0 B12R1.252 O=C(Cl)CCCC1=CC=CC=C1 SC-71520 [0,0,0,0,0,0|1,0,0]=1 1 B12R1.252 O=C(Cl)COCC1=CC=CC=C1 SC-20864 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.252 O=C(O)CCCC1=CC=CC=C1 SC-22740 [0,0,0,0,0,0|0,0,0]=0 3 B12R1.252 O=C(O)CNCC1=CC=CC=C1 SC-24828 [0,0,0,0,0,0|1,0,0]=1 4 B12R1.252 O=C(O)COCC1=CC=CC=C1 SC-11831 [0,0,0,0,0,0|1,0,0]=1 5 B11R1.28 BrCCCCC1=CC=CC=C1 SC-13820 [1,0,0,0,0,0|1,0,1]=3 6 B11R1.28 BrCCCOC1=CC=CC=C1 SC-76960 [1,0,0,0,0,0|2,0,1]=4 7 B11R1.28 BrCCOCC1=CC=CC=C1 SC-57855 [1,0,0,0,0,0|2,0,1]=4 8 B11R1.28 C#CCOCC1=CC=CC=C1 SC-14312 [1,0,0,0,0,0|2,0,1]=4 9 B11R1.28 CCCNCC1=CC=CC=C1 SC-65059 [1,0,0,0,0,0|2,0,1]=4 10 B11R1.28 ClCCCCC1=CC=NC=C1 SC-99954 [1,0,0,0,0,0|2,0,1]=4 11 B11R1.28 ClCCOCC1=CC=CC=C1 SC-12134 [1,0,0,0,0,0|2,0,1]=4 12 B11R1.28 ICCOCC1=CC=CC=C1 SC-A2944 [1,0,0,0,0,0|2,0,1]=4 13 B11R1.28 N#CCCCC1=CN=CC=C1 SC-12264 [1,0,0,0,0,0|2,0,1]=4 14 B11R1.28 NNCCCC1=CC=CC=C1 SC-45618 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.28 O=CCCCC1=CC=CC=C1 SC-59796 [1,0,0,0,0,0|0,0,0]=1 16 B11R1.28 O=CCOCC1=CC=CC=C1 SC-47403 [1,0,0,0,0,0|1,0,0]=2 17 B11R1.28 OCCCCC1=CC=CC=C1 SC-03572 [1,0,0,0,0,0|0,0,1]=2 18 B11R1.28 OCCNCC1=CC=CC=C1 SC-47199 [1,0,0,0,0,0|1,0,1]=3 19 B11R1.28 OCCOCC1=CC=CC=C1 SC-05822 [1,0,0,0,0,0|1,0,1]=3 20 B11R1.28 S=C=NCCC1=CC=CC=C1 SC-75540 [1,0,0,0,0,0|1,1,1]=4 21 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 22 B13R1.45 O=C([O-])CNC(=O)C1=CC=CC=C1 SC-40764 [0,1,0,0,0,0|1,0,2]=4 23 B13R1.158 O=C(O)CCCC1=CC=CC=C1F SC-11471 [0,1,0,0,0,0|0,0,0]=1 24 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 SC-46101 [0,1,0,0,0,0|0,0,0]=1 25 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 SC-48872 [0,1,0,0,0,0|0,0,0]=1 26 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 SC-77068 [0,1,0,0,0,0|0,0,0]=1 27 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 SC-46102 [0,1,0,0,0,0|0,0,0]=1 28 B13R1.351 CC(=O)C(=O)OCC1=CC=CC=C1 SC-A3376 [0,1,0,0,0,0|2,0,1]=4 29 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O SC-10977 [0,1,0,0,0,0|0,0,0]=1 30 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O SC-10979 [0,1,0,0,0,0|0,0,0]=1 31 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O SC-78855 [0,1,0,0,0,0|0,0,0]=1 32 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O SC-76550 [0,1,0,0,0,0|1,0,0]=2 33 B13R1.351 O=C(O)[C@H](O)CCC1=CC=CC=C1 SC-44640 [0,1,0,0,0,0|0,0,0]=1 34 B13R1.351 [C@@H](N)(CCC1=CC=CC=C1)C(=O)O SC-10978 [0,1,0,0,0,0|0,0,0]=1 35 B13R1.513 CC(=O)NCCC1=CC=C(O)C=C1 SC-83302 [0,1,0,0,0,0|2,0,0]=3 36 B13R1.513 CC1=CC=C(CCCC(=O)O)C=C1 SC-68300 [0,1,0,0,0,0|0,0,0]=1 37 B13R1.513 O=C(O)CCCC1=CC=C(Br)C=C1 SC-49268 [0,1,0,0,0,0|0,0,0]=1 38 B13R1.718 COC(=O)CNCC1=CC=CC=C1 SC-73836 [0,1,0,0,0,0|1,0,0]=2 39 B13R2.10 O=C1CC(C2=CC=CC=C2)CN1 SC-A2649 [0,0,0,1,0,0|2,0,0]=3 40 B13R2.10 O=C1CN=C(C2=CC=CC=C2)O1 SC-21225 [0,0,0,1,0,0|1,0,1]=3 41 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 SC-07544 [0,0,0,1,0,0|2,0,0]=3 42 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 SC-07250 [0,0,0,1,0,0|2,0,0]=3 43 B13R2.10 [C@@H]1(C2=CC=CC=C2)CSC(=S)N1 SC-17069 [0,0,0,1,0,0|2,1,0]=4 44 B13R2.31 OC1CN(CC2=CC=CC=C2)C1 SC-40411 [0,0,0,1,0,0|2,0,1]=4 45 B13R2.72 CC(=O)N1CCC2=C1C=CC=C2 SC-01460 [0,0,0,1,0,0|2,0,0]=3 46 B13R2.72 O=C(O)C1=CNC2=C1C=CC=C2 SC-06727 [0,0,0,1,0,0|1,0,2]=4 47 B13R2.72 O=C(O)C1=CSC2=CC=CC=C21 SC-46218 [0,0,0,1,0,0|1,0,2]=4 48 B13R2.72 O=C(O)C1=NNC2=CC=CC=C21 SC-12540 [0,0,0,1,0,0|2,0,1]=4 49 B13R2.72 O=C(O)C1=NOC2=CC=CC=C21 SC-26583 [0,0,0,1,0,0|2,0,1]=4 50 B13R2.72 O=C(O)C1CCC2=C1C=CC=C2 SC-21633 [0,0,0,1,0,0|0,0,0]=1 51 B13R2.72 O=C(O)C1NCC2=C1C=CC=C2 SC-49419 [0,0,0,1,0,0|1,0,0]=2 52 B13R2.72 O=C(O)[C@H]1NCC2=C1C=CC=C2 SC-70901 [0,0,0,1,0,0|1,0,0]=2 53 B13R2.163 O=C1CC2=CC=CC=C2CCN1 SC-A3624 [0,0,0,1,0,0|2,0,0]=3 54 B13R2.163 O=C1CCCC2=CC=CC=C2C1 SC-48284 [0,0,0,1,0,0|1,0,0]=2 55 B13R2.163 O=C1NCCC2=CC=CC=C2N1 SC-49030 [0,0,0,1,0,0|2,0,0]=3 56 B13R2.423 O=C(O)C1CC1C2=CC=CC=C2 SC-71542 [0,0,0,1,0,0|0,0,0]=1 57 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 58 B13R2.2382 C1=CC=C(COCC2CO2)C=C1 SC-01157 [0,0,0,1,0,0|2,0,1]=4 59 B13R2.2382 C1=CC=C(COCC2CO2)C=C1 SC-82731 [0,0,0,1,0,0|2,0,1]=4 60 B13R2.2382 C1=CC=C(COC[C@@H]2CO2)C=C1 SC-01544 [0,0,0,1,0,0|2,0,1]=4 61 B11R1.91 CC(=O)C#CC1=CC=CC=C1 SC-83281 [0,0,0,0,1,0|1,0,2]=4 62 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 SC-80359 [0,0,0,0,1,0|1,0,2]=4 63 B11R1.91 C[C@H](O)CCC1=CC=CC=C1 SC-A2296 [0,0,0,0,1,0|1,0,1]=3 64 B11R1.91 N=C(N)NCC1=CC=CC=C1 SC-A4867 [0,0,0,0,1,0|3,0,0]=4 65 B11R1.91 NC(=O)OCC1=CC=CC=C1 SC-47828 [0,0,0,0,1,0|2,0,0]=3 66 B11R1.91 N\C(S)=N/CC1=CC=CC=C1 SC-81144 [0,0,0,0,1,0|2,1,0]=4 67 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 SC-06047 [0,0,0,0,1,0|1,0,0]=2 68 B11R1.91 O=C(O)C#CC1=CC=CC=C1 SC-13741 [0,0,0,0,1,0|0,0,2]=3 69 B11R1.91 O=C(O)CCC1=NC=CC=C1 SC-50767 [0,0,0,0,1,0|1,0,0]=2 70 B11R1.91 O=C(O)CCC1=NC=CC=N1 SC-22039 [0,0,0,0,1,0|2,0,0]=3 71 B11R1.91 O=C(O)CNC1=CC=CC=C1 SC-75650 [0,0,0,0,1,0|1,0,0]=2 72 B11R1.91 O=C(O)CNC1=CC=CN=C1 SC-A2839 [0,0,0,0,1,0|2,0,0]=3 73 B11R1.91 O=C(O)COC1=CC=CN=C1 SC-47923 [0,0,0,0,1,0|2,0,0]=3 74 B11R1.91 O=C(O)CSC1=NC=CC=N1 SC-77923 [0,0,0,0,1,0|3,0,0]=4 75 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 SC-39613 [0,0,0,0,1,0|1,0,2]=4 76 B11R1.91 O=C(O)\C=C\C1=CN=CC=C1 SC-57973 [0,0,0,0,1,0|1,0,2]=4 77 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 SC-62388 [0,0,0,0,1,0|1,0,2]=4 78 B13R1.337 CC(=O)CCCCC1=CC=CC=C1 SC-70636 [0,0,0,0,0,1|1,0,0]=2 79 B13R1.337 O=C(O)CCCCC1=CC=CC=C1 SC-15647 [0,0,0,0,0,1|0,0,0]=1 80 B13R1.337 O=C(O)CCSSC1=NC=CC=C1 SC-95019 [0,0,0,0,0,1|2,0,0]=3 81 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 82 B10R1.17 C=CCSC1=CC=CC=C1 SC-A2865 [2,0,0,0,0,0|1,0,1]=4 83 B10R1.17 CCCC[N+]1=CC=CC=C1 SC-07618 [2,0,0,0,0,0|1,0,1]=4 84 B10R1.17 CCCC[N+]1=CC=CC=C1 SC-62348 [2,0,0,0,0,0|1,0,1]=4 85 B10R1.17 CCNCC1=CC=CC=C1 SC-18916 [2,0,0,0,0,0|1,0,1]=4 86 B10R1.17 ClCCCC1=CC=CC=N1 SC-54618 [2,0,0,0,0,0|2,0,0]=4 87 B10R1.17 ClCOCC1=CC=CC=C1 SC-03811 [2,0,0,0,0,0|2,0,0]=4 88 B10R1.17 ICCCC1=CC=CC=C1 SC-54412 [2,0,0,0,0,0|1,0,0]=3 89 B10R1.17 NCCCC1=CC=NC=C1 SC-34013 [2,0,0,0,0,0|2,0,0]=4 90 B10R1.17 NCCCC1=CC=NC=C1 SC-41628 [2,0,0,0,0,0|2,0,0]=4 91 B10R1.17 NCCOC1=CC=CC=C1 SC-25696 [2,0,0,0,0,0|2,0,0]=4 92 B10R1.17 NOCCC1=CC=CC=C1 SC-99889 [2,0,0,0,0,0|2,0,0]=4 93 B10R1.17 O=C=NCC1=CC=CC=C1 SC-27328 [2,0,0,0,0,0|1,0,1]=4 94 B10R1.17 O=CCCC1=CC=CC=C1 SC-79262 [2,0,0,0,0,0|0,0,0]=2 95 B10R1.17 O=CCCC1=CN=CC=C1 SC-14308 [2,0,0,0,0,0|1,0,0]=3 96 B10R1.17 O=C\C=C\C1=CC=CC=C1 SC-19143 [2,0,0,0,0,0|0,0,2]=4 97 B10R1.17 OCCCC1=CC=CC=C1 SC-26828 [2,0,0,0,0,0|0,0,0]=2 98 B10R1.17 OCCCC1=CC=NC=C1 SC-19784 [2,0,0,0,0,0|1,0,0]=3 99 B10R1.17 OCCNC1=CC=CC=C1 SC-47141 [2,0,0,0,0,0|1,0,0]=3 100 B10R1.17 OCCSC1=CC=CC=C1 SC-46195 [2,0,0,0,0,0|1,0,0]=3 101 B10R1.17 [C-]#[N+]CCC1=CC=CC=C1 SC-51184 [2,0,0,0,0,0|1,0,1]=4 102 B12R1.1 CC1=CC=C(CCCCO)C=C1 SC-54522 [1,1,0,0,0,0|0,0,1]=3 103 B12R1.1 OCCCCC1=CC=C(Br)C=C1 SC-50344 [1,1,0,0,0,0|0,0,1]=3 104 B12R1.8 BrCCCOCC1=CC=CC=C1 SC-23991 [1,1,0,0,0,0|1,0,1]=4 105 B12R1.8 NCCCNCC1=CC=CC=C1 SC-21184 [1,1,0,0,0,0|1,0,1]=4 106 B12R1.8 O=CCCOCC1=CC=CC=C1 SC-33984 [1,1,0,0,0,0|0,0,0]=2 107 B12R1.8 OCCCOCC1=CC=CC=C1 SC-22056 [1,1,0,0,0,0|0,0,1]=3 108 B12R1.27 OCC(O)COC1=CC=CC=C1 SC-16362 [1,1,0,0,0,0|1,0,1]=4 109 B12R1.30 CNCCC(O)C1=CC=CC=C1 SC-25550 [1,1,0,0,0,0|2,0,0]=4 110 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 SC-01266 [0,1,0,0,1,0|0,0,0]=2 111 B12R1.21 N=C(N)CCC1=CC=C(Cl)C=C1 SC-54614 [0,1,0,0,1,0|2,0,0]=4 112 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 SC-65225 [0,1,0,0,1,0|0,0,2]=4 113 B12R1.21 O=C(Cl)COC1=CC=C(F)C=C1 SC-97746 [0,1,0,0,1,0|2,0,0]=4 114 B12R1.21 O=C(O)C#CC1=CC=C(Cl)C=C1 SC-14663 [0,1,0,0,1,0|0,0,2]=4 115 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 SC-26484 [0,1,0,0,1,0|0,0,0]=2 116 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 SC-16870 [0,1,0,0,1,0|0,0,0]=2 117 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 SC-45457 [0,1,0,0,1,0|0,0,0]=2 118 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 SC-13665 [0,1,0,0,1,0|0,0,0]=2 119 B12R1.21 O=C(O)CNC1=CC=C(Cl)C=C1 SC-48332 [0,1,0,0,1,0|1,0,0]=3 120 B12R1.21 O=C(O)CNC1=CC=C(F)C=C1 SC-25784 [0,1,0,0,1,0|1,0,0]=3 121 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 SC-17666 [0,1,0,0,1,0|1,0,0]=3 122 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 SC-00565 [0,1,0,0,1,0|0,0,2]=4 123 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 SC-01473 [0,1,0,0,1,0|0,0,2]=4 124 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 SC-28823 [0,1,0,0,1,0|0,0,2]=4 125 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 SC-25929 [0,1,0,0,1,0|0,0,2]=4 126 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 SC-09787 [0,1,0,0,1,0|1,0,0]=3 127 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O SC-01259 [0,1,0,0,1,0|0,0,0]=2 128 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O SC-09766 [0,1,0,0,1,0|0,0,0]=2 129 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O SC-09765 [0,1,0,0,1,0|0,0,0]=2 130 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O SC-03978 [0,1,0,0,1,0|1,0,0]=3 131 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 SC-45736 [0,1,0,0,1,0|0,0,0]=2 132 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 SC-96045 [0,1,0,0,1,0|0,0,0]=2 133 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 SC-02277 [0,1,0,0,1,0|0,0,0]=2 134 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 SC-06556 [0,1,0,0,1,0|0,0,0]=2 135 B12R1.43 [C@H](N)(CC1=CC=NC=C1)C(=O)O SC-19508 [0,1,0,0,1,0|1,0,0]=3 136 B12R1.107 C[C@H](CC(=O)O)C1=CC=CC=C1 SC-A2836 [0,1,0,0,1,0|0,0,0]=2 137 B12R1.107 NC(=O)CC(=O)C1=CC=CC=C1 SC-84768 [0,1,0,0,1,0|1,0,1]=4 138 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 SC-45519 [0,1,0,0,1,0|0,0,0]=2 139 B12R1.107 N[C@H](CC(=O)O)C1=CC=CN=C1 SC-82383 [0,1,0,0,1,0|1,0,0]=3 140 B12R1.107 O=C(O)CC(=O)C1=CC=CC=C1 SC-19254 [0,1,0,0,1,0|0,0,1]=3 141 B12R1.125 CC1=CC=CC=C1CCC(=O)O SC-27982 [0,1,0,0,1,0|0,0,0]=2 142 B12R1.125 O=C(O)CCC1=CC=CC=C1Br SC-17877 [0,1,0,0,1,0|0,0,0]=2 143 B12R1.125 O=C(O)CNC1=CC=CC=C1F SC-92918 [0,1,0,0,1,0|1,0,0]=3 144 B12R1.125 O=C(O)COC1=CC=CC=C1F SC-50195 [0,1,0,0,1,0|1,0,0]=3 145 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Br SC-81630 [0,1,0,0,1,0|0,0,2]=4 146 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Cl SC-03976 [0,1,0,0,1,0|0,0,2]=4 147 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 SC-13720 [0,1,0,0,1,0|0,0,0]=2 148 B12R1.226 O=C(O)COC1=CC=CC(Br)=C1 SC-84996 [0,1,0,0,1,0|1,0,0]=3 149 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 SC-92718 [0,1,0,0,1,0|0,0,2]=4 150 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 SC-02327 [0,1,0,0,1,0|0,0,2]=4 151 B14R1.716 COC(=O)CCNCC1=CC=CC=C1 SC-71276 [0,1,0,0,0,1|0,0,0]=2 152 B14R1.818 CC(=O)OC(C)CCC1=CC=CC=C1 SC-94020 [0,1,0,0,0,1|1,0,0]=3 153 B14R1.818 O=C(O)CC(=O)OCC1=CC=CC=C1 SC-66833 [0,1,0,0,0,1|0,0,1]=3 154 B14R1.6449 NC(COCC1=CC=CC=C1)C(=O)O SC-21032 [0,1,0,0,0,1|0,0,0]=2 155 B14R1.6449 N[C@@H](COCC1=CC=CC=C1)C(=O)O SC-09857 [0,1,0,0,0,1|0,0,0]=2 156 B14R1.813 O=C(O)CCS(=O)(=O)C1=CC=CC=C1 SC-A2963 [0,2,0,0,0,0|1,0,0]=3 157 B14R1.154 O=C(O)CCCC1=CC=CC(O)=C1O SC-51738 [0,2,0,0,0,0|0,0,0]=2 158 B14R1.5978 N[C@@H](CC(=O)O)CC1=CC=CC(F)=C1 SC-A1235 [0,2,0,0,0,0|0,0,0]=2 159 B14R1.337 N[C@@H](CC(=O)O)CC1=CC=CC=C1F SC-A1230 [0,2,0,0,0,0|0,0,0]=2 160 B14R1.337 N[C@H](CC(=O)O)CC1=CC=CC=C1Br SC-A1239 [0,2,0,0,0,0|0,0,0]=2 161 B14R1.4464 O=C(O)CCCC1=CC=C(Cl)C=C1Cl SC-13057 [0,2,0,0,0,0|0,0,0]=2 162 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]=2 163 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]=2 164 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]=2 165 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]=2 166 B14R1.743 COC(=O)CC(=O)CC1=CC=CC=C1 SC-25807 [0,2,0,0,0,0|0,0,1]=3 167 B14R1.679 CC(COC1=CC=C(Cl)C=C1)C(=O)O SC-25413 [0,2,0,0,0,0|1,0,0]=3 168 B14R1.4 CCC1=CC=C(CCCC(=O)O)C=C1 SC-50579 [0,2,0,0,0,0|0,0,0]=2 169 B14R1.4 COC1=CC=C(CCCC(=O)O)C=C1 SC-25820 [0,2,0,0,0,0|0,0,0]=2 170 B14R1.4 COC1=CC=C(COCC(=O)O)C=C1 SC-53236 [0,2,0,0,0,0|1,0,0]=3 171 B14R1.520 CCOC(=O)CCNC1=NC=CC=C1 SC-44413 [0,2,0,0,0,0|2,0,0]=4 172 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 SC-12695 [0,2,0,0,0,0|1,0,0]=3 173 B14R1.520 CCOC(=O)COCC1=CC=CC=C1 SC-68827 [0,2,0,0,0,0|1,0,0]=3 174 B14R1.520 CCOC(=O)C\N=C\C1=CC=CC=C1 SC-31188 [0,2,0,0,0,0|1,0,1]=4 175 B12R2.2 C1=CC=C(C2CCCN2)C=C1 SC-26472 [1,0,0,1,0,0|1,0,1]=4 176 B12R2.2 C1=CC=C(C2CCNC2)C=C1 SC-36240 [1,0,0,1,0,0|2,0,0]=4 177 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 SC-54752 [1,0,0,1,0,0|1,0,1]=4 178 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 SC-A3783 [1,0,0,1,0,0|1,0,1]=4 179 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 SC-21775 [1,0,0,1,0,0|2,0,0]=4 180 B12R2.23 O=C1CCN1C2=CC=CC=C2 SC-45405 [1,0,0,1,0,0|1,0,0]=3 181 B12R2.41 C1=CC=C2CCCC=CC2=C1 SC-85750 [1,0,0,1,0,0|1,0,0]=3 182 B12R2.41 C1=CC=C2CNCCCC2=C1 SC-95327 [1,0,0,1,0,0|2,0,0]=4 183 B12R2.41 C1=CC=C2CNCCCC2=C1 SC-A2065 [1,0,0,1,0,0|2,0,0]=4 184 B12R2.41 C1=CC=C2NCCCCC2=C1 SC-21560 [1,0,0,1,0,0|1,0,1]=4 185 B12R2.1081 BrC1CCCC2=C1C=CC=C2 SC-88957 [1,0,0,1,0,0|1,0,1]=4 186 B12R2.1081 C=C1CCCC2=CC=CC=C12 SC-45518 [1,0,0,1,0,0|1,0,0]=3 187 B12R2.1081 CC1=CCCC2=C1C=CC=C2 SC-88953 [1,0,0,1,0,0|1,0,1]=4 188 B12R2.1081 CN1CCCC2=C1C=CC=C2 SC-28600 [1,0,0,1,0,0|2,0,0]=4 189 B12R2.1081 NC1CCCC2=C1C=CC=C2 SC-21114 [1,0,0,1,0,0|1,0,1]=4 190 B12R2.1081 O=C1CCCC2=C1C=CC=C2 SC-25802 [1,0,0,1,0,0|0,0,0]=2 191 B12R2.1081 O=C1CCCC2=C1C=CC=N2 SC-33091 [1,0,0,1,0,0|1,0,0]=3 192 B12R2.1081 O=C1CCCC2=C1C=CN=C2 SC-14614 [1,0,0,1,0,0|1,0,0]=3 193 B12R2.1081 O=C1CCCC2=C1C=CN=C2 SC-70199 [1,0,0,1,0,0|1,0,0]=3 194 B12R2.1081 O=C1CCCC2=C1C=NC=C2 SC-40262 [1,0,0,1,0,0|1,0,0]=3 195 B12R2.1081 O=C1CCCC2=C1C=NC=C2 SC-47535 [1,0,0,1,0,0|1,0,0]=3 196 B12R2.1081 O=C1CCCC2=C1N=CC=C2 SC-11409 [1,0,0,1,0,0|1,0,0]=3 197 B12R2.1081 O=C1CCNC2=C1C=CC=C2 SC-21443 [1,0,0,1,0,0|1,0,0]=3 198 B12R2.1081 O=C1CCNC2=C1C=CC=C2 SC-A3233 [1,0,0,1,0,0|1,0,0]=3 199 B12R2.1081 O=C1CCOC2=C1N=CC=C2 SC-84669 [1,0,0,1,0,0|2,0,0]=4 200 B12R2.1081 O=C1CCOC2=CC=CC=C12 SC-04797 [1,0,0,1,0,0|1,0,0]=3 201 B12R2.1081 O=C1COCC2=C1C=CC=C2 SC-27836 [1,0,0,1,0,0|1,0,0]=3 202 B12R2.1081 O=C1NCCC2=C1C=CC=C2 SC-25175 [1,0,0,1,0,0|1,0,0]=3 203 B12R2.1081 O=C1NCCC2=C1N=CC=C2 SC-49713 [1,0,0,1,0,0|2,0,0]=4 204 B12R2.1081 OC1CNCC2=C1C=CC=C2 SC-89460 [1,0,0,1,0,0|1,0,1]=4 205 B12R2.1081 [C@@H]1(N)CCCC2=CC=CC=C21 SC-45076 [1,0,0,1,0,0|1,0,1]=4 206 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 SC-35877 [0,0,0,1,1,0|1,0,0]=3 207 B12R2.24 CC1=CC2=C(C=CC=C2)CC1 SC-88943 [0,0,0,1,1,0|2,0,0]=4 208 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 SC-90927 [0,0,0,1,1,0|2,0,0]=4 209 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 SC-16512 [0,0,0,1,1,0|2,0,0]=4 210 B12R2.24 O=C1CCC2=C(C=CC=C2)C1 SC-17975 [0,0,0,1,1,0|1,0,0]=3 211 B12R2.24 O=C1CCC2=CC=CC=C2N1 SC-18489 [0,0,0,1,1,0|1,0,0]=3 212 B12R2.24 O=C1NCC2=C(C=CC=C2)N1 SC-24920 [0,0,0,1,1,0|2,0,0]=4 213 B12R2.3190 O=C(O)C1=CC2=CC=CC=C21 SC-19627 [0,0,0,1,1,0|0,0,2]=4 214 B14R2.2 O=C(O)CC1=CNC2=C1C=CC=C2 SC-07103 [0,0,0,1,0,1|0,0,2]=4 215 B14R2.2 O=C(O)CN1C=CC2=C1C=CC=C2 SC-12057 [0,0,0,1,0,1|0,0,2]=4 216 B14R2.2 O=C(O)CN1N=CC2=C1C=CC=C2 SC-53181 [0,0,0,1,0,1|1,0,1]=4 217 B14R2.19 O=C1CCN(CC2=CC=CC=C2)C1 SC-06753 [0,0,0,1,0,1|1,0,0]=3 218 B14R2.19 O=C1N[C@H](CC2=CC=CC=C2)CO1 SC-00097 [0,0,0,1,0,1|1,0,0]=3 219 B14R2.19 OC1CCN(CC2=CC=CC=C2)C1 SC-08969 [0,0,0,1,0,1|1,0,1]=4 220 B14R2.19 S=C1N[C@@H](CC2=CC=CC=C2)CS1 SC-17059 [0,0,0,1,0,1|1,1,0]=4 221 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CS1 SC-75768 [0,0,0,1,0,1|1,1,0]=4 222 B14R2.19 [C@H]1(CC2=CC=CC=C2)COC(=O)N1 SC-07268 [0,0,0,1,0,1|1,0,0]=3 223 B14R2.21 O=C1CCC[C@@H](C2=CC=CC=C2)C1 SC-45226 [0,0,0,1,0,1|1,0,0]=3 224 B14R2.21 O=C1CCNC(C2=CC=CC=C2)C1 SC-35402 [0,0,0,1,0,1|1,0,0]=3 225 B14R2.436 O=C1CC(OCC2=CC=CC=C2)C1 SC-52127 [0,0,0,1,0,1|1,0,0]=3 226 B14R2.436 OC1CC(OCC2=CC=CC=C2)C1 SC-B8431 [0,0,0,1,0,1|1,0,1]=4 227 B14R2.31359 CC(=O)N1CCCC2=C1C=CC=C2 SC-89441 [0,0,0,1,0,1|1,0,0]=3 228 B14R2.31359 O=C(O)C1CCCC2=C1C=CC=C2 SC-13448 [0,0,0,1,0,1|0,0,0]=2 229 B14R2.31359 O=C(O)C1CCCC2=CC=CC=C21 SC-02697 [0,0,0,1,0,1|0,0,0]=2 230 B14R2.31359 O=C(O)C1CCNC2=C1C=CC=C2 SC-35176 [0,0,0,1,0,1|0,0,0]=2 231 B14R2.31359 O=C(O)C1CNCC2=C1C=CC=C2 SC-A3652 [0,0,0,1,0,1|0,0,0]=2 232 B14R2.31359 O=C(O)C1NCCC2=C1C=CC=C2 SC-21808 [0,0,0,1,0,1|0,0,0]=2 233 B14R2.31359 O=C(O)C1NCCC2=CC=CC=C21 SC-21344 [0,0,0,1,0,1|0,0,0]=2 234 B14R2.31359 O=C(O)[C@H]1CCCC2=C1C=CC=C2 SC-14979 [0,0,0,1,0,1|0,0,0]=2 235 B14R2.31359 O=C(O)[C@H]1NCCC2=C1C=CC=C2 SC-70900 [0,0,0,1,0,1|0,0,0]=2 236 B14R2.68 O=C1CCC(C2=CC=CC=C2)CC1 SC-51008 [0,1,0,1,0,0|1,0,0]=3 237 B14R2.25733 O=C1OC(C(=O)O)C2=CC=CC=C12 SC-61440 [0,1,0,1,0,0|1,0,1]=4 238 B14R2.300 CC(=O)N1CCC2=CC(Br)=CC=C21 SC-23850 [0,1,0,1,0,0|2,0,0]=4 239 B14R2.4476 O=C(O)C1CC1C2=CC=CC(Cl)=C2 SC-A2599 [0,1,0,1,0,0|0,0,0]=2 240 B14R2.768 O=C(O)CC1=NC2=CC=CC=C2O1 SC-28084 [0,1,0,1,0,0|1,0,1]=4 241 B14R2.781 O=C(O)C1CC2=C(C=CC=C2)CN1 SC-78444 [0,1,0,1,0,0|1,0,0]=3 242 B14R2.781 O=C(O)C1CC2=CC=CC=C2CN1 SC-44475 [0,1,0,1,0,0|1,0,0]=3 243 B14R2.781 O=C(O)C1CCC2=C(C=CC=C2)C1 SC-65318 [0,1,0,1,0,0|0,0,0]=2 244 B14R2.781 O=C(O)C1CCC2=C(C=CC=C2)N1 SC-A3399 [0,1,0,1,0,0|0,0,0]=2 245 B14R2.781 O=C(O)C1CNC2=C(C=CC=C2)C1 SC-52232 [0,1,0,1,0,0|1,0,0]=3 246 B14R2.781 O=C(O)C1CNC2=CC=CC=C2O1 SC-92503 [0,1,0,1,0,0|1,0,0]=3 247 B14R2.781 O=C(O)C1COC2=CC=CC=C2C1 SC-65754 [0,1,0,1,0,0|1,0,0]=3 248 B14R2.781 O=C(O)C1COC2=CC=CC=C2N1 SC-87885 [0,1,0,1,0,0|1,0,0]=3 249 B14R2.781 O=C(O)C1COC2=CC=CC=C2O1 SC-23379 [0,1,0,1,0,0|1,0,0]=3 250 B14R2.781 O=C(O)[C@@H]1COC2=CC=CC=C2O1 SC-93049 [0,1,0,1,0,0|1,0,0]=3 251 B14R2.781 O=C(O)[C@H]1CCC2=C(C=CC=C2)N1 SC-A2473 [0,1,0,1,0,0|0,0,0]=2 252 B14R2.781 O=C(O)[C@H]1COC2=CC=CC=C2O1 SC-69587 [0,1,0,1,0,0|1,0,0]=3 253 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]=3 254 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]=3 255 B14R2.741 N[C@@H]1CCC2=CC=CC=C2NC1=O SC-20528 [0,1,0,1,0,0|1,0,0]=3 256 B14R2.20 NC1=CC=C(C2CNC(=O)C2)C=C1 SC-22371 [0,1,0,1,0,0|2,0,0]=4 257 B14R2.20 O=C1CC(C2=CC=C(Cl)C=C2)CN1 SC-22370 [0,1,0,1,0,0|2,0,0]=4 258 B14R2.4402 O=C(O)C1CC1C2=CC=C(Br)C=C2 SC-A3021 [0,1,0,1,0,0|0,0,0]=2 259 B14R2.4402 O=C(O)C1CC1C2=CC=C(Cl)C=C2 SC-A2417 [0,1,0,1,0,0|0,0,0]=2 260 B10R1.18 CC(=O)CC1=NC=CC=C1 SC-85146 [0,0,0,0,2,0|2,0,0]=4 261 B10R1.18 N=C(N)CC1=CC=CC=C1 SC-12266 [0,0,0,0,2,0|2,0,0]=4 262 B10R1.18 N=C(N)CC1=CC=CC=C1 SC-17307 [0,0,0,0,2,0|2,0,0]=4 263 B10R1.18 NC(=O)C[N+]1=CC=CC=C1 SC-78519 [0,0,0,0,2,0|2,0,0]=4 264 B10R1.18 O=C(Cl)OC1=CC=CC=C1 SC-18821 [0,0,0,0,2,0|2,0,0]=4 265 B10R1.18 O=C(O)CC1=CC=CN=C1 SC-12152 [0,0,0,0,2,0|1,0,0]=3 266 B10R1.18 O=C(O)CC1=CC=CN=C1 SC-16916 [0,0,0,0,2,0|1,0,0]=3 267 B10R1.18 O=C(O)CC1=CC=NC=C1 SC-80508 [0,0,0,0,2,0|1,0,0]=3 268 B10R1.18 O=C(O)CC1=CN=CN=C1 SC-47534 [0,0,0,0,2,0|2,0,0]=4 269 B10R1.18 O=C(O)CC1=NC=CC=C1 SC-20933 [0,0,0,0,2,0|1,0,0]=3 270 B10R1.18 O=C(O)CC1=NC=CC=C1 SC-26574 [0,0,0,0,2,0|1,0,0]=3 271 B10R1.18 O=C(O)CC1=NC=CC=N1 SC-21888 [0,0,0,0,2,0|2,0,0]=4 272 B10R1.18 O=C(O)CC1=NC=CN=C1 SC-25279 [0,0,0,0,2,0|2,0,0]=4 273 B10R1.18 OC(=S)CC1=CC=CC=C1 SC-46270 [0,0,0,0,2,0|0,1,0]=3 274 B10R1.66 O=C(O)CCC1=CC=CO1 SC-51380 [0,0,0,0,2,0|1,0,0]=3 275 B10R1.66 O=C(O)CCC1=CSC=C1 SC-48358 [0,0,0,0,2,0|1,0,0]=3 276 B10R1.66 O=C(O)CCN1C=CN=C1 SC-04130 [0,0,0,0,2,0|2,0,0]=4 277 B14R1.422 O=C(O)CCCOCC1=CC=CC=C1 SC-70181 [0,0,0,0,0,2|0,0,0]=2