0,0|2,0,0]=4 329 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 SC-12695 [0,2,0,0,0,0|1,0,0]=3 330 B14R1.520 CCOC(=O)COCC1=CC=CC=C1 SC-68827 [0,2,0,0,0,0|1,0,0]=3 331 B14R1.520 CCOC(=O)C\N=C\C1=CC=CC=C1 SC-31188 [0,2,0,0,0,0|1,0,1]=4 332 B14R1.520 CCOC(=O)\C=C\CC1=CC=CC=C1 SC-61904 [0,2,0,0,0,0|0,0,2]=4 333 B14R1.520 CCOC(=O)\C=C\CC1=CC=CC=C1 SC-61905 [0,2,0,0,0,0|0,0,2]=4 334 B12R2.1 NNC1CCC2=C1C=CC=C2 SC-59032 [1,0,0,1,0,0|2,0,0]=4 335 B12R2.1 OCC1OCC2=CC=CC=C21 SC-14005 [1,0,0,1,0,0|1,0,1]=4 336 B12R2.2 C1=CC=C(C2CCCN2)C=C1 SC-26472 [1,0,0,1,0,0|1,0,1]=4 337 B12R2.2 C1=CC=C(C2CCNC2)C=C1 SC-36240 [1,0,0,1,0,0|2,0,0]=4 338 B12R2.2 C1=CC=C(C2CCNC2)C=C1 SC-47817 [1,0,0,1,0,0|2,0,0]=4 339 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 SC-54752 [1,0,0,1,0,0|1,0,1]=4 340 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 SC-A3783 [1,0,0,1,0,0|1,0,1]=4 341 B12R2.2 C1=CC=C([C@@H]2CCNC2)C=C1 SC-B7869 [1,0,0,1,0,0|2,0,0]=4 342 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 SC-21775 [1,0,0,1,0,0|2,0,0]=4 343 B12R2.23 O=C1CCN1C2=CC=CC=C2 SC-45405 [1,0,0,1,0,0|1,0,0]=3 344 B12R2.27 O=C[C@@H]1C[C@H]1C2=CC=CC=C2 SC-54076 [1,0,0,1,0,0|0,0,0]=2 345 B12R2.41 C1=CC=C2CCCC=CC2=C1 SC-85750 [1,0,0,1,0,0|1,0,0]=3 346 B12R2.41 C1=CC=C2CCCCCC2=C1 SC-36155 [1,0,0,1,0,0|1,0,1]=4 347 B12R2.41 C1=CC=C2CNCCCC2=C1 SC-95327 [1,0,0,1,0,0|2,0,0]=4 348 B12R2.41 C1=CC=C2CNCCCC2=C1 SC-A2065 [1,0,0,1,0,0|2,0,0]=4 349 B12R2.41 C1=CC=C2NCCCCC2=C1 SC-21560 [1,0,0,1,0,0|1,0,1]=4 350 B12R2.41 C1=CC=C2OCCCNC2=C1 SC-36095 [1,0,0,1,0,0|1,0,1]=4 351 B12R2.41 C1=CC=C2OCCCOC2=C1 SC-26913 [1,0,0,1,0,0|1,0,1]=4 352 B12R2.1081 C=C1CCCC2=CC=CC=C12 SC-45518 [1,0,0,1,0,0|1,0,0]=3 353 B12R2.1081 CC1=CCCC2=C1C=CC=C2 SC-88953 [1,0,0,1,0,0|1,0,1]=4 354 B12R2.1081 CN1CCCC2=C1C=CC=C2 SC-28600 [1,0,0,1,0,0|2,0,0]=4 355 B12R2.1081 NC1CCCC2=C1C=CC=C2 SC-21114 [1,0,0,1,0,0|1,0,1]=4 356 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 SC-44493 [1,0,0,1,0,0|1,0,1]=4 357 B12R2.1081 O=C1CCCC2=C1C=CC=N2 SC-33091 [1,0,0,1,0,0|1,0,0]=3 358 B12R2.1081 O=C1CCCC2=C1C=CN=C2 SC-14614 [1,0,0,1,0,0|1,0,0]=3 359 B12R2.1081 O=C1CCCC2=C1C=CN=C2 SC-70199 [1,0,0,1,0,0|1,0,0]=3 360 B12R2.1081 O=C1CCCC2=C1C=NC=C2 SC-40262 [1,0,0,1,0,0|1,0,0]=3 361 B12R2.1081 O=C1CCCC2=C1C=NC=C2 SC-47535 [1,0,0,1,0,0|1,0,0]=3 362 B12R2.1081 O=C1CCCC2=C1N=CC=C2 SC-11409 [1,0,0,1,0,0|1,0,0]=3 363 B12R2.1081 O=C1CCNC2=C1C=CC=C2 SC-21443 [1,0,0,1,0,0|1,0,0]=3 364 B12R2.1081 O=C1CCNC2=C1C=CC=C2 SC-A3233 [1,0,0,1,0,0|1,0,0]=3 365 B12R2.1081 O=C1CCOC2=C1N=CC=C2 SC-84669 [1,0,0,1,0,0|2,0,0]=4 366 B12R2.1081 O=C1COCC2=C1C=CC=C2 SC-27836 [1,0,0,1,0,0|1,0,0]=3 367 B12R2.1081 O=C1NCCC2=C1C=CC=C2 SC-25175 [1,0,0,1,0,0|1,0,0]=3 368 B12R2.1081 O=C1NCCC2=C1N=CC=C2 SC-49713 [1,0,0,1,0,0|2,0,0]=4 369 B12R2.1081 OC1CCCC2=C1C=CN=C2 SC-29515 [1,0,0,1,0,0|1,0,1]=4 370 B12R2.1081 OC1CNCC2=C1C=CC=C2 SC-89460 [1,0,0,1,0,0|1,0,1]=4 371 B12R2.1081 [C@@H]1(N)CCCC2=CC=CC=C21 SC-45076 [1,0,0,1,0,0|1,0,1]=4 372 B12R2.2057 C1=CC=C(OC[C@@H]2CO2)C=C1 SC-52606 [1,0,0,1,0,0|1,0,1]=4 373 B12R2.2057 C1=CC=C(OC[C@H]2CO2)C=C1 SC-52609 [1,0,0,1,0,0|1,0,1]=4 374 B12R2.2058 C1=CC=C(CC2CNC2)C=C1 SC-42034 [1,0,0,1,0,0|2,0,0]=4 375 B12R2.24 CC1=CC2=C(C=CC=C2)CC1 SC-88943 [0,0,0,1,1,0|2,0,0]=4 376 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 SC-19598 [0,0,0,1,1,0|0,0,2]=4 377 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 SC-90927 [0,0,0,1,1,0|2,0,0]=4 378 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 SC-16512 [0,0,0,1,1,0|2,0,0]=4 379 B12R2.24 O=C1CCC2=C(C=CC=C2)C1 SC-17975 [0,0,0,1,1,0|1,0,0]=3 380 B12R2.24 O=C1CCC2=C(C=NC=C2)N1 SC-29951 [0,0,0,1,1,0|2,0,0]=4 381 B12R2.24 O=C1CCC2=CC=CC=C2N1 SC-18489 [0,0,0,1,1,0|1,0,0]=3 382 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 SC-86899 [0,0,0,1,1,0|2,0,0]=4 383 B12R2.24 O=C1COC2=CC=CC=C2N1 SC-03871 [0,0,0,1,1,0|2,0,0]=4 384 B12R2.24 O=C1NCC2=C(C=CC=C2)N1 SC-24920 [0,0,0,1,1,0|2,0,0]=4 385 B12R2.24 OC1CCC2=C(C=CC=C2)C1 SC-26690 [0,0,0,1,1,0|1,0,1]=4 386 B12R2.3190 O=C(Cl)C1CC2=CC=CC=C21 SC-61000 [0,0,0,1,1,0|1,0,0]=3 387 B12R2.3190 O=C(O)C1=CC2=CC=CC=C21 SC-19627 [0,0,0,1,1,0|0,0,2]=4 388 B14R2.2 O=C(O)CC1=CNC2=C1C=CC=C2 SC-07103 [0,0,0,1,0,1|0,0,2]=4 389 B14R2.2 O=C(O)CC1=NOC2=CC=CC=C21 SC-65108 [0,0,0,1,0,1|1,0,1]=4 390 B14R2.2 O=C(O)CC1CCC2=C1C=CC=C2 SC-30355 [0,0,0,1,0,1|0,0,0]=2 391 B14R2.2 O=C(O)CN1C=CC2=C1C=CC=C2 SC-12057 [0,0,0,1,0,1|0,0,2]=4 392 B14R2.2 O=C(O)CN1N=CC2=C1C=CC=C2 SC-53181 [0,0,0,1,0,1|1,0,1]=4 393 B14R2.2 O=C(O)\C=C1/CCC2=C1C=CC=C2 SC-36336 [0,0,0,1,0,1|0,0,1]=3 394 B14R2.19 O=C1CCN(CC2=CC=CC=C2)C1 SC-06753 [0,0,0,1,0,1|1,0,0]=3 395 B14R2.19 O=C1CCN(CC2=CC=CC=C2)C1 SC-25251 [0,0,0,1,0,1|1,0,0]=3 396 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CO1 SC-19534 [0,0,0,1,0,1|1,0,0]=3 397 B14R2.19 O=C1N[C@H](CC2=CC=CC=C2)CO1 SC-00097 [0,0,0,1,0,1|1,0,0]=3 398 B14R2.19 OC1CCN(CC2=CC=CC=C2)C1 SC-08969 [0,0,0,1,0,1|1,0,1]=4 399 B14R2.19 OC1CCN(CC2=CC=CC=C2)C1 SC-18235 [0,0,0,1,0,1|1,0,1]=4 400 B14R2.19 S=C1N[C@@H](CC2=CC=CC=C2)CO1 SC-65525 [0,0,0,1,0,1|1,1,0]=4 401 B14R2.19 S=C1N[C@@H](CC2=CC=CC=C2)CS1 SC-17059 [0,0,0,1,0,1|1,1,0]=4 402 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CO1 SC-14154 [0,0,0,1,0,1|1,1,0]=4 403 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CS1 SC-75768 [0,0,0,1,0,1|1,1,0]=4 404 B14R2.19 [C@H]1(CC2=CC=CC=C2)COC(=O)N1 SC-07268 [0,0,0,1,0,1|1,0,0]=3 405 B14R2.21 O=C1CCCC(C2=CC=CC=C2)O1 SC-36252 [0,0,0,1,0,1|0,0,0]=2 406 B14R2.21 O=C1CCC[C@@H](C2=CC=CC=C2)C1 SC-45226 [0,0,0,1,0,1|1,0,0]=3 407 B14R2.21 O=C1CCNC(C2=CC=CC=C2)C1 SC-35402 [0,0,0,1,0,1|1,0,0]=3 408 B14R2.21 O=C1COC[C@@H](C2=CC=CC=C2)N1 SC-A4508 [0,0,0,1,0,1|1,0,0]=3 409 B14R2.436 O=C1CC(OCC2=CC=CC=C2)C1 SC-52127 [0,0,0,1,0,1|1,0,0]=3 410 B14R2.436 OC1CC(OCC2=CC=CC=C2)C1 SC-B8431 [0,0,0,1,0,1|1,0,1]=4 411 B14R2.31359 CC(=O)N1CCCC2=C1C=CC=C2 SC-89441 [0,0,0,1,0,1|1,0,0]=3 412 B14R2.31359 O=C(O)C1CCCC2=C1C=CC=C2 SC-13448 [0,0,0,1,0,1|0,0,0]=2 413 B14R2.31359 O=C(O)C1CCCC2=CC=CC=C21 SC-02697 [0,0,0,1,0,1|0,0,0]=2 414 B14R2.31359 O=C(O)C1CCNC2=C1C=CC=C2 SC-35176 [0,0,0,1,0,1|0,0,0]=2 415 B14R2.31359 O=C(O)C1CCOC2=CC=CC=C21 SC-22348 [0,0,0,1,0,1|0,0,0]=2 416 B14R2.31359 O=C(O)C1CNCC2=C1C=CC=C2 SC-85998 [0,0,0,1,0,1|0,0,0]=2 417 B14R2.31359 O=C(O)C1CNCC2=C1C=CC=C2 SC-A3652 [0,0,0,1,0,1|0,0,0]=2 418 B14R2.31359 O=C(O)C1NCCC2=C1C=CC=C2 SC-21808 [0,0,0,1,0,1|0,0,0]=2 419 B14R2.31359 O=C(O)C1NCCC2=CC=CC=C21 SC-21344 [0,0,0,1,0,1|0,0,0]=2 420 B14R2.31359 O=C(O)[C@H]1CCCC2=C1C=CC=C2 SC-14979 [0,0,0,1,0,1|0,0,0]=2 421 B14R2.31359 O=C(O)[C@H]1NCCC2=C1C=CC=C2 SC-70900 [0,0,0,1,0,1|0,0,0]=2 422 B14R2.68 O=C1CCC(C2=CC=CC=C2)CO1 SC-35883 [0,1,0,1,0,0|0,0,0]=2 423 B14R2.68 O=C1CCC(C2=NC=CC=C2)CC1 SC-49378 [0,1,0,1,0,0|2,0,0]=4 424 B14R2.68 O=C1CCN(C2=CC=CC=C2)CC1 SC-20823 [0,1,0,1,0,0|2,0,0]=4 425 B14R2.68 O=C1CN[C@H](C2=CC=CC=C2)CO1 SC-77596 [0,1,0,1,0,0|1,0,0]=3 426 B14R2.287 O=C1CCC(=O)C2=CC=CC=C2N1 SC-96785 [0,1,0,1,0,0|1,0,1]=4 427 B14R2.25733 O=C1CC(C(=O)O)C2=CC=CC=C12 SC-03206 [0,1,0,1,0,0|0,0,1]=3 428 B14R2.25733 O=C1OC(C(=O)O)C2=CC=CC=C12 SC-61440 [0,1,0,1,0,0|1,0,1]=4 429 B14R2.22 CC1=CC(C2CNC(=O)C2)=CC=C1 SC-48820 [0,1,0,1,0,0|2,0,0]=4 430 B14R2.22 O=C1CC(C2=CC(Br)=CC=C2)CN1 SC-34709 [0,1,0,1,0,0|2,0,0]=4 431 B14R2.300 CC(=O)N1CCC2=C1C=CC(C)=C2 SC-57336 [0,1,0,1,0,0|2,0,0]=4 432 B14R2.300 CC(=O)N1CCC2=C1C=CC(Cl)=C2 SC-57327 [0,1,0,1,0,0|2,0,0]=4 433 B14R2.300 CC(=O)N1CCC2=C1C=CC(O)=C2 SC-49586 [0,1,0,1,0,0|2,0,0]=4 434 B14R2.300 CC(=O)N1CCC2=CC(Br)=CC=C21 SC-23850 [0,1,0,1,0,0|2,0,0]=4 435 B14R2.4476 O=C(O)C1CC1C2=CC=CC(Cl)=C2 SC-A2599 [0,1,0,1,0,0|0,0,0]=2 436 B14R2.8053 CC(=O)N1CCC2=C1C(C)=CC=C2 SC-57338 [0,1,0,1,0,0|2,0,0]=4 437 B14R2.8053 CC(=O)N1CCC2=C1C(Cl)=CC=C2 SC-61811 [0,1,0,1,0,0|2,0,0]=4 438 B14R2.256 CC1=CC=CC=C1C2CNC(=O)C2 SC-48747 [0,1,0,1,0,0|2,0,0]=4 439 B14R2.256 O=C1CC(C2=CC=CC=C2F)CN1 SC-48773 [0,1,0,1,0,0|2,0,0]=4 440 B14R2.768 O=C(O)CC1=CC2=C(C=CC=C2)N1 SC-28729 [0,1,0,1,0,0|0,0,2]=4 441 B14R2.781 CC(=O)N1CCC2=CC=CC=C2C1 SC-36655 [0,1,0,1,0,0|2,0,0]=4 442 B14R2.781 O=C(Cl)C1CCC2=C(C=CC=C2)C1 SC-61009 [0,1,0,1,0,0|1,0,0]=3 443 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)NC1 SC-69256 [0,1,0,1,0,0|1,0,1]=4 444 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)OC1 SC-52044 [0,1,0,1,0,0|1,0,1]=4 445 B14R2.781 O=C(O)C1CC2=C(C=CC=C2)CN1 SC-78444 [0,1,0,1,0,0|1,0,0]=3 446 B14R2.781 O=C(O)C1CC2=CC=CC=C2CN1 SC-44475 [0,1,0,1,0,0|1,0,0]=3 447 B14R2.781 O=C(O)C1CCC2=C(C=CC=C2)C1 SC-65318 [0,1,0,1,0,0|0,0,0]=2 448 B14R2.781 O=C(O)C1CCC2=C(C=CC=C2)N1 SC-A3399 [0,1,0,1,0,0|0,0,0]=2 449 B14R2.781 O=C(O)C1CCC2=CC=CC=C2N1 SC-49015 [0,1,0,1,0,0|0,0,0]=2 450 B14R2.781 O=C(O)C1CNC2=C(C=CC=C2)C1 SC-52232 [0,1,0,1,0,0|1,0,0]=3 451 B14R2.781 O=C(O)C1CNC2=CC=CC=C2O1 SC-92503 [0,1,0,1,0,0|1,0,0]=3 452 B14R2.781 O=C(O)C1COC2=CC=CC=C2C1 SC-65754 [0,1,0,1,0,0|1,0,0]=3 453 B14R2.781 O=C(O)C1COC2=CC=CC=C2N1 SC-87885 [0,1,0,1,0,0|1,0,0]=3 454 B14R2.781 O=C(O)C1COC2=CC=CC=C2N1 SC-A4963 [0,1,0,1,0,0|1,0,0]=3 455 B14R2.781 O=C(O)C1COC2=CC=CC=C2O1 SC-23379 [0,1,0,1,0,0|1,0,0]=3 456 B14R2.781 O=C(O)[C@@H]1CC2=C(C=CC=C2)CN1 SC-06593 [0,1,0,1,0,0|1,0,0]=3 457 B14R2.781 O=C(O)[C@@H]1COC2=CC=CC=C2O1 SC-93049 [0,1,0,1,0,0|1,0,0]=3 458 B14R2.781 O=C(O)[C@H]1CCC2=C(C=CC=C2)N1 SC-A2473 [0,1,0,1,0,0|0,0,0]=2 459 B14R2.781 O=C(O)[C@H]1CCC2=CC=CC=C2C1 SC-50071 [0,1,0,1,0,0|0,0,0]=2 460 B14R2.8032 CC(=O)N1CCC2=C1C=CC=C2Br SC-61813 [0,1,0,1,0,0|2,0,0]=4 461 B14R2.8032 CC(=O)N1CCC2=C1C=CC=C2Cl SC-57326 [0,1,0,1,0,0|2,0,0]=4 462 B14R2.8032 CC(=O)N1CCC2=C1C=CC=C2N SC-57319 [0,1,0,1,0,0|2,0,0]=4 463 B14R2.8032 NC1=CC=CC2=C1N=NC2C(=O)O SC-41798 [0,1,0,1,0,0|2,0,0]=4 464 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 SC-47562 [0,1,0,1,0,0|1,0,0]=3 465 B14R2.598 [C@@H]1(C2=CC=CC=C2)OC(=O)N[C@@H]1C SC-47563 [0,1,0,1,0,0|1,0,0]=3 466 B14R2.741 N[C@@H]1CCC2=CC=CC=C2NC1=O SC-20528 [0,1,0,1,0,0|1,0,0]=3 467 B14R2.9535 NC1(C(=O)O)CCC2=C1C=CC=C2 SC-86822 [0,1,0,1,0,0|0,0,0]=2 468 B14R2.20 CC1=CC=C(C2CCC(=O)O2)C=C1 SC-36106 [0,1,0,1,0,0|0,0,0]=2 469 B14R2.20 NC1=CC=C(C2CNC(=O)C2)C=C1 SC-22371 [0,1,0,1,0,0|2,0,0]=4 470 B14R2.20 O=C1CC(C2=CC=C(Cl)C=C2)CN1 SC-22370 [0,1,0,1,0,0|2,0,0]=4 471 B14R2.20 O=C1CCC(C2=CC=C(Br)C=C2)O1 SC-36132 [0,1,0,1,0,0|0,0,0]=2 472 B14R2.20 O=C1CCC(C2=CC=C(Cl)C=C2)O1 SC-36131 [0,1,0,1,0,0|0,0,0]=2 473 B14R2.20 O=C1CCC(C2=CC=C(F)C=C2)N1 SC-37835 [0,1,0,1,0,0|1,0,0]=3 474 B14R2.4402 O=C(O)C1CC1C2=CC=C(Br)C=C2 SC-A3021 [0,1,0,1,0,0|0,0,0]=2 475 B14R2.4402 O=C(O)C1CC1C2=CC=C(Cl)C=C2 SC-A2417 [0,1,0,1,0,0|0,0,0]=2 476 B14R2.5816 CC(=O)N1CCC2=C1C=C(C)C=C2 SC-57337 [0,1,0,1,0,0|2,0,0]=4 477 B14R2.5816 CC(=O)N1CCC2=C1C=C(Cl)C=C2 SC-57328 [0,1,0,1,0,0|2,0,0]=4 478 B14R2.5816 NC1=CC2=C(C=C1)N=NC2C(=O)O SC-41698 [0,1,0,1,0,0|2,0,0]=4 479 B14R2.95 O=C(CBr)N1CCC2=C1C=CC=C2 SC-48703 [0,1,0,1,0,0|2,0,0]=4 480 B14R2.279 NC1C2=CC=CC=C2CCCC1O SC-35243 [0,1,0,1,0,0|1,0,1]=4 481 B10R1.18 CC(=O)CC1=CC=NC=C1 SC-22966 [0,0,0,0,2,0|2,0,0]=4 482 B10R1.18 CC(=O)CC1=NC=CC=C1 SC-85146 [0,0,0,0,2,0|2,0,0]=4 483 B10R1.18 N=C(N)CC1=CC=CC=C1 SC-12266 [0,0,0,0,2,0|2,0,0]=4 484 B10R1.18 NC(=O)CC1=CC=CC=C1 SC-19149 [0,0,0,0,2,0|1,0,0]=3 485 B10R1.18 NC(=O)CC1=CC=CN=C1 SC-52723 [0,0,0,0,2,0|2,0,0]=4 486 B10R1.18 NC(=O)C[N+]1=CC=CC=C1 SC-78519 [0,0,0,0,2,0|2,0,0]=4 487 B10R1.18 O=C(Cl)CC1=CC=CC=C1 SC-78877 [0,0,0,0,2,0|1,0,0]=3 488 B10R1.18 O=C(Cl)OC1=CC=CC=C1 SC-18821 [0,0,0,0,2,0|2,0,0]=4 489 B10R1.18 O=C(O)CC1=CC=CN=C1 SC-12152 [0,0,0,0,2,0|1,0,0]=3 490 B10R1.18 O=C(O)CC1=CC=CN=C1 SC-16916 [0,0,0,0,2,0|1,0,0]=3 491 B10R1.18 O=C(O)CC1=CC=NC=C1 SC-26657 [0,0,0,0,2,0|1,0,0]=3 492 B10R1.18 O=C(O)CC1=CC=NC=C1 SC-80508 [0,0,0,0,2,0|1,0,0]=3 493 B10R1.18 O=C(O)CC1=CN=CN=C1 SC-47534 [0,0,0,0,2,0|2,0,0]=4 494 B10R1.18 O=C(O)CC1=NC=CC=C1 SC-20933 [0,0,0,0,2,0|1,0,0]=3 495 B10R1.18 O=C(O)CC1=NC=CC=C1 SC-26574 [0,0,0,0,2,0|1,0,0]=3 496 B10R1.18 O=C(O)CC1=NC=CC=N1 SC-21888 [0,0,0,0,2,0|2,0,0]=4 497 B10R1.18 O=C(O)CC1=NC=CN=C1 SC-25279 [0,0,0,0,2,0|2,0,0]=4 498 B10R1.18 O=C(O)CC1=NC=NC=C1 SC-14668 [0,0,0,0,2,0|2,0,0]=4 499 B10R1.66 O=C(O)CCC1=CC=CN1 SC-21976 [0,0,0,0,2,0|1,0,0]=3 500 B10R1.66 O=C(O)CCC1=CC=CO1 SC-51380 [0,0,0,0,2,0|1,0,0]=3 501 B10R1.66 O=C(O)CCC1=CSC=C1 SC-48358 [0,0,0,0,2,0|1,0,0]=3 502 B10R1.66 O=C(O)CCC1=NC=CS1 SC-43633 [0,0,0,0,2,0|2,0,0]=4 503 B10R1.66 O=C(O)CCN1C=CN=C1 SC-04130 [0,0,0,0,2,0|2,0,0]=4 504 B14R1.422 CC(=O)C#CCOCC1=CC=CC=C1 SC-31720 [0,0,0,0,0,2|1,0,1]=4 505 B14R1.422 O=C(O)CCCOCC1=CC=CC=C1 SC-70181 [0,0,0,0,0,2|0,0,0]=2 506 B14R1.422 O=C(O)\C=C\CNCC1=CC=CC=C1 SC-35146 [0,0,0,0,0,2|0,0,1]=3