0 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 SBB068279 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.27 CC(CO)NCC1=CC=CC=C1 SBB010465 [0,0,0,0,0,0|1,0,2]=3 2 B12R1.27 NNC(=O)CCC1=CC=CC=C1 SBB000151 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.27 OC(CCl)COC1=CC=CC=C1 SBB061224 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.27 OC(COC1=CC=CC=C1)CN SBB010049 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.27 OC[C@H](O)COC1=CC=CC=C1 SBB088177 [0,0,0,0,0,0|2,0,2]=4 6 B11R1.28 C#CCNCC1=CC=CC=C1 SBB300092 [1,0,0,0,0,0|2,0,1]=4 7 B11R1.28 CCCCCC1=CC=CC=C1 SBB057141 [1,0,0,0,0,0|1,0,1]=3 8 B11R1.28 CCCCNC1=CC=CC=C1 SBB058812 [1,0,0,0,0,0|2,0,1]=4 9 B11R1.28 CCCCOC1=CC=CC=C1 SBB060061 [1,0,0,0,0,0|2,0,1]=4 10 B11R1.28 CCCNCC1=CC=CC=C1 SBB080024 [1,0,0,0,0,0|2,0,1]=4 11 B11R1.28 CCCOCC1=CC=CC=C1 SBB061197 [1,0,0,0,0,0|2,0,1]=4 12 B11R1.28 CNCCOC1=CC=CC=C1 SBB027283 [1,0,0,0,0,0|3,0,0]=4 13 B11R1.28 COCCSC1=CC=CC=C1 SBB116878 [1,0,0,0,0,0|3,0,0]=4 14 B11R1.28 ClCCCOC1=CC=CC=C1 SBB300461 [1,0,0,0,0,0|2,0,1]=4 15 B11R1.28 ClCCNCC1=CC=CC=C1 SBB052393 [1,0,0,0,0,0|2,0,1]=4 16 B11R1.28 N#CCCCC1=NC=CC=C1 SBB018559 [1,0,0,0,0,0|2,0,1]=4 17 B11R1.28 N#CCCNC1=CC=CC=C1 SBB004106 [1,0,0,0,0,0|2,0,1]=4 18 B11R1.28 NCCCCC1=NC=CC=C1 SBB018864 [1,0,0,0,0,0|2,0,1]=4 19 B11R1.28 NCCCOC1=CC=CC=C1 SBB043657 [1,0,0,0,0,0|2,0,1]=4 20 B11R1.28 NCCCSC1=CC=CC=C1 SBB071863 [1,0,0,0,0,0|2,0,1]=4 21 B11R1.28 NCCNCC1=CC=CC=C1 SBB028295 [1,0,0,0,0,0|2,0,1]=4 22 B11R1.28 NCCOCC1=CC=CC=C1 SBB050278 [1,0,0,0,0,0|2,0,1]=4 23 B11R1.28 NCCOCC1=CC=CC=C1 SBB055150 [1,0,0,0,0,0|2,0,1]=4 24 B11R1.28 NCCSCC1=CC=CC=C1 SBB003512 [1,0,0,0,0,0|2,0,1]=4 25 B11R1.28 O=C=NCCC1=CC=CC=C1 SBB048864 [1,0,0,0,0,0|1,0,1]=3 26 B11R1.28 OCCNCC1=CC=CC=C1 SBB004062 [1,0,0,0,0,0|1,0,2]=4 27 B11R1.28 OCCOCC1=CC=CC=C1 SBB063066 [1,0,0,0,0,0|1,0,2]=4 28 B11R1.28 OCCSCC1=CC=CC=C1 SBB058901 [1,0,0,0,0,0|1,0,2]=4 29 B11R1.28 S=C=NCCC1=CC=CC=C1 SBB002732 [1,0,0,0,0,0|1,1,1]=4 30 B11R1.91 CC(=O)C#CC1=CC=CC=C1 SBB015101 [1,0,0,0,0,0|0,0,3]=4 31 B11R1.91 CC(=O)CCC1=CC=CC=C1 SBB058827 [1,0,0,0,0,0|0,0,1]=2 32 B11R1.91 CC(=O)NNC1=CC=CC=C1 SBB058004 [1,0,0,0,0,0|2,0,1]=4 33 B11R1.91 CC(=O)OCC1=CC=CC=C1 SBB058375 [1,0,0,0,0,0|1,0,1]=3 34 B11R1.91 CC(=O)O[I+]C1=CC=CC=C1 SBB057853 [1,0,0,0,0,0|2,0,1]=4 35 B11R1.91 CC(C)=CCC1=CC=CC=C1 SBB007979 [1,0,0,0,0,0|0,0,3]=4 36 B11R1.91 CC(C)NCC1=CC=CC=C1 SBB048017 [1,0,0,0,0,0|1,0,1]=3 37 B11R1.91 CC(N)CCC1=CC=CC=C1 SBB059846 [1,0,0,0,0,0|1,0,0]=2 38 B11R1.91 CC(N)COC1=CC=CC=C1 SBB084093 [1,0,0,0,0,0|2,0,0]=3 39 B11R1.91 CC(O)C#CC1=CC=CC=C1 SBB015100 [1,0,0,0,0,0|0,0,3]=4 40 B11R1.91 CN(C)CCC1=NC=CC=C1 SBB086734 [1,0,0,0,0,0|2,0,1]=4 41 B11R1.91 NC(=O)CCC1=CC=CC=C1 SBB058119 [1,0,0,0,0,0|1,0,1]=3 42 B11R1.91 NC(=O)COC1=CC=CC=C1 SBB028296 [1,0,0,0,0,0|2,0,1]=4 43 B11R1.91 NC(=O)NCC1=CC=CC=C1 SBB058548 [1,0,0,0,0,0|2,0,1]=4 44 B11R1.91 NC(=O)OCC1=CC=CC=C1 SBB058407 [1,0,0,0,0,0|2,0,1]=4 45 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 SBB058859 [1,0,0,0,0,0|1,0,1]=3 46 B11R1.91 O=C(Cl)COC1=CC=CC=C1 SBB040630 [1,0,0,0,0,0|2,0,1]=4 47 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 SBB063193 [1,0,0,0,0,0|2,0,1]=4 48 B11R1.91 O=C(O)CCC1=CC=CC=C1 SBB056662 [1,0,0,0,0,0|1,0,1]=3 49 B11R1.91 O=C(O)CCC1=CC=CC=N1 SBB018634 [1,0,0,0,0,0|2,0,1]=4 50 B11R1.91 O=C(O)CCC1=CC=NC=C1 SBB012865 [1,0,0,0,0,0|2,0,1]=4 51 B11R1.91 O=C(O)CCC1=CN=CC=C1 SBB028468 [1,0,0,0,0,0|2,0,1]=4 52 B11R1.91 O=C(O)CNC1=CC=CC=C1 SBB028637 [1,0,0,0,0,0|2,0,1]=4 53 B11R1.91 O=C(O)COC1=CC=CC=C1 SBB040522 [1,0,0,0,0,0|2,0,1]=4 54 B11R1.91 O=C(O)CSC1=CC=CC=C1 SBB001712 [1,0,0,0,0,0|2,0,1]=4 55 B11R1.91 OB(O)CCC1=CC=CC=C1 SBB071100 [1,0,0,0,0,0|2,0,1]=4 56 B13R1.14 CCC(C)NCC1=CC=C(C)C=C1 SBB080104 [0,1,0,0,0,0|2,0,1]=4 57 B13R1.254 C#CC(C)(O)CCC1=CC=CC=C1 SBB002549 [0,1,0,0,0,0|1,0,1]=3 58 B13R1.351 NC(CCC1=CC=CC=N1)C(=O)O SBB014776 [0,1,0,0,0,0|2,0,0]=3 59 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O SBB063155 [0,1,0,0,0,0|1,0,0]=2 60 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O SBB066411 [0,1,0,0,0,0|2,0,0]=3 61 B13R1.351 O=C(O)[C@@H](O)CCC1=CC=CC=C1 SBB065026 [0,1,0,0,0,0|1,0,0]=2 62 B13R1.417 N(CC1=CC=CC=C1)[C@H](CC)CO SBB040057 [0,1,0,0,0,0|1,0,2]=4 63 B13R1.528 CCC(C)NCC1=C(C)C=CC=C1 SBB080106 [0,1,0,0,0,0|2,0,1]=4 64 B13R1.528 CCC(C)NCC1=C(Cl)C=CC=C1 SBB080109 [0,1,0,0,0,0|2,0,1]=4 65 B13R2.10 CC1COC(C2=CC=CC=C2)O1 SBB060969 [0,0,0,1,0,0|1,0,2]=4 66 B13R2.32 CC1CCC2=CC=CC=C2C1=O SBB067641 [0,0,0,1,0,0|0,0,0]=1 67 B13R2.57 BrCC1CCC2=CC=CC=C2O1 SBB054977 [0,0,0,1,0,0|2,0,1]=4 68 B13R2.57 O=CC1=CC2=CC=CC=C2OC1 SBB010136 [0,0,0,1,0,0|1,0,2]=4 69 B13R2.57 OC[C@@H]1CC2=CC=CC=C2CN1 SBB003923 [0,0,0,1,0,0|1,0,2]=4 70 B11R1.25 CNC(C)CCC1=CC=CO1 SBB007121 [0,0,0,0,1,0|3,0,0]=4 71 B11R1.40 CC(CN)OC1=CC=CC=C1 SBB028307 [0,0,0,0,1,0|2,0,1]=4 72 B11R1.40 CNC(C)CC1=CC=CC=N1 SBB025630 [0,0,0,0,1,0|3,0,0]=4 73 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 SBB040229 [0,0,0,0,1,0|0,0,2]=3 74 B11R1.40 O=C\C(Br)=C\C1=CC=CC=C1 SBB040238 [0,0,0,0,1,0|1,0,2]=4 75 B13R1.718 NCC(O)COCC1=CC=CC=C1 SBB010672 [0,0,0,0,0,1|2,0,1]=4 76 B13R1.718 OC(CCl)COCC1=CC=CC=C1 SBB056727 [0,0,0,0,0,1|2,0,1]=4 77 B13R1.718 OCC(O)COCC1=CC=CC=C1 SBB058667 [0,0,0,0,0,1|1,0,2]=4 78 B10R1.17 BrCCCC1=CN=CC=C1 SBB014930 [2,0,0,0,0,0|2,0,0]=4 79 B10R1.17 BrCCOC1=CC=CC=C1 SBB042586 [2,0,0,0,0,0|2,0,0]=4 80 B10R1.17 BrCCSC1=CC=CC=C1 SBB059699 [2,0,0,0,0,0|2,0,0]=4 81 B10R1.17 C(=O)CCC1=CC=CC=C1 SBB006730 [2,0,0,0,0,0|0,0,0]=2 82 B10R1.17 C(=O)NNC1=CC=CC=C1 SBB008261 [2,0,0,0,0,0|2,0,0]=4 83 B10R1.17 C=CCCC1=CC=CC=C1 SBB008476 [2,0,0,0,0,0|0,0,1]=3 84 B10R1.17 CCCNC1=CC=CC=C1 SBB059800 [2,0,0,0,0,0|1,0,0]=3 85 B10R1.17 CCCOC1=CC=CC=C1 SBB061098 [2,0,0,0,0,0|1,0,0]=3 86 B10R1.17 CCNCC1=CC=CC=C1 SBB058765 [2,0,0,0,0,0|1,0,0]=3 87 B10R1.17 CCNCC1=CC=NC=C1 SBB058813 [2,0,0,0,0,0|2,0,0]=4 88 B10R1.17 CCOCC1=CC=CC=C1 SBB061196 [2,0,0,0,0,0|1,0,0]=3 89 B10R1.17 CCSCC1=CC=CC=C1 SBB061362 [2,0,0,0,0,0|1,0,0]=3 90 B10R1.17 CNCCC1=NC=CC=C1 SBB017551 [2,0,0,0,0,0|2,0,0]=4 91 B10R1.17 CNCCC1=NC=CC=C1 SBB040053 [2,0,0,0,0,0|2,0,0]=4 92 B10R1.17 ClCCCC1=CC=CC=C1 SBB061361 [2,0,0,0,0,0|1,0,0]=3 93 B10R1.17 ClCOCC1=CC=CC=C1 SBB064207 [2,0,0,0,0,0|2,0,0]=4 94 B10R1.17 ClCSCC1=CC=CC=C1 SBB055458 [2,0,0,0,0,0|2,0,0]=4 95 B10R1.17 N(CC=C)C1=CC=CC=C1 SBB004211 [2,0,0,0,0,0|1,0,1]=4 96 B10R1.17 NCCCC1=CC=CC=C1 SBB028248 [2,0,0,0,0,0|1,0,0]=3 97 B10R1.17 NCCCC1=CC=CC=N1 SBB012768 [2,0,0,0,0,0|2,0,0]=4 98 B10R1.17 NCCNC1=CC=CC=C1 SBB004200 [2,0,0,0,0,0|2,0,0]=4 99 B10R1.17 NCCOC1=CC=CC=C1 SBB085982 [2,0,0,0,0,0|2,0,0]=4 100 B10R1.17 NCCSC1=CC=CC=C1 SBB047720 [2,0,0,0,0,0|2,0,0]=4 101 B10R1.17 O=C=NCC1=CC=CC=C1 SBB048859 [2,0,0,0,0,0|1,0,1]=4 102 B10R1.17 O=COCC1=CC=CC=C1 SBB061238 [2,0,0,0,0,0|1,0,0]=3 103 B10R1.17 O=C\C=C\C1=CC=CC=C1 SBB028652 [2,0,0,0,0,0|0,0,2]=4 104 B10R1.17 OCCCC1=CC=CC=C1 SBB061127 [2,0,0,0,0,0|0,0,1]=3 105 B10R1.17 OCCCC1=CC=NC=C1 SBB072686 [2,0,0,0,0,0|1,0,1]=4 106 B10R1.17 OCCOC1=CC=CC=C1 SBB060485 [2,0,0,0,0,0|1,0,1]=4 107 B12R1.1 CCCCCC1=CC=C(N)C=C1 SBB008338 [1,1,0,0,0,0|1,0,1]=4 108 B12R1.1 CCCCCC1=CC=C(O)C=C1 SBB059154 [1,1,0,0,0,0|1,0,1]=4 109 B12R1.8 BrCCCOCC1=CC=CC=C1 SBB055279 [1,1,0,0,0,0|1,0,1]=4 110 B12R1.8 CCCCCOC1=CC=CC=C1 SBB060062 [1,1,0,0,0,0|1,0,1]=4 111 B12R1.8 CCCCOCC1=CC=CC=C1 SBB061154 [1,1,0,0,0,0|1,0,1]=4 112 B12R1.8 N#CCCNCC1=CC=CC=C1 SBB056785 [1,1,0,0,0,0|1,0,1]=4 113 B12R1.8 N#CCCNCC1=CC=CC=C1 SBB080384 [1,1,0,0,0,0|1,0,1]=4 114 B12R1.8 N#CCCOCC1=CC=CC=C1 SBB072745 [1,1,0,0,0,0|1,0,1]=4 115 B12R1.8 N(CCCC)CC1=CC=CC=C1 SBB006552 [1,1,0,0,0,0|1,0,1]=4 116 B12R1.8 NCCCNCC1=CC=CC=C1 SBB015090 [1,1,0,0,0,0|1,0,1]=4 117 B12R1.8 NCCCOCC1=CC=CC=C1 SBB072321 [1,1,0,0,0,0|1,0,1]=4 118 B12R1.8 OCCCNCC1=CC=CC=C1 SBB055297 [1,1,0,0,0,0|0,0,2]=4 119 B12R1.30 CCCCC(O)C1=CC=CC=C1 SBB063387 [1,1,0,0,0,0|1,0,1]=4 120 B12R1.30 CNCCC(O)C1=CC=CC=C1 SBB063260 [1,1,0,0,0,0|2,0,0]=4 121 B12R1.252 CC(=O)CCCC1=CC=CC=N1 SBB018700 [1,1,0,0,0,0|1,0,0]=3 122 B12R1.252 CC(=O)CSCC1=CC=CC=C1 SBB058580 [1,1,0,0,0,0|1,0,0]=3 123 B12R1.252 CC(=O)NCCC1=CC=CC=C1 SBB058213 [1,1,0,0,0,0|1,0,0]=3 124 B12R1.252 CC(=O)OCCC1=CC=CC=C1 SBB061194 [1,1,0,0,0,0|1,0,0]=3 125 B12R1.252 CC(N)CCCC1=CC=CC=C1 SBB010444 [1,1,0,0,0,0|1,0,1]=4 126 B12R1.252 N=C(N)NCCC1=CC=CC=C1 SBB102430 [1,1,0,0,0,0|2,0,0]=4 127 B12R1.252 NC(=O)CCCC1=CC=CC=C1 SBB051450 [1,1,0,0,0,0|0,0,0]=2 128 B12R1.252 NC(=S)NCCC1=CC=CC=C1 SBB017394 [1,1,0,0,0,0|1,1,0]=4 129 B12R1.252 O=C(Cl)CCCC1=CC=CC=C1 SBB040702 [1,1,0,0,0,0|0,0,0]=2 130 B12R1.252 O=C(Cl)COCC1=CC=CC=C1 SBB063195 [1,1,0,0,0,0|1,0,0]=3 131 B12R1.252 O=C(O)CCCC1=CC=CC=C1 SBB008452 [1,1,0,0,0,0|0,0,0]=2 132 B12R1.252 O=C(O)CCCC1=CC=CC=N1 SBB014662 [1,1,0,0,0,0|1,0,0]=3 133 B12R1.252 O=C(O)CCCC1=CC=NC=C1 SBB014669 [1,1,0,0,0,0|1,0,0]=3 134 B12R1.252 O=C(O)CCSC1=CC=CC=C1 SBB049906 [1,1,0,0,0,0|1,0,0]=3 135 B12R1.252 O=C(O)CCSC1=CC=CC=N1 SBB103611 [1,1,0,0,0,0|2,0,0]=4 136 B12R1.252 O=C(O)CNCC1=CC=CC=C1 SBB003529 [1,1,0,0,0,0|1,0,0]=3 137 B12R1.252 O=C(O)CNCC1=CC=CC=C1 SBB063075 [1,1,0,0,0,0|1,0,0]=3 138 B12R1.252 O=C(O)COCC1=CC=CC=C1 SBB048109 [1,1,0,0,0,0|1,0,0]=3 139 B12R1.252 O=C(O)CSCC1=CC=CC=C1 SBB042552 [1,1,0,0,0,0|1,0,0]=3 140 B12R1.252 OC(=O)CCOC1=CC=CC=C1 SBB003895 [1,1,0,0,0,0|1,0,0]=3 141 B12R1.267 C=CCNCC1=C(F)C=CC=C1 SBB010457 [1,1,0,0,0,0|2,0,0]=4 142 B12R1.21 C=C(C)COC1=CC=C(N)C=C1 SBB080146 [1,1,0,0,0,0|1,0,1]=4 143 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 SBB056768 [1,1,0,0,0,0|0,0,1]=3 144 B12R1.21 CC(=O)COC1=CC=C(Cl)C=C1 SBB072870 [1,1,0,0,0,0|1,0,1]=4 145 B12R1.21 CC(=O)CSC1=CC=C(C)C=C1 SBB089710 [1,1,0,0,0,0|1,0,1]=4 146 B12R1.21 CC(=O)CSC1=CC=C(Cl)C=C1 SBB057983 [1,1,0,0,0,0|1,0,1]=4 147 B12R1.21 CC(=O)CSC1=CC=C(F)C=C1 SBB090182 [1,1,0,0,0,0|1,0,1]=4 148 B12R1.21 CC(=O)NCC1=CC=C(F)C=C1 SBB055227 [1,1,0,0,0,0|1,0,1]=4 149 B12R1.21 CC(=O)OCC1=CC=C(C)C=C1 SBB116862 [1,1,0,0,0,0|1,0,1]=4 150 B12R1.21 CC(C)COC1=CC=C(N)C=C1 SBB079898 [1,1,0,0,0,0|1,0,1]=4 151 B12R1.21 CC(C)NCC1=CC=C(F)C=C1 SBB109028 [1,1,0,0,0,0|1,0,1]=4 152 B12R1.21 CC(N)CCC1=CC=C(Cl)C=C1 SBB010707 [1,1,0,0,0,0|1,0,0]=3 153 B12R1.21 CC(N)CCC1=CC=C(F)C=C1 SBB010486 [1,1,0,0,0,0|1,0,0]=3 154 B12R1.21 CC(N)COC1=CC=C(Cl)C=C1 SBB010732 [1,1,0,0,0,0|2,0,0]=4 155 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 SBB016295 [1,1,0,0,0,0|1,0,1]=4 156 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 SBB010089 [1,1,0,0,0,0|1,0,1]=4 157 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 SBB017617 [1,1,0,0,0,0|1,0,1]=4 158 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 SBB010179 [1,1,0,0,0,0|1,0,1]=4 159 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 SBB017621 [1,1,0,0,0,0|1,0,1]=4 160 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 SBB052832 [1,1,0,0,0,0|1,0,1]=4 161 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 SBB064098 [1,1,0,0,0,0|1,0,1]=4 162 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 SBB014560 [1,1,0,0,0,0|0,0,1]=3 163 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 SBB027287 [1,1,0,0,0,0|1,0,1]=4 164 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O SBB058700 [1,1,0,0,0,0|1,0,1]=4 165 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 SBB012365 [1,1,0,0,0,0|1,0,1]=4 166 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 SBB040798 [1,1,0,0,0,0|0,0,2]=4 167 B12R1.107 CC(=O)NC(C)C1=CC=CC=C1 SBB058063 [1,1,0,0,0,0|1,0,1]=4 168 B12R1.107 N(C(C)C)[C@H](C)C1=CC=CC=C1 SBB059587 [1,1,0,0,0,0|1,0,1]=4 169 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 SBB001851 [1,1,0,0,0,0|1,0,1]=4 170 B12R1.107 O=C(O)CC(Br)C1=CC=CC=C1 SBB008428 [1,1,0,0,0,0|1,0,1]=4 171 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 SBB063579 [1,1,0,0,0,0|1,0,1]=4 172 B12R1.107 O=[N+]([O-])CC(O)C1=CC=CC=C1 SBB001885 [1,1,0,0,0,0|2,0,0]=4 173 B12R1.125 C=C(C)COC1=CC=CC=C1N SBB080151 [1,1,0,0,0,0|1,0,1]=4 174 B12R1.125 CC(=O)NCC1=C(Br)C=CC=C1 SBB079113 [1,1,0,0,0,0|1,0,1]=4 175 B12R1.125 CC(C)COC1=C(N)C=CC=C1 SBB080113 [1,1,0,0,0,0|1,0,1]=4 176 B12R1.125 CC(C)NCC1=C(F)C=CC=C1 SBB109026 [1,1,0,0,0,0|1,0,1]=4 177 B12R1.125 CC1=CC=CC=C1CCC(=O)O SBB067749 [1,1,0,0,0,0|1,0,1]=4 178 B12R1.125 O=C(O)CCC1=CC=CC=C1Br SBB064066 [1,1,0,0,0,0|1,0,1]=4 179 B12R1.125 O=C(O)CCC1=CC=CC=C1Cl SBB069087 [1,1,0,0,0,0|1,0,1]=4 180 B12R1.125 O=C(O)CCC1=CC=CC=C1F SBB010203 [1,1,0,0,0,0|1,0,1]=4 181 B12R1.125 O=C(O)CCC1=CC=CC=C1O SBB063739 [1,1,0,0,0,0|1,0,1]=4 182 B12R1.226 C=C(C)COC1=CC(N)=CC=C1 SBB080148 [1,1,0,0,0,0|1,0,1]=4 183 B12R1.226 CC(=O)CCC1=CC(Br)=CC=C1 SBB055142 [1,1,0,0,0,0|0,0,1]=3 184 B12R1.226 CC(C)COC1=CC(N)=CC=C1 SBB027489 [1,1,0,0,0,0|1,0,1]=4 185 B12R1.226 CC(C)NCC1=CC(F)=CC=C1 SBB109027 [1,1,0,0,0,0|1,0,1]=4 186 B12R1.226 CC1=CC=CC(CCC(=O)O)=C1 SBB067747 [1,1,0,0,0,0|1,0,1]=4 187 B12R1.226 NC1=CC=CC(CCC(=O)O)=C1 SBB028355 [1,1,0,0,0,0|1,0,1]=4 188 B12R1.226 O=C(O)CCC1=CC(F)=CC=C1 SBB010231 [1,1,0,0,0,0|1,0,1]=4 189 B12R1.226 O=C(O)CCC1=CC(O)=CC=C1 SBB057915 [1,1,0,0,0,0|1,0,1]=4 190 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 SBB063235 [1,1,0,0,0,0|1,0,1]=4 191 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 SBB005906 [1,1,0,0,0,0|1,0,1]=4 192 B12R1.891 CC(C)(C)NCC1=CC=CC=C1 SBB072754 [1,1,0,0,0,0|1,0,1]=4 193 B12R1.891 O=P(O)(O)CCC1=CC=CC=C1 SBB057482 [1,1,0,0,0,0|2,0,0]=4 194 B12R1.891 O=S(=O)(Cl)CCC1=CC=CC=C1 SBB018064 [1,1,0,0,0,0|2,0,0]=4 195 B12R1.264 CC(SCC1=CC=CO1)C(=O)O SBB010744 [0,1,0,0,1,0|2,0,0]=4 196 B12R1.194 C#CC(C)(O)CC1=CC=CC=C1 SBB002525 [0,1,0,0,1,0|1,0,1]=4 197 B12R1.194 CC(C)(C=O)SC1=CC=CC=C1 SBB052358 [0,1,0,0,1,0|1,0,0]=3 198 B12R1.194 CNC(C)(C)CC1=CC=CC=C1 SBB015072 [0,1,0,0,1,0|2,0,0]=4 199 B14R1.6449 CC(SCCC1=NC=CC=C1)C(=O)O SBB300317 [0,1,0,0,0,1|1,0,0]=3 200 B14R1.6449 NC(CCCC1=CC=CC=C1)C(=O)O SBB064584 [0,1,0,0,0,1|1,0,0]=3 201 B14R1.6449 NC(COCC1=CC=CC=C1)C(=O)O SBB071425 [0,1,0,0,0,1|1,0,0]=3 202 B14R1.6449 N[C@@H](CSCC1=CC=CC=C1)C(=O)O SBB007644 [0,1,0,0,0,1|1,0,0]=3 203 B14R1.415 CC(NC(=O)C1=CC=CC=C1)C(=O)O SBB004603 [0,2,0,0,0,0|1,0,1]=4 204 B14R1.679 CC(SCC1=CC=C(Cl)C=C1)C(=O)O SBB072997 [0,2,0,0,0,0|1,0,0]=3 205 B14R1.161 CC1=C(OCC(O)C(=O)O)C=CC=C1 SBB014000 [0,2,0,0,0,0|2,0,0]=4 206 B12R2.2 C1=CC=C(C2CCCC2)C=C1 SBB060080 [1,0,0,1,0,0|1,0,1]=4 207 B12R2.2 C1=CC=C(C2CCCN2)C=C1 SBB056158 [1,0,0,1,0,0|1,0,1]=4 208 B12R2.2 C1=CC=C(C2CCNC2)C=C1 SBB010168 [1,0,0,1,0,0|2,0,0]=4 209 B12R2.27 OCC1CC1C2=CC=CC=C2 SBB084422 [1,0,0,1,0,0|0,0,2]=4 210 B12R2.1081 NC1CCCC2=C1C=CC=C2 SBB000241 [1,0,0,1,0,0|1,0,1]=4 211 B12R2.1081 NC1CCCC2=C1C=CC=C2 SBB028283 [1,0,0,1,0,0|1,0,1]=4 212 B12R2.1081 O=C1CCCC2=C1C=CC=C2 SBB066987 [1,0,0,1,0,0|0,0,0]=2 213 B12R2.1081 O=C1CCOC2=CC=CC=C12 SBB056286 [1,0,0,1,0,0|1,0,0]=3 214 B12R2.1081 OC1CCCC2=CC=CC=C21 SBB056331 [1,0,0,1,0,0|0,0,2]=4 215 B12R2.24 CC1CCC2=CC=CC=C2N1 SBB039108 [1,0,0,1,0,0|1,0,0]=3 216 B12R2.24 CC1CNC2=C(C=CC=C2)S1 SBB048277 [1,0,0,1,0,0|1,1,0]=4 217 B12R2.24 CC1CNC2=CC=CC=C2O1 SBB080829 [1,0,0,1,0,0|1,0,1]=4 218 B12R2.24 NC1CCC2=C(C=CC=C2)C1 SBB072624 [1,0,0,1,0,0|1,0,0]=3 219 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 SBB068599 [1,0,0,1,0,0|1,0,1]=4 220 B12R2.24 O=C1CCC2=C(C=CC=C2)O1 SBB058834 [1,0,0,1,0,0|1,0,1]=4 221 B12R2.24 O=C1CCC2=CC=CC=C2N1 SBB056014 [1,0,0,1,0,0|1,0,1]=4 222 B12R2.24 OC1CCC2=C(C=CC=C2)C1 SBB008511 [1,0,0,1,0,0|0,0,1]=3 223 B12R2.3190 O=C(O)C1CC2=CC=CC=C21 SBB053554 [1,0,0,1,0,0|1,0,1]=4 224 B12R2.18 CC1CC2=CC=CC=C2C1=O SBB067570 [0,0,0,1,1,0|0,0,0]=2 225 B12R2.18 O=C1C2=CC=CC=C2CC1Br SBB054709 [0,0,0,1,1,0|1,0,0]=3 226 B12R2.18 O=C1CC2=C(C=CC=C2)C1=O SBB068426 [0,0,0,1,1,0|1,0,1]=4 227 B14R2.3019 C1=CC=C(CNCC2CCC2)C=C1 SBB080025 [0,0,0,1,0,1|1,0,1]=4 228 B14R2.260 CC1CN(C2=CC=CC=C2)NC1=O SBB001600 [0,1,0,1,0,0|1,0,0]=3 229 B14R2.7724 CC1CC(=O)C2=C(C=CC=C2)C1=O SBB058530 [0,1,0,1,0,0|0,0,1]=3 230 B14R2.741 CC1CNC2=C(C=CC=C2)NC1=O SBB027802 [0,1,0,1,0,0|1,0,0]=3 231 B14R2.741 O=C1NC2=CC=CC=C2CCC1Br SBB099210 [0,1,0,1,0,0|1,0,0]=3 232 B14R2.781 NC(=O)C1CC2=CC=CC=C2CN1 SBB047807 [0,1,0,1,0,0|1,0,0]=3 233 B14R2.781 O=C(O)C1CC2=C(C=CC=C2)CN1 SBB003411 [0,1,0,1,0,0|1,0,0]=3 234 B14R2.781 O=C(O)C1CC2=C(C=CC=C2)CN1 SBB013155 [0,1,0,1,0,0|1,0,0]=3 235 B14R2.781 O=C(O)C1CCC2=CC=CC=C2O1 SBB053531 [0,1,0,1,0,0|1,0,0]=3 236 B14R2.781 O=C(O)C1CNC2=CC=CC=C2O1 SBB089531 [0,1,0,1,0,0|2,0,0]=4 237 B14R2.781 O=C(O)C1COC2=CC=CC=C2C1 SBB053502 [0,1,0,1,0,0|1,0,0]=3 238 B14R2.781 O=C(O)C1COC2=CC=CC=C2O1 SBB000213 [0,1,0,1,0,0|2,0,0]=4 239 B14R2.781 O=C(O)[C@@H]1CC2=CC=CC=C2CN1 SBB053293 [0,1,0,1,0,0|1,0,0]=3 240 B14R2.92 O=CC1=C(Cl)C2=CC=CC=C2CC1 SBB091507 [0,1,0,1,0,0|0,0,2]=4 241 B10R1.18 CC(=O)CC1=CC=NC=C1 SBB055597 [1,0,0,0,1,0|1,0,1]=4 242 B10R1.18 CC(=O)NC1=CC=CC=C1 SBB040833 [1,0,0,0,1,0|1,0,1]=4 243 B10R1.18 CC(=O)OC1=CC=CC=C1 SBB058747 [1,0,0,0,1,0|1,0,1]=4 244 B10R1.18 CC(C)NC1=CC=CC=C1 SBB007921 [1,0,0,0,1,0|1,0,1]=4 245 B10R1.18 CC(N)CC1=CC=CC=N1 SBB025629 [1,0,0,0,1,0|2,0,0]=4 246 B10R1.18 CN(C)CC1=CC=CC=C1 SBB060233 [1,0,0,0,1,0|1,0,1]=4 247 B10R1.18 NC(=O)CC1=CC=CC=C1 SBB017634 [1,0,0,0,1,0|1,0,1]=4 248 B10R1.18 O=C(Cl)CC1=CC=CC=C1 SBB040622 [1,0,0,0,1,0|1,0,1]=4 249 B10R1.66 CC(N)CCC1=CC=CO1 SBB007120 [1,0,0,0,1,0|2,0,0]=4 250 B10R1.15 C(=O)C(C)C1=CC=CC=C1 SBB007693 [0,0,0,0,2,0|0,0,0]=2 251 B10R1.15 CC(CN)C1=CC=CC=C1 SBB028247 [0,0,0,0,2,0|1,0,1]=4 252 B10R1.15 CC(CO)C1=CC=CC=C1 SBB007853 [0,0,0,0,2,0|0,0,2]=4 253 B10R1.15 CCC(C)C1=CC=CC=C1 SBB060615 [0,0,0,0,2,0|1,0,1]=4 254 B10R1.15 CN(C=O)C1=CC=CC=C1 SBB056830 [0,0,0,0,2,0|1,0,0]=3 255 B10R1.15 C[C@H](CN)C1=CC=CC=C1 SBB052360 [0,0,0,0,2,0|1,0,1]=4 256 B10R1.15 O=CC(=O)C1=CC=CC=C1 SBB068905 [0,0,0,0,2,0|1,0,1]=4