0 B12R1.16 CC1=CC=C(C(=O)CC#N)C=C1 SBB005351 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.16 CC1=CC=C(C(=O)CCCl)C=C1 SBB063951 [0,0,0,0,0,0|3,0,0]=3 2 B12R1.16 CCCC(=O)C1=CC=C(Br)C=C1 SBB065069 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 SBB017369 [0,0,0,0,0,0|2,0,0]=2 4 B12R1.16 CCCC(=O)C1=CC=C(F)C=C1 SBB088007 [0,0,0,0,0,0|2,0,0]=2 5 B12R1.16 CCCC(=O)C1=CC=C(N)C=C1 SBB017672 [0,0,0,0,0,0|1,0,0]=1 6 B12R1.16 CCCC(=O)C1=CC=C(O)C=C1 SBB001584 [0,0,0,0,0,0|2,0,0]=2 7 B12R1.16 CCNC(=O)C1=CC=C(N)C=C1 SBB017849 [0,0,0,0,0,0|1,0,0]=1 8 B12R1.16 CCOC(=N)C1=CC=C(O)C=C1 SBB057804 [0,0,0,0,0,0|2,0,0]=2 9 B12R1.16 CCOC(=O)C1=CC=C(Br)C=C1 SBB065108 [0,0,0,0,0,0|1,0,0]=1 10 B12R1.16 CCOC(=O)C1=CC=C(C)C=C1 SBB064875 [0,0,0,0,0,0|1,0,0]=1 11 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 SBB040855 [0,0,0,0,0,0|1,0,0]=1 12 B12R1.16 CCOC(=O)C1=CC=C(Cl)N=C1 SBB053795 [0,0,0,0,0,0|2,0,0]=2 13 B12R1.16 CCOC(=O)C1=CC=C(F)C=C1 SBB063137 [0,0,0,0,0,0|1,0,0]=1 14 B12R1.16 CCOC(=O)C1=CC=C(I)C=C1 SBB058455 [0,0,0,0,0,0|1,0,0]=1 15 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 SBB028356 [0,0,0,0,0,0|0,0,0]=0 16 B12R1.16 CCOC(=O)C1=CC=C(O)C=C1 SBB038536 [0,0,0,0,0,0|1,0,0]=1 17 B12R1.16 CCOC(=O)C1=NNC(=O)C=C1 SBB053958 [0,0,0,0,0,0|3,0,0]=3 18 B12R1.16 CNCC(=O)C1=CC=C(O)C=C1 SBB013970 [0,0,0,0,0,0|3,0,0]=3 19 B12R1.16 N#CCC(=O)C1=CC=C(Br)C=C1 SBB059061 [0,0,0,0,0,0|3,0,1]=4 20 B12R1.16 N#CCC(=O)C1=CC=C(Cl)C=C1 SBB049524 [0,0,0,0,0,0|3,0,1]=4 21 B12R1.16 N#CCC(=O)C1=CC=C(F)C=C1 SBB022265 [0,0,0,0,0,0|3,0,1]=4 22 B12R1.16 N#CCC(=O)C1=CC=C(I)C=C1 SBB019130 [0,0,0,0,0,0|3,0,1]=4 23 B12R1.16 O=C(CCCl)C1=CC=C(Cl)C=C1 SBB063212 [0,0,0,0,0,0|3,0,0]=3 24 B12R1.16 O=C(CCCl)C1=CC=C(F)C=C1 SBB042481 [0,0,0,0,0,0|3,0,0]=3 25 B11R1.1 CCCCC1=CC=C(Cl)C=C1 SBB116909 [1,0,0,0,0,0|2,0,1]=4 26 B11R1.1 CCCCC1=CC=C(N)C=C1 SBB008298 [1,0,0,0,0,0|1,0,1]=3 27 B11R1.1 CCCCC1=CC=C(O)C=C1 SBB059153 [1,0,0,0,0,0|2,0,1]=4 28 B11R1.1 CCCOC1=CC=C(Br)C=C1 SBB059354 [1,0,0,0,0,0|3,0,0]=4 29 B11R1.1 CCCOC1=CC=C(N)C=C1 SBB008316 [1,0,0,0,0,0|2,0,0]=3 30 B11R1.1 CCCOC1=CC=C(O)C=C1 SBB059151 [1,0,0,0,0,0|3,0,0]=4 31 B11R1.1 CCNCC1=CC=C(Cl)C=C1 SBB080066 [1,0,0,0,0,0|2,0,1]=4 32 B11R1.1 NC1=CC=C(NCCO)C=C1 SBB006780 [1,0,0,0,0,0|3,0,0]=4 33 B11R1.1 NC1=CC=C(OCCO)C=C1 SBB024256 [1,0,0,0,0,0|3,0,0]=4 34 B11R1.1 NCCOC1=CC=C(N)C=C1 SBB050309 [1,0,0,0,0,0|3,0,0]=4 35 B11R1.16 CCCC(=O)C1=CC=CC=C1 SBB058761 [1,0,0,0,0,0|1,0,0]=2 36 B11R1.16 CCC[C@@H](N)C1=CC=CC=C1 SBB070021 [1,0,0,0,0,0|2,0,1]=4 37 B11R1.16 CCNC(=O)C1=CC=CC=C1 SBB058216 [1,0,0,0,0,0|1,0,0]=2 38 B11R1.16 CCOC(=O)C1=CC=CC=C1 SBB058595 [1,0,0,0,0,0|0,0,0]=1 39 B11R1.16 CCOC(=O)C1=CC=CN=C1 SBB065600 [1,0,0,0,0,0|1,0,0]=2 40 B11R1.16 CCOC(=O)C1=CC=NC=C1 SBB065225 [1,0,0,0,0,0|1,0,0]=2 41 B11R1.16 CCOC(=O)C1=NC=CC=C1 SBB065219 [1,0,0,0,0,0|1,0,0]=2 42 B11R1.16 N#CCC(=O)C1=CC=CC=C1 SBB004121 [1,0,0,0,0,0|2,0,1]=4 43 B11R1.16 O=C(CCCl)C1=CC=CC=C1 SBB063710 [1,0,0,0,0,0|2,0,0]=3 44 B11R1.16 O=C(CCF)C1=CC=CC=C1 SBB063711 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.16 O=C(N=C=S)C1=CC=CC=C1 SBB068862 [1,0,0,0,0,0|2,0,1]=4 46 B11R1.16 O=C(SCO)C1=CC=CC=C1 SBB088192 [1,0,0,0,0,0|1,1,0]=3 47 B11R1.16 O=C(\C=N\O)C1=CC=CC=C1 SBB063283 [1,0,0,0,0,0|3,0,0]=4 48 B11R1.16 O=C=NC(=O)C1=CC=CC=C1 SBB067603 [1,0,0,0,0,0|2,0,1]=4 49 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 SBB038706 [1,0,0,0,0,0|2,0,0]=3 50 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 SBB028287 [1,0,0,0,0,0|3,0,0]=4 51 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 SBB058414 [1,0,0,0,0,0|1,0,0]=2 52 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 SBB056753 [1,0,0,0,0,0|1,0,0]=2 53 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 SBB035779 [1,0,0,0,0,0|1,0,0]=2 54 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 SBB058461 [1,0,0,0,0,0|1,0,0]=2 55 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 SBB040250 [1,0,0,0,0,0|1,0,0]=2 56 B11R1.22 CCC(N)C1=CC=C(C)C=C1 SBB017924 [1,0,0,0,0,0|2,0,1]=4 57 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 SBB046785 [1,0,0,0,0,0|2,0,1]=4 58 B11R1.22 CCC(N)C1=CC=C(F)C=C1 SBB010339 [1,0,0,0,0,0|2,0,1]=4 59 B11R1.22 CCC(N)C1=CC=C(O)C=C1 SBB080407 [1,0,0,0,0,0|2,0,1]=4 60 B11R1.22 CCC(O)C1=CC=C(F)C=C1 SBB087018 [1,0,0,0,0,0|1,0,2]=4 61 B11R1.22 CNC(=O)C1=CC=C(Br)C=C1 SBB051043 [1,0,0,0,0,0|2,0,0]=3 62 B11R1.22 CNC(=O)C1=CC=C(C)C=C1 SBB008263 [1,0,0,0,0,0|2,0,0]=3 63 B11R1.22 CNC(=O)C1=CC=C(Cl)C=C1 SBB003861 [1,0,0,0,0,0|2,0,0]=3 64 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 SBB000104 [1,0,0,0,0,0|1,0,0]=2 65 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 SBB063144 [1,0,0,0,0,0|1,0,0]=2 66 B11R1.22 COC(=O)C1=CC=C(Br)N=C1 SBB053855 [1,0,0,0,0,0|2,0,0]=3 67 B11R1.22 COC(=O)C1=CC=C(C)C=C1 SBB064103 [1,0,0,0,0,0|1,0,0]=2 68 B11R1.22 COC(=O)C1=CC=C(C)N=C1 SBB053798 [1,0,0,0,0,0|2,0,0]=3 69 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 SBB063826 [1,0,0,0,0,0|1,0,0]=2 70 B11R1.22 COC(=O)C1=CC=C(Cl)N=C1 SBB005815 [1,0,0,0,0,0|2,0,0]=3 71 B11R1.22 COC(=O)C1=CC=C(Cl)N=N1 SBB053957 [1,0,0,0,0,0|3,0,0]=4 72 B11R1.22 COC(=O)C1=CC=C(F)C=C1 SBB053694 [1,0,0,0,0,0|1,0,0]=2 73 B11R1.22 COC(=O)C1=CC=C(I)C=C1 SBB063273 [1,0,0,0,0,0|1,0,0]=2 74 B11R1.22 COC(=O)C1=CC=C(N)N=C1 SBB015053 [1,0,0,0,0,0|1,0,0]=2 75 B11R1.22 COC(=O)C1=CC=C(O)C=C1 SBB040908 [1,0,0,0,0,0|1,0,0]=2 76 B11R1.22 COC(=O)C1=CC=[N+](C)C=C1 SBB086856 [1,0,0,0,0,0|2,0,0]=3 77 B11R1.22 COC(=O)C1=CC=[N+]([O-])C=C1 SBB059050 [1,0,0,0,0,0|2,0,0]=3 78 B11R1.22 COC(=O)C1=CN=C(F)C=C1 SBB065264 [1,0,0,0,0,0|2,0,0]=3 79 B11R1.22 COC(=O)C1=COC(=O)C=C1 SBB000117 [1,0,0,0,0,0|2,0,0]=3 80 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 SBB053856 [1,0,0,0,0,0|2,0,0]=3 81 B11R1.22 COC(=O)C1=NC=C(C)N=C1 SBB053940 [1,0,0,0,0,0|3,0,0]=4 82 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 SBB053941 [1,0,0,0,0,0|3,0,0]=4 83 B11R1.22 COC(=O)C1=NC=C(O)N=C1 SBB014253 [1,0,0,0,0,0|3,0,0]=4 84 B11R1.22 COC(=O)C1=NNC(=O)C=C1 SBB042722 [1,0,0,0,0,0|3,0,0]=4 85 B11R1.22 NC1=CC=C(C(=O)OC)C=C1 SBB004063 [1,0,0,0,0,0|0,0,0]=1 86 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 SBB100801 [1,0,0,0,0,0|2,0,0]=3 87 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 SBB017900 [1,0,0,0,0,0|2,0,0]=3 88 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 SBB093579 [1,0,0,0,0,0|2,0,0]=3 89 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 SBB028150 [1,0,0,0,0,0|3,0,0]=4 90 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 SBB003853 [1,0,0,0,0,0|3,0,0]=4 91 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 SBB002375 [1,0,0,0,0,0|3,0,0]=4 92 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 SBB007555 [1,0,0,0,0,0|2,0,0]=3 93 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 SBB043780 [1,0,0,0,0,0|3,0,0]=4 94 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 SBB038654 [1,0,0,0,0,0|2,0,0]=3 95 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 SBB006561 [1,0,0,0,0,0|2,0,0]=3 96 B11R1.22 O=CC(=O)C1=CC=C(F)C=C1 SBB088374 [1,0,0,0,0,0|2,0,1]=4 97 B13R1.17 CC1=CC=C(C(=O)CCCCl)C=C1 SBB005845 [0,1,0,0,0,0|2,0,0]=3 98 B13R1.17 CCCCC(=O)C1=CC=C(Br)C=C1 SBB065070 [0,1,0,0,0,0|2,0,0]=3 99 B13R1.17 CCCCC(=O)C1=CC=C(Cl)C=C1 SBB005774 [0,1,0,0,0,0|2,0,0]=3 100 B13R1.17 CCCCC(=O)C1=CC=C(F)C=C1 SBB005843 [0,1,0,0,0,0|2,0,0]=3 101 B13R1.17 CCCCC(=O)C1=CC=C(O)C=C1 SBB063295 [0,1,0,0,0,0|2,0,0]=3 102 B13R1.17 CCCNC(=O)C1=CC=C(N)C=C1 SBB046817 [0,1,0,0,0,0|1,0,0]=2 103 B13R1.17 CCCOC(=O)C1=CC=C(N)C=C1 SBB015273 [0,1,0,0,0,0|0,0,0]=1 104 B13R1.17 N#CCCC(=O)C1=CC=C(Br)C=C1 SBB079132 [0,1,0,0,0,0|2,0,1]=4 105 B13R1.17 NC1=CC=C(C(=O)NCCO)C=C1 SBB017879 [0,1,0,0,0,0|1,0,0]=2 106 B13R1.17 O=C(CCCCl)C1=CC=C(Cl)C=C1 SBB058352 [0,1,0,0,0,0|2,0,0]=3 107 B13R1.17 O=C(CCCCl)C1=CC=C(F)C=C1 SBB003536 [0,1,0,0,0,0|2,0,0]=3 108 B13R1.17 OC1=CC=C(C(=O)OCCC)C=C1 SBB015060 [0,1,0,0,0,0|1,0,0]=2 109 B13R1.29 CCNS(=O)(=O)C1=CC=C(N)C=C1 SBB019570 [0,1,0,0,0,0|2,0,0]=3 110 B13R1.29 CCOS(=O)(=O)C1=CC=C(C)C=C1 SBB060597 [0,1,0,0,0,0|2,0,0]=3 111 B13R1.132 CC(=O)CC(=O)C1=CC=C(Cl)C=C1 SBB055091 [0,1,0,0,0,0|2,0,1]=4 112 B13R1.132 CC(C)NC(=O)C1=CC=C(F)C=C1 SBB089802 [0,1,0,0,0,0|2,0,0]=3 113 B13R1.132 CC(C)NC(=O)C1=CC=C(N)C=C1 SBB046815 [0,1,0,0,0,0|1,0,0]=2 114 B13R1.132 CC(C)OC(=O)C1=CC=C(N)C=C1 SBB007108 [0,1,0,0,0,0|0,0,0]=1 115 B13R1.132 CC(C)OC(=O)C1=CC=C(O)C=C1 SBB080171 [0,1,0,0,0,0|1,0,0]=2 116 B13R1.132 CC1=CC=C(C(=O)[N-][S+](C)C)C=C1 SBB091917 [0,1,0,0,0,0|3,0,0]=4 117 B13R1.132 C[S+](C)[N-]C(=O)C1=CC=C(Cl)C=C1 SBB095168 [0,1,0,0,0,0|3,0,0]=4 118 B13R1.452 CCCC(=O)C1=CC=C(CC)C=C1 SBB056543 [0,1,0,0,0,0|2,0,0]=3 119 B13R1.452 CCCC(=O)C1=CC=C(OC)C=C1 SBB048006 [0,1,0,0,0,0|2,0,0]=3 120 B13R1.452 CCOC(=O)C1=CC=C(CBr)C=C1 SBB063062 [0,1,0,0,0,0|1,0,0]=2 121 B13R1.452 CCOC(=O)C1=CC=C(OC)C=C1 SBB071416 [0,1,0,0,0,0|1,0,0]=2 122 B13R1.452 CCOC(=O)C1=CN=C(SC)N=C1 SBB065718 [0,1,0,0,0,0|3,0,0]=4 123 B13R1.452 COC1=CC=C(C(=O)CCCl)C=C1 SBB055437 [0,1,0,0,0,0|3,0,0]=4 124 B13R1.466 CCCC(=O)C1=CC=C(C)C(C)=C1 SBB017370 [0,1,0,0,0,0|2,0,0]=3 125 B13R1.466 CCOC(=O)C1=CC(Cl)=C(Cl)N=C1 SBB014427 [0,1,0,0,0,0|2,0,0]=3 126 B13R1.466 CCOC(=O)C1=CC(I)=C(N)C=C1 SBB035799 [0,1,0,0,0,0|0,0,0]=1 127 B13R1.466 CCOC(=O)C1=CC=C(F)C(F)=C1 SBB064627 [0,1,0,0,0,0|1,0,0]=2 128 B13R1.466 CCOC(=O)C1=CC=C(N)C(N)=C1 SBB079269 [0,1,0,0,0,0|0,0,0]=1 129 B13R1.466 CCOC(=O)C1=CC=C(O)C(Br)=C1 SBB067771 [0,1,0,0,0,0|1,0,0]=2 130 B13R1.466 CCOC(=O)C1=CC=C(O)C(N)=C1 SBB072081 [0,1,0,0,0,0|1,0,0]=2 131 B13R1.466 CCOC(=O)C1=CC=C(O)C(O)=C1 SBB063061 [0,1,0,0,0,0|1,0,0]=2 132 B13R1.466 CNCC(=O)C1=CC=C(O)C(O)=C1 SBB057989 [0,1,0,0,0,0|3,0,0]=4 133 B13R1.1511 CCOC(=O)C1=C(N)N=C(S)N=C1 SBB024243 [0,1,0,0,0,0|3,0,0]=4 134 B13R1.1511 CCOC(=O)C1=C(N)NC(=S)N=C1 SBB012821 [0,1,0,0,0,0|3,0,0]=4 135 B13R1.1511 CCOC(=O)C1=C(O)C=C(O)N=C1 SBB053841 [0,1,0,0,0,0|2,0,0]=3 136 B13R1.1511 CCOC(=O)C1=C(O)N=C(C)N=C1 SBB089892 [0,1,0,0,0,0|3,0,0]=4 137 B13R1.1511 CCOC(=O)C1=CC=C(F)C=C1F SBB064610 [0,1,0,0,0,0|1,0,0]=2 138 B13R1.1511 CCOC(=O)C1=CC=C(F)C=C1N SBB053716 [0,1,0,0,0,0|1,0,0]=2 139 B13R1.1511 CCOC(=O)C1=CN=C(Cl)C=C1Cl SBB062779 [0,1,0,0,0,0|2,0,0]=3 140 B13R1.1511 CCOC(=O)C1=CN=C(N)N=C1C SBB053944 [0,1,0,0,0,0|2,0,0]=3 141 B13R1.1511 CCOC(=O)C1=CN=C(N)N=C1N SBB083050 [0,1,0,0,0,0|2,0,0]=3 142 B13R1.1511 CCOC(=O)C1=CN=C(N)N=C1O SBB057997 [0,1,0,0,0,0|2,0,0]=3 143 B13R1.1511 CCOC(=O)C1=CN=C(O)N=C1C SBB083048 [0,1,0,0,0,0|3,0,0]=4 144 B13R1.1511 CCOC(=O)C1=CN=C(O)N=C1N SBB083049 [0,1,0,0,0,0|3,0,0]=4 145 B13R1.1511 CCOC(=O)C1=CNC(=S)NC1=O SBB056783 [0,1,0,0,0,0|3,0,0]=4 146 B13R1.1511 COCC(=O)C1=CC=C(O)C=C1O SBB055503 [0,1,0,0,0,0|3,0,0]=4 147 B13R2.12 NC1=CC=C(C2=CC=NO2)C=C1 SBB022553 [0,0,0,1,0,0|2,0,1]=4 148 B13R2.12 NC1=CC=C(C2=NCCO2)C=C1 SBB057030 [0,0,0,1,0,0|1,0,0]=2 149 B13R2.12 NC1=CC=C(N2CCCC2)C=C1 SBB009578 [0,0,0,1,0,0|3,0,0]=4 150 B13R2.12 NC1=CC=C(N2CCCC2)C=C1 SBB098377 [0,0,0,1,0,0|3,0,0]=4 151 B13R2.520 O=C(C1=CC=C(Br)C=C1)C2CC2 SBB005772 [0,0,0,1,0,0|2,0,0]=3 152 B13R2.520 O=C(C1=CC=C(Cl)C=C1)C2CC2 SBB063027 [0,0,0,1,0,0|2,0,0]=3 153 B13R2.520 O=C(C1=CC=C(F)C=C1)C2CC2 SBB057537 [0,0,0,1,0,0|2,0,0]=3 154 B13R2.5179 CC1=CC=C2C(=O)CCCC2=C1 SBB017371 [0,0,0,1,0,0|2,0,0]=3 155 B13R2.5179 NC1=CC2=C(C=C1)C(=O)CCC2 SBB087532 [0,0,0,1,0,0|1,0,0]=2 156 B13R2.5179 NC1=NC=C2C(=O)CCCC2=N1 SBB012732 [0,0,0,1,0,0|3,0,0]=4 157 B13R2.5179 O=C1CCCC2=C1C=CC(Br)=C2 SBB068533 [0,0,0,1,0,0|2,0,0]=3 158 B13R2.5179 O=C1CCCC2=C1C=CC(O)=C2 SBB066989 [0,0,0,1,0,0|2,0,0]=3 159 B13R2.5179 O=C1CCOC2=C1C=CC(Br)=C2 SBB068500 [0,0,0,1,0,0|3,0,0]=4 160 B13R2.5187 NC1=CC=C2C(=O)NC(=O)C2=C1 SBB001589 [0,0,0,1,0,0|2,0,1]=4 161 B13R2.5187 O=C1OC(=O)C2=C1C=CC(Br)=C2 SBB008534 [0,0,0,1,0,0|2,0,1]=4 162 B13R2.5187 O=C1OC(=O)C2=C1C=CC(F)=C2 SBB059551 [0,0,0,1,0,0|2,0,1]=4 163 B11R1.15 CCNC(=O)C1=CC=C(Br)O1 SBB047049 [0,0,0,0,1,0|3,0,0]=4 164 B11R1.15 CCNC(=O)C1=CC=C(Br)S1 SBB047069 [0,0,0,0,1,0|3,0,0]=4 165 B11R1.15 CCOC(=O)C1=CC(C)=NN1 SBB053932 [0,0,0,0,1,0|3,0,0]=4 166 B11R1.15 CCOC(=O)C1=CC=C(Br)S1 SBB068484 [0,0,0,0,1,0|2,0,0]=3 167 B11R1.15 CCOC(=O)C1=CC=C(Cl)S1 SBB068483 [0,0,0,0,1,0|2,0,0]=3 168 B11R1.15 CCOC(=O)C1=CC=C(F)S1 SBB073634 [0,0,0,0,1,0|2,0,0]=3 169 B11R1.15 CCOC(=O)C1=CN(C)N=C1 SBB116499 [0,0,0,0,1,0|3,0,0]=4 170 B11R1.15 CCOC(=O)C1=CN=C(Br)S1 SBB053906 [0,0,0,0,1,0|3,0,0]=4 171 B11R1.15 CCOC(=O)C1=CN=C(C)S1 SBB053908 [0,0,0,0,1,0|3,0,0]=4 172 B11R1.15 CCOC(=O)C1=CN=C(N)O1 SBB053929 [0,0,0,0,1,0|2,0,0]=3 173 B11R1.15 CCOC(=O)C1=CN=C(N)S1 SBB066388 [0,0,0,0,1,0|2,0,0]=3 174 B11R1.15 CCOC(=O)C1=CNC(S)=N1 SBB088664 [0,0,0,0,1,0|3,0,0]=4 175 B11R1.15 CCOC(=O)C1=COC(C)=N1 SBB053930 [0,0,0,0,1,0|3,0,0]=4 176 B11R1.15 CCOC(=O)C1=COC(Cl)=N1 SBB067111 [0,0,0,0,1,0|3,0,0]=4 177 B11R1.15 CCOC(=O)C1=COC(N)=N1 SBB053928 [0,0,0,0,1,0|2,0,0]=3 178 B11R1.15 CCOC(=O)C1=CSC(Br)=N1 SBB053905 [0,0,0,0,1,0|3,0,0]=4 179 B11R1.15 CCOC(=O)C1=CSC(C)=N1 SBB088520 [0,0,0,0,1,0|3,0,0]=4 180 B11R1.15 CCOC(=O)C1=CSC(N)=N1 SBB000178 [0,0,0,0,1,0|2,0,0]=3 181 B11R1.15 CCOC(=O)C1=NN(C)C=C1 SBB030498 [0,0,0,0,1,0|3,0,0]=4 182 B11R1.15 CCOC(=O)C1=NN=C(N)O1 SBB005498 [0,0,0,0,1,0|3,0,0]=4 183 B11R1.15 CCOC(=O)C1=NN=C(N)S1 SBB059527 [0,0,0,0,1,0|3,0,0]=4 184 B11R1.15 CCOC(=O)C1=NNC(N)=C1 SBB025726 [0,0,0,0,1,0|2,0,0]=3 185 B11R1.15 CCOC(=O)C1=NNC(O)=C1 SBB026848 [0,0,0,0,1,0|3,0,0]=4 186 B11R1.15 CCOC(=O)C1=NOC(C)=C1 SBB050105 [0,0,0,0,1,0|3,0,0]=4 187 B11R1.15 CCOC(=O)C1=NOC(O)=C1 SBB026075 [0,0,0,0,1,0|3,0,0]=4 188 B13R1.19 CC1=CC=C(NC(=O)CCCl)C=C1 SBB072086 [0,0,0,0,0,1|3,0,0]=4 189 B13R1.19 CCCC(=O)NC1=CC=C(N)C=C1 SBB080276 [0,0,0,0,0,1|1,0,0]=2 190 B13R1.19 CCNC(=S)NC1=CC=C(Br)C=C1 SBB000974 [0,0,0,0,0,1|2,1,0]=4 191 B13R1.19 CCNC(=S)NC1=CC=C(F)C=C1 SBB000373 [0,0,0,0,0,1|2,1,0]=4 192 B13R1.19 CCNC(=S)NC1=CC=C(I)C=C1 SBB006260 [0,0,0,0,0,1|2,1,0]=4 193 B13R1.19 CCOC(=O)NC1=CC=C(N)C=C1 SBB072360 [0,0,0,0,0,1|0,0,0]=1 194 B13R1.19 CCOC(C)OC1=CC=C(Br)C=C1 SBB009965 [0,0,0,0,0,1|2,0,1]=4 195 B13R1.19 NC1=CC=C(CC(=O)OCC)C=C1 SBB005813 [0,0,0,0,0,1|0,0,0]=1 196 B13R1.19 O=C(CCCl)NC1=CC=C(Br)C=C1 SBB102589 [0,0,0,0,0,1|3,0,0]=4 197 B13R1.19 O=C(CCCl)NC1=CC=C(Cl)C=C1 SBB108388 [0,0,0,0,0,1|3,0,0]=4 198 B13R1.19 O=C(CCCl)NC1=CC=C(F)C=C1 SBB038546 [0,0,0,0,0,1|3,0,0]=4 199 B10R1.1 C=COC1=CC=C(N)C=C1 SBB010266 [2,0,0,0,0,0|0,0,2]=4 200 B10R1.1 CCCC1=CC=C(N)C=C1 SBB008337 [2,0,0,0,0,0|0,0,1]=3 201 B10R1.1 CCCC1=CC=C(O)C=C1 SBB055506 [2,0,0,0,0,0|1,0,1]=4 202 B10R1.1 CCOC1=CC=C(Br)C=C1 SBB059353 [2,0,0,0,0,0|1,0,0]=3 203 B10R1.1 CCOC1=CC=C(C)C=C1 SBB060988 [2,0,0,0,0,0|1,0,0]=3 204 B10R1.1 CCOC1=CC=C(Cl)C=C1 SBB040853 [2,0,0,0,0,0|1,0,0]=3 205 B10R1.1 CCOC1=CC=C(F)C=C1 SBB086157 [2,0,0,0,0,0|1,0,0]=3 206 B10R1.1 CCOC1=CC=C(N)C=C1 SBB040442 [2,0,0,0,0,0|0,0,0]=2 207 B10R1.1 CCOC1=CC=C(N)C=C1 SBB073014 [2,0,0,0,0,0|0,0,0]=2 208 B10R1.1 CCOC1=CC=C(O)C=C1 SBB043810 [2,0,0,0,0,0|1,0,0]=3 209 B10R1.1 CCOC1=NC=C(Br)C=C1 SBB054264 [2,0,0,0,0,0|2,0,0]=4 210 B10R1.1 CCSC1=CC=C(N)C=C1 SBB071614 [2,0,0,0,0,0|0,1,0]=3 211 B10R1.1 NC1=CC=C(CCO)C=C1 SBB042772 [2,0,0,0,0,0|1,0,1]=4 212 B10R1.17 CCCNC1=CC=CC=C1 SBB059800 [2,0,0,0,0,0|2,0,0]=4 213 B10R1.17 CCCOC1=CC=CC=C1 SBB061098 [2,0,0,0,0,0|2,0,0]=4 214 B10R1.17 CCNCC1=CC=CC=C1 SBB058765 [2,0,0,0,0,0|1,0,1]=4 215 B10R1.17 CCOCC1=CC=CC=C1 SBB061196 [2,0,0,0,0,0|0,0,1]=3 216 B10R1.17 CCSCC1=CC=CC=C1 SBB061362 [2,0,0,0,0,0|0,1,1]=4 217 B10R1.17 ClCOCC1=CC=CC=C1 SBB064207 [2,0,0,0,0,0|1,0,1]=4 218 B10R1.17 ClC\C=C\C1=CC=CC=C1 SBB040602 [2,0,0,0,0,0|2,0,0]=4 219 B10R1.17 OC\C=C\C1=CC=CC=C1 SBB058645 [2,0,0,0,0,0|2,0,0]=4 220 B10R1.15 C#CC(=O)C1=CC=CC=C1 SBB012771 [2,0,0,0,0,0|0,0,2]=4 221 B10R1.15 CCC(=O)C1=CC=CC=C1 SBB058853 [2,0,0,0,0,0|0,0,0]=2 222 B10R1.15 CCC(=O)C1=CC=NC=C1 SBB068976 [2,0,0,0,0,0|1,0,0]=3 223 B10R1.15 CCC(Br)C1=CC=CC=C1 SBB060201 [2,0,0,0,0,0|1,0,1]=4 224 B10R1.15 CCC(C)C1=CC=CC=C1 SBB060615 [2,0,0,0,0,0|1,0,1]=4 225 B10R1.15 CCC(N)C1=CC=CC=C1 SBB029878 [2,0,0,0,0,0|1,0,1]=4 226 B10R1.15 CCC(N)C1=CC=CC=C1 SBB080382 [2,0,0,0,0,0|1,0,1]=4 227 B10R1.15 CCC(O)C1=CC=CC=C1 SBB058750 [2,0,0,0,0,0|0,0,2]=4 228 B10R1.15 CNC(=O)C1=CC=CC=C1 SBB051421 [2,0,0,0,0,0|1,0,0]=3 229 B10R1.15 COC(=N)C1=CC=CC=C1 SBB055305 [2,0,0,0,0,0|1,0,0]=3 230 B10R1.15 COC(=O)C1=CC=CC=C1 SBB058212 [2,0,0,0,0,0|0,0,0]=2 231 B10R1.15 COC(=O)C1=CC=CC=N1 SBB008127 [2,0,0,0,0,0|1,0,0]=3 232 B10R1.15 COC(=O)C1=CC=NC=C1 SBB058848 [2,0,0,0,0,0|1,0,0]=3 233 B10R1.15 COC(=O)C1=CN=CC=C1 SBB040924 [2,0,0,0,0,0|1,0,0]=3 234 B10R1.15 COC(=O)C1=NC=CC=N1 SBB053945 [2,0,0,0,0,0|2,0,0]=4 235 B10R1.15 COC(=O)C1=NC=CN=C1 SBB053939 [2,0,0,0,0,0|2,0,0]=4 236 B10R1.15 COC(=O)C1=NC=NC=C1 SBB053949 [2,0,0,0,0,0|2,0,0]=4 237 B10R1.15 N#CC(=O)C1=CC=CC=C1 SBB058756 [2,0,0,0,0,0|1,0,1]=4 238 B10R1.15 NCC(=O)C1=CC=CC=C1 SBB063139 [2,0,0,0,0,0|1,0,0]=3 239 B10R1.15 NCC(=O)C1=CC=CC=C1 SBB066026 [2,0,0,0,0,0|1,0,0]=3 240 B10R1.15 NNC(=O)C1=CC=CC=C1 SBB040976 [2,0,0,0,0,0|2,0,0]=4 241 B10R1.15 O=C(CBr)C1=CC=NC=C1 SBB051672 [2,0,0,0,0,0|2,0,0]=4 242 B10R1.15 O=C(CBr)C1=CN=CC=C1 SBB005582 [2,0,0,0,0,0|2,0,0]=4 243 B10R1.15 O=C(CBr)C1=NC=CC=C1 SBB005581 [2,0,0,0,0,0|2,0,0]=4 244 B10R1.15 O=C(CO)C1=CC=CC=C1 SBB085926 [2,0,0,0,0,0|1,0,0]=3 245 B10R1.15 O=C(NO)C1=CC=CC=C1 SBB058405 [2,0,0,0,0,0|2,0,0]=4 246 B10R1.15 O=CC(=O)C1=CC=CC=C1 SBB068905 [2,0,0,0,0,0|1,0,1]=4 247 B10R1.15 [NH3+]CC(=O)C1=CC=CC=C1 SBB061439 [2,0,0,0,0,0|1,0,0]=3 248 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 SBB040244 [2,0,0,0,0,0|1,0,0]=3 249 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 SBB055637 [2,0,0,0,0,0|2,0,0]=4 250 B10R1.13 CC(=O)C1=CC=C(C)C=C1 SBB058845 [2,0,0,0,0,0|1,0,0]=3 251 B10R1.13 CC(=O)C1=CC=C(C)N=C1 SBB055610 [2,0,0,0,0,0|2,0,0]=4 252 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 SBB040243 [2,0,0,0,0,0|1,0,0]=3 253 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 SBB055593 [2,0,0,0,0,0|2,0,0]=4 254 B10R1.13 CC(=O)C1=CC=C(F)C=C1 SBB040257 [2,0,0,0,0,0|1,0,0]=3 255 B10R1.13 CC(=O)C1=CC=C(I)C=C1 SBB058956 [2,0,0,0,0,0|1,0,0]=3 256 B10R1.13 CC(=O)C1=CC=C(N)C=C1 SBB040278 [2,0,0,0,0,0|0,0,0]=2 257 B10R1.13 CC(=O)C1=CC=C(O)C=C1 SBB040251 [2,0,0,0,0,0|1,0,0]=3 258 B10R1.13 CC(C)C1=CC=C(N)C=C1 SBB040447 [2,0,0,0,0,0|1,0,1]=4 259 B10R1.13 CC(O)C1=CC=C(N)C=C1 SBB048111 [2,0,0,0,0,0|0,0,2]=4 260 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 SBB058746 [2,0,0,0,0,0|2,0,0]=4 261 B10R1.13 CC1=CC=C(C(=O)O)C=C1 SBB040516 [2,0,0,0,0,0|1,0,0]=3 262 B10R1.13 CC1=CC=C(C(=O)O)C=N1 SBB006666 [2,0,0,0,0,0|2,0,0]=4 263 B10R1.13 CC1=CC=C(C(N)=O)C=C1 SBB007862 [2,0,0,0,0,0|2,0,0]=4 264 B10R1.13 CC1=CN=C(C(=O)O)C=C1 SBB052876 [2,0,0,0,0,0|2,0,0]=4 265 B10R1.13 CN(C)C1=CC=C(N)C=C1 SBB058715 [2,0,0,0,0,0|2,0,0]=4 266 B10R1.13 N=C(N)C1=CC=C(N)C=C1 SBB003838 [2,0,0,0,0,0|2,0,0]=4 267 B10R1.13 N=C(N)C1=CC=C(N)C=C1 SBB063615 [2,0,0,0,0,0|2,0,0]=4 268 B10R1.13 N=C(\C1=CC=C(N)C=C1)N SBB005770 [2,0,0,0,0,0|2,0,0]=4 269 B10R1.13 NC(=O)C1=CC=C(F)C=C1 SBB086057 [2,0,0,0,0,0|2,0,0]=4 270 B10R1.13 NC(=O)C1=CC=C(N)C=C1 SBB028159 [2,0,0,0,0,0|1,0,0]=3 271 B10R1.13 NC(=O)C1=CC=C(N)N=C1 SBB051875 [2,0,0,0,0,0|2,0,0]=4 272 B10R1.13 NC(=O)C1=CC=C(O)C=C1 SBB058350 [2,0,0,0,0,0|2,0,0]=4 273 B10R1.13 NC1=CC=C(B(O)O)C=C1 SBB070184 [2,0,0,0,0,0|1,0,1]=4 274 B10R1.13 NC1=CC=C(C(=O)O)C=C1 SBB058665 [2,0,0,0,0,0|0,0,0]=2 275 B10R1.13 NC1=CC=C(C(=O)O)C=N1 SBB004186 [2,0,0,0,0,0|1,0,0]=3 276 B10R1.13 NC1=CC=C(C(=O)O)N=C1 SBB028257 [2,0,0,0,0,0|1,0,0]=3 277 B10R1.13 NC1=CC=C(C(=O)O)N=N1 SBB053237 [2,0,0,0,0,0|2,0,0]=4 278 B10R1.13 NC1=CC=C(S(=O)O)C=C1 SBB072620 [2,0,0,0,0,0|1,0,0]=3 279 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 SBB059787 [2,0,0,0,0,0|1,0,1]=4 280 B10R1.13 NC1=NC=C(C(=O)O)C=N1 SBB053221 [2,0,0,0,0,0|2,0,0]=4 281 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 SBB058718 [2,0,0,0,0,0|2,0,0]=4 282 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 SBB058751 [2,0,0,0,0,0|2,0,0]=4 283 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 SBB040628 [2,0,0,0,0,0|2,0,0]=4 284 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 SBB040519 [2,0,0,0,0,0|1,0,0]=3 285 B10R1.13 O=C(O)C1=CC=C(Br)C=N1 SBB028529 [2,0,0,0,0,0|2,0,0]=4 286 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 SBB040517 [2,0,0,0,0,0|1,0,0]=3 287 B10R1.13 O=C(O)C1=CC=C(Cl)C=N1 SBB062819 [2,0,0,0,0,0|2,0,0]=4 288 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 SBB004004 [2,0,0,0,0,0|2,0,0]=4 289 B10R1.13 O=C(O)C1=CC=C(F)C=C1 SBB008568 [2,0,0,0,0,0|1,0,0]=3 290 B10R1.13 O=C(O)C1=CC=C(F)N=C1 SBB065228 [2,0,0,0,0,0|2,0,0]=4 291 B10R1.13 O=C(O)C1=CC=C(I)C=C1 SBB063146 [2,0,0,0,0,0|1,0,0]=3 292 B10R1.13 O=C(O)C1=CC=C(O)N=C1 SBB004181 [2,0,0,0,0,0|2,0,0]=4 293 B10R1.13 O=C(O)C1=CC=[N+]([O-])C=C1 SBB052968 [2,0,0,0,0,0|2,0,0]=4 294 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 SBB028530 [2,0,0,0,0,0|2,0,0]=4 295 B10R1.13 O=C(O)C1=CN=C(S)C=C1 SBB004027 [2,0,0,0,0,0|2,0,0]=4 296 B10R1.13 O=C(O)C1=NC=C(F)C=C1 SBB065401 [2,0,0,0,0,0|2,0,0]=4 297 B10R1.13 O=C(O)C1=NC=C(O)C=C1 SBB052998 [2,0,0,0,0,0|2,0,0]=4 298 B10R1.13 OC(=O)C1=COC(=O)C=C1 SBB004170 [2,0,0,0,0,0|2,0,0]=4 299 B12R1.1 CCCCCC1=CC=C(N)C=C1 SBB008338 [1,1,0,0,0,0|1,0,1]=4 300 B12R1.1 CCCCOC1=CC=C(N)C=C1 SBB008295 [1,1,0,0,0,0|1,0,1]=4 301 B12R1.1 CCCCSC1=CC=C(N)C=C1 SBB072787 [1,1,0,0,0,0|1,0,1]=4 302 B12R1.1 NCCOCC1=CC=C(Cl)C=C1 SBB071568 [1,1,0,0,0,0|1,0,1]=4 303 B12R1.21 CC(C)COC1=CC=C(N)C=C1 SBB079898 [1,1,0,0,0,0|2,0,0]=4 304 B12R1.49 CCC(=O)NC1=CC=C(N)C=C1 SBB080274 [1,1,0,0,0,0|2,0,0]=4 305 B12R1.71 CCCCC1=CC=C(CN)C=C1 SBB059362 [1,1,0,0,0,0|1,0,1]=4 306 B12R1.71 CCCOC1=CC=C(CN)C=C1 SBB048897 [1,1,0,0,0,0|2,0,0]=4 307 B12R1.385 CCCCC1=CC=C(N)C(C)=C1 SBB087730 [1,1,0,0,0,0|1,0,1]=4 308 B12R1.17 CCNC(=O)C1=CC(N)=CC=C1 SBB080262 [1,1,0,0,0,0|1,0,0]=3 309 B12R1.17 CCOC(=O)C1=CC(Br)=CN=C1 SBB005820 [1,1,0,0,0,0|1,0,0]=3 310 B12R1.17 CCOC(=O)C1=CC(Cl)=NC=C1 SBB019078 [1,1,0,0,0,0|1,0,0]=3 311 B12R1.17 CCOC(=O)C1=CC(F)=CN=C1 SBB053804 [1,1,0,0,0,0|1,0,0]=3 312 B12R1.17 CCOC(=O)C1=CC(N)=CN=C1 SBB088001 [1,1,0,0,0,0|1,0,0]=3 313 B12R1.17 CCOC(=O)C1=CC(N)=NC=C1 SBB053850 [1,1,0,0,0,0|1,0,0]=3 314 B12R1.17 CCOC(=O)C1=CC=CC(C)=C1 SBB064988 [1,1,0,0,0,0|0,0,0]=2 315 B12R1.17 CCOC(=O)C1=CC=CC(Cl)=C1 SBB064614 [1,1,0,0,0,0|0,0,0]=2 316 B12R1.17 CCOC(=O)C1=CC=CC(F)=C1 SBB064679 [1,1,0,0,0,0|0,0,0]=2 317 B12R1.17 CCOC(=O)C1=CC=CC(N)=C1 SBB064162 [1,1,0,0,0,0|0,0,0]=2 318 B12R1.17 CCOC(=O)C1=CC=CC(O)=C1 SBB038646 [1,1,0,0,0,0|0,0,0]=2 319 B12R1.17 CCOC(=O)C1=CN=CC(O)=C1 SBB088061 [1,1,0,0,0,0|1,0,0]=3 320 B12R1.17 CCOC(=O)C1=NC(Br)=CC=C1 SBB065220 [1,1,0,0,0,0|1,0,0]=3 321 B12R1.17 CCOC(=O)C1=NC(O)=CC=C1 SBB014301 [1,1,0,0,0,0|1,0,0]=3 322 B12R1.30 CCCCC(=O)C1=CC=CC=C1 SBB064862 [1,1,0,0,0,0|1,0,0]=3 323 B12R1.30 CCCNC(=O)C1=CC=CC=C1 SBB058554 [1,1,0,0,0,0|1,0,0]=3 324 B12R1.30 CCCOC(=O)C1=CC=CC=C1 SBB061241 [1,1,0,0,0,0|0,0,0]=2 325 B12R1.30 CCCOC(=O)C1=CN=CC=C1 SBB061278 [1,1,0,0,0,0|1,0,0]=3 326 B12R1.30 N#CCCC(=O)C1=CC=CC=C1 SBB087363 [1,1,0,0,0,0|1,0,1]=4 327 B12R1.30 N#CCNC(=O)C1=CC=CC=C1 SBB038180 [1,1,0,0,0,0|1,0,1]=4 328 B12R1.30 NCCNC(=O)C1=CC=NC=C1 SBB044912 [1,1,0,0,0,0|2,0,0]=4 329 B12R1.30 O=C(NCCCl)C1=CC=CC=C1 SBB008196 [1,1,0,0,0,0|1,0,0]=3 330 B12R1.30 O=C(NCCO)C1=CC=NC=C1 SBB055661 [1,1,0,0,0,0|2,0,0]=4 331 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 SBB040798 [1,1,0,0,0,0|1,0,1]=4 332 B12R1.107 CC(C)NC(=O)C1=CC=CC=C1 SBB058207 [1,1,0,0,0,0|1,0,0]=3 333 B12R1.107 C[S+](C)CC(=O)C1=CC=CC=C1 SBB063237 [1,1,0,0,0,0|2,0,0]=4 334 B12R1.308 CCNC(=O)C1=CC=CC=C1N SBB079897 [1,1,0,0,0,0|1,0,0]=3 335 B12R1.308 CCNC(=O)C1=CC=CN=C1Cl SBB047046 [1,1,0,0,0,0|2,0,0]=4 336 B12R1.308 CCOC(=O)C1=C(Cl)C=CC=C1 SBB064139 [1,1,0,0,0,0|0,0,0]=2 337 B12R1.308 CCOC(=O)C1=C(Cl)N=CC=C1 SBB065272 [1,1,0,0,0,0|1,0,0]=3 338 B12R1.308 CCOC(=O)C1=CC=CC=C1Br SBB065109 [1,1,0,0,0,0|0,0,0]=2 339 B12R1.308 CCOC(=O)C1=CC=CC=C1C SBB064989 [1,1,0,0,0,0|0,0,0]=2 340 B12R1.308 CCOC(=O)C1=CC=CC=C1F SBB064678 [1,1,0,0,0,0|0,0,0]=2 341 B12R1.308 CCOC(=O)C1=CC=CC=C1N SBB064986 [1,1,0,0,0,0|0,0,0]=2 342 B12R1.308 CCOC(=O)C1=CC=CC=C1O SBB058594 [1,1,0,0,0,0|0,0,0]=2 343 B12R1.308 CCOC(=O)C1=CC=CN=C1C SBB053824 [1,1,0,0,0,0|1,0,0]=3 344 B12R1.308 CCOC(=O)C1=CC=NC=C1N SBB053810 [1,1,0,0,0,0|1,0,0]=3 345 B12R1.308 CCOC(=O)C1=CN=CC=C1Cl SBB053818 [1,1,0,0,0,0|1,0,0]=3 346 B12R1.5 C#CC1=CC=C(C(=O)OC)C=C1 SBB068914 [1,1,0,0,0,0|1,0,0]=3 347 B12R1.5 C(=O)C1=CC=C(C(=O)OC)C=C1 SBB008362 [1,1,0,0,0,0|1,0,0]=3 348 B12R1.5 CCC(=O)C1=CC=C(C#N)C=C1 SBB074336 [1,1,0,0,0,0|0,0,1]=3 349 B12R1.5 CCC(=O)C1=CC=C(OC)C=C1 SBB087799 [1,1,0,0,0,0|1,0,0]=3 350 B12R1.5 CCC1=CC=C(C(=O)CCl)C=C1 SBB072734 [1,1,0,0,0,0|2,0,0]=4 351 B12R1.5 CNC(=O)C1=CC=C(OC)C=C1 SBB087913 [1,1,0,0,0,0|2,0,0]=4 352 B12R1.5 CNC1=CC=C(C(=O)OC)C=C1 SBB048194 [1,1,0,0,0,0|0,0,0]=2 353 B12R1.5 COC(=O)C1=CC=C(C#N)C=C1 SBB057292 [1,1,0,0,0,0|0,0,1]=3 354 B12R1.5 COC(=O)C1=CC=C(CBr)C=C1 SBB054899 [1,1,0,0,0,0|1,0,0]=3 355 B12R1.5 COC(=O)C1=CC=C(CCl)C=C1 SBB059299 [1,1,0,0,0,0|1,0,0]=3 356 B12R1.5 COC(=O)C1=CC=C(CN)C=C1 SBB026559 [1,1,0,0,0,0|0,0,0]=2 357 B12R1.5 COC(=O)C1=CC=C(CN)C=C1 SBB052372 [1,1,0,0,0,0|0,0,0]=2 358 B12R1.5 COC(=O)C1=CC=C(CO)C=C1 SBB059298 [1,1,0,0,0,0|1,0,0]=3 359 B12R1.5 COC(=O)C1=CC=C(NN)C=C1 SBB072386 [1,1,0,0,0,0|0,0,0]=2 360 B12R1.5 COC(=O)C1=CC=C(OC)C=C1 SBB058204 [1,1,0,0,0,0|1,0,0]=3 361 B12R1.5 COC(=O)C1=CN=C(CO)C=C1 SBB053825 [1,1,0,0,0,0|2,0,0]=4 362 B12R1.5 COC(=O)C1=CN=C(OC)C=C1 SBB058538 [1,1,0,0,0,0|2,0,0]=4 363 B12R1.5 COC1=CC=C(C(=O)CBr)C=C1 SBB007777 [1,1,0,0,0,0|2,0,0]=4 364 B12R1.5 COC1=CC=C(C(=O)CCl)C=C1 SBB027247 [1,1,0,0,0,0|2,0,0]=4 365 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 SBB003530 [1,1,0,0,0,0|2,0,0]=4 366 B12R1.9 CCS(=O)(=O)C1=CC=C(Cl)C=C1 SBB006304 [1,1,0,0,0,0|2,0,0]=4 367 B12R1.9 CNS(=O)(=O)C1=CC=C(N)C=C1 SBB005913 [1,1,0,0,0,0|2,0,0]=4 368 B12R1.9 COS(=O)(=O)C1=CC=C(C)C=C1 SBB058206 [1,1,0,0,0,0|2,0,0]=4 369 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 SBB017540 [1,1,0,0,0,0|2,0,0]=4 370 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 SBB040493 [1,1,0,0,0,0|2,0,0]=4 371 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 SBB059403 [1,1,0,0,0,0|2,0,0]=4 372 B12R1.12 CC\C(=N/O)C1=CC=C(C)C=C1 SBB020243 [1,1,0,0,0,0|1,0,1]=4 373 B12R1.12 CC\C(=N\O)C1=CC=C(O)C=C1 SBB080217 [1,1,0,0,0,0|1,0,1]=4 374 B12R1.20 CC(C)C(=O)C1=CC=C(F)C=C1 SBB088008 [1,1,0,0,0,0|1,0,0]=3 375 B12R1.20 CC(Cl)C(=O)C1=CC=C(F)C=C1 SBB064057 [1,1,0,0,0,0|1,0,0]=3 376 B12R1.20 CN(C)C(=O)C1=CC=C(N)C=C1 SBB041090 [1,1,0,0,0,0|1,0,0]=3 377 B12R1.20 O=C(C1=CC=C(Cl)C=C1)C(Cl)Cl SBB080786 [1,1,0,0,0,0|2,0,0]=4 378 B12R1.367 CCC(=O)C1=CC(Br)=C(F)C=C1 SBB097700 [1,1,0,0,0,0|1,0,0]=3 379 B12R1.367 CCC(=O)C1=CC(C)=C(O)C=C1 SBB057383 [1,1,0,0,0,0|1,0,0]=3 380 B12R1.367 CCC(=O)C1=CC(F)=C(F)C=C1 SBB055169 [1,1,0,0,0,0|1,0,0]=3 381 B12R1.367 CCC(=O)C1=CC=C(C)C(C)=C1 SBB028618 [1,1,0,0,0,0|1,0,0]=3 382 B12R1.367 CCC(=O)C1=CC=C(Cl)C(Cl)=C1 SBB058468 [1,1,0,0,0,0|1,0,0]=3 383 B12R1.367 CCC(=O)C1=CC=C(Cl)C(F)=C1 SBB090501 [1,1,0,0,0,0|1,0,0]=3 384 B12R1.367 CCC(=O)C1=CC=C(F)C(Cl)=C1 SBB090505 [1,1,0,0,0,0|1,0,0]=3 385 B12R1.367 CCC(=O)C1=CC=C(O)C(Cl)=C1 SBB090222 [1,1,0,0,0,0|1,0,0]=3 386 B12R1.367 COC(=O)C1=CC(Br)=C(Cl)N=C1 SBB053832 [1,1,0,0,0,0|2,0,0]=4 387 B12R1.367 COC(=O)C1=CC(Br)=C(N)C=C1 SBB012847 [1,1,0,0,0,0|0,0,0]=2 388 B12R1.367 COC(=O)C1=CC(Br)=C(N)N=C1 SBB053828 [1,1,0,0,0,0|1,0,0]=3 389 B12R1.367 COC(=O)C1=CC(Br)=C(O)N=C1 SBB053800 [1,1,0,0,0,0|2,0,0]=4 390 B12R1.367 COC(=O)C1=CC(C)=C(C)C=C1 SBB053730 [1,1,0,0,0,0|1,0,0]=3 391 B12R1.367 COC(=O)C1=CC(C)=C(N)C=C1 SBB053690 [1,1,0,0,0,0|0,0,0]=2 392 B12R1.367 COC(=O)C1=CC(Cl)=C(C)C=C1 SBB053740 [1,1,0,0,0,0|1,0,0]=3 393 B12R1.367 COC(=O)C1=CC(Cl)=C(Cl)C=C1 SBB093406 [1,1,0,0,0,0|1,0,0]=3 394 B12R1.367 COC(=O)C1=CC(N)=C(C)C=C1 SBB053756 [1,1,0,0,0,0|1,0,0]=3 395 B12R1.367 COC(=O)C1=CC(N)=C(N)C=C1 SBB053760 [1,1,0,0,0,0|0,0,0]=2 396 B12R1.367 COC(=O)C1=CC(N)=C(O)C=C1 SBB053757 [1,1,0,0,0,0|1,0,0]=3 397 B12R1.367 COC(=O)C1=CC(O)=C(C)C=C1 SBB053738 [1,1,0,0,0,0|1,0,0]=3 398 B12R1.367 COC(=O)C1=CC(O)=C(O)C=C1 SBB058373 [1,1,0,0,0,0|1,0,0]=3 399 B12R1.367 COC(=O)C1=CC=C(Br)C(C)=C1 SBB064631 [1,1,0,0,0,0|1,0,0]=3 400 B12R1.367 COC(=O)C1=CC=C(C)C(Br)=C1 SBB064768 [1,1,0,0,0,0|1,0,0]=3 401 B12R1.367 COC(=O)C1=CC=C(C)C(I)=C1 SBB068078 [1,1,0,0,0,0|1,0,0]=3 402 B12R1.367 COC(=O)C1=CC=C(Cl)C(C)=C1 SBB064720 [1,1,0,0,0,0|1,0,0]=3 403 B12R1.367 COC(=O)C1=CC=C(F)C(F)=C1 SBB068281 [1,1,0,0,0,0|1,0,0]=3 404 B12R1.367 COC(=O)C1=CC=C(F)C(N)=C1 SBB088266 [1,1,0,0,0,0|1,0,0]=3 405 B12R1.367 COC(=O)C1=CC=C(F)C(O)=C1 SBB067582 [1,1,0,0,0,0|1,0,0]=3 406 B12R1.367 COC(=O)C1=CC=C(I)C(C)=C1 SBB064772 [1,1,0,0,0,0|1,0,0]=3 407 B12R1.367 COC(=O)C1=CC=C(N)C(I)=C1 SBB064804 [1,1,0,0,0,0|0,0,0]=2 408 B12R1.367 COC(=O)C1=CC=C(N)C(O)=C1 SBB050374 [1,1,0,0,0,0|0,0,0]=2 409 B12R1.367 COC(=O)C1=CC=C(O)C(Br)=C1 SBB067796 [1,1,0,0,0,0|1,0,0]=3 410 B12R1.367 COC(=O)C1=CC=C(O)C(I)=C1 SBB068813 [1,1,0,0,0,0|1,0,0]=3 411 B12R1.367 COC(=O)C1=COC(=O)C(Br)=C1 SBB054033 [1,1,0,0,0,0|2,0,0]=4 412 B12R1.367 NC1=C(Cl)C=C(C(=O)OC)C=C1 SBB003712 [1,1,0,0,0,0|0,0,0]=2 413 B12R1.367 NCC(=O)C1=CC=C(Cl)C(Cl)=C1 SBB064539 [1,1,0,0,0,0|2,0,0]=4 414 B12R1.367 NNC(=O)C1=CC=C(N)C(N)=C1 SBB048002 [1,1,0,0,0,0|2,0,0]=4 415 B12R1.367 O=C(CBr)C1=CC=C(F)C(F)=C1 SBB063566 [1,1,0,0,0,0|2,0,0]=4 416 B12R1.367 O=C(CCl)C1=CC(O)=C(O)C=C1 SBB063277 [1,1,0,0,0,0|2,0,0]=4 417 B12R1.1703 CCC(=O)C1=C(F)C=C(F)C=C1 SBB064045 [1,1,0,0,0,0|1,0,0]=3 418 B12R1.1703 CCC(=O)C1=C(O)C=C(O)C=C1 SBB057457 [1,1,0,0,0,0|1,0,0]=3 419 B12R1.1703 CCC(=O)C1=CC=C(C)C=C1C SBB028615 [1,1,0,0,0,0|1,0,0]=3 420 B12R1.1703 CCC(=O)C1=CC=C(Cl)C=C1Cl SBB016918 [1,1,0,0,0,0|1,0,0]=3 421 B12R1.1703 CCC(=O)C1=CC=C(Cl)C=C1Cl SBB016920 [1,1,0,0,0,0|1,0,0]=3 422 B12R1.1703 COC(=O)C1=C(Cl)C=C(Cl)N=C1 SBB053826 [1,1,0,0,0,0|2,0,0]=4 423 B12R1.1703 COC(=O)C1=C(Cl)N=C(Cl)C=C1 SBB093570 [1,1,0,0,0,0|2,0,0]=4 424 B12R1.1703 COC(=O)C1=C(O)C=C(C)C=C1 SBB008512 [1,1,0,0,0,0|1,0,0]=3 425 B12R1.1703 COC(=O)C1=C(O)C=C(F)C=C1 SBB064671 [1,1,0,0,0,0|1,0,0]=3 426 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1N SBB053695 [1,1,0,0,0,0|1,0,0]=3 427 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1Cl SBB064667 [1,1,0,0,0,0|1,0,0]=3 428 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1N SBB003711 [1,1,0,0,0,0|1,0,0]=3 429 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1O SBB053784 [1,1,0,0,0,0|1,0,0]=3 430 B12R1.1703 COC(=O)C1=CC=C(F)C=C1Cl SBB053708 [1,1,0,0,0,0|1,0,0]=3 431 B12R1.1703 COC(=O)C1=CC=C(F)C=C1F SBB063010 [1,1,0,0,0,0|1,0,0]=3 432 B12R1.1703 COC(=O)C1=CC=C(N)C=C1C SBB053715 [1,1,0,0,0,0|0,0,0]=2 433 B12R1.1703 COC(=O)C1=CC=C(N)C=C1O SBB053791 [1,1,0,0,0,0|0,0,0]=2 434 B12R1.1703 COC(=O)C1=CC=C(O)C=C1O SBB040072 [1,1,0,0,0,0|1,0,0]=3 435 B12R1.1703 O=C(CBr)C1=CC=C(F)C=C1F SBB065035 [1,1,0,0,0,0|2,0,0]=4 436 B12R1.1703 O=C(CCl)C1=C(F)C=C(F)C=C1 SBB006665 [1,1,0,0,0,0|2,0,0]=4 437 B12R1.1703 O=C(CCl)C1=CC=C(O)C=C1O SBB010752 [1,1,0,0,0,0|2,0,0]=4 438 B12R1.312 CCOC(=O)C1=CC(C=O)=CN1 SBB067763 [0,1,0,0,1,0|2,0,0]=4 439 B12R1.312 CCOC(=O)C1=CC=C(CCl)O1 SBB054930 [0,1,0,0,1,0|2,0,0]=4 440 B12R1.312 CCOC(=O)C1=CC=C(CN)O1 SBB001502 [0,1,0,0,1,0|1,0,0]=3 441 B12R1.312 CCOC(=O)C1=CSC(NC)=N1 SBB053916 [0,1,0,0,1,0|2,0,0]=4 442 B12R1.313 CCOC(=O)C1=C(Br)SC(N)=N1 SBB053904 [0,1,0,0,1,0|2,0,0]=4 443 B12R1.313 CCOC(=O)C1=C(C)C=C(C)N1 SBB019119 [0,1,0,0,1,0|2,0,0]=4 444 B12R1.313 CCOC(=O)C1=C(C)N=C(N)S1 SBB000257 [0,1,0,0,1,0|2,0,0]=4 445 B12R1.313 CCOC(=O)C1=C(C)N=C(N)S1 SBB006956 [0,1,0,0,1,0|2,0,0]=4 446 B12R1.313 CCOC(=O)C1=C(C)N=C(N)S1 SBB043659 [0,1,0,0,1,0|2,0,0]=4 447 B12R1.313 CCOC(=O)C1=C(N)SC(C)=C1 SBB019620 [0,1,0,0,1,0|2,0,0]=4 448 B12R1.313 CCOC(=O)C1=CC(N)=NN1C SBB025687 [0,1,0,0,1,0|2,0,0]=4 449 B12R1.314 CCOC(=O)C1=NN(C)C(N)=C1 SBB116479 [0,1,0,0,1,0|2,0,0]=4 450 B12R1.1579 CCOC(=O)C1=CSC(C)=C1C SBB017499 [0,1,0,0,1,0|2,0,0]=4 451 B14R1.33 O=C(NCCBr)NC1=CC=C(F)C=C1 SBB102381 [0,1,0,0,0,1|2,0,0]=4 452 B14R1.33 O=C(NCCCl)NC1=CC=C(F)C=C1 SBB055144 [0,1,0,0,0,1|2,0,0]=4 453 B14R1.698 CC(C)CC(=O)NC1=CC=C(N)C=C1 SBB080088 [0,1,0,0,0,1|1,0,0]=3 454 B14R1.954 C(=O)C1=CC=C(OC(=O)CCC)C=C1 SBB008233 [0,1,0,0,0,1|2,0,0]=4 455 B14R1.954 CCOC(=O)CC1=CC=C(NN)C=C1 SBB053734 [0,1,0,0,0,1|0,0,0]=2 456 B14R1.967 CCCC(=O)NC1=CC(N)=C(Cl)C=C1 SBB080083 [0,1,0,0,0,1|2,0,0]=4 457 B14R1.967 CCOC(=O)CC1=CC(Cl)=C(Cl)C=C1 SBB053710 [0,1,0,0,0,1|1,0,0]=3 458 B14R1.967 CCOC(=O)NC1=CC=C(C)C(Cl)=C1 SBB008113 [0,1,0,0,0,1|1,0,0]=3 459 B14R1.967 CCSC(=O)NC1=CC=C(C)C(Cl)=C1 SBB008112 [0,1,0,0,0,1|1,1,0]=4 460 B14R1.10 CCC(C)NC(=O)C1=CC=C(N)C=C1 SBB080278 [0,2,0,0,0,0|1,0,0]=3 461 B14R1.19 CCCCCC(=O)C1=CC=C(C)C=C1 SBB056545 [0,2,0,0,0,0|2,0,0]=4 462 B14R1.19 CCCCNC(=O)C1=CC=C(N)C=C1 SBB080091 [0,2,0,0,0,0|1,0,0]=3 463 B14R1.19 CCCCOC(=O)C1=CC=C(N)C=C1 SBB007542 [0,2,0,0,0,0|0,0,0]=2 464 B14R1.19 CCCCOC(=O)C1=CC=C(O)C=C1 SBB060338 [0,2,0,0,0,0|1,0,0]=3 465 B14R1.19 COCCNC(=O)C1=CC=C(N)C=C1 SBB080271 [0,2,0,0,0,0|1,0,0]=3 466 B14R1.19 COCCOC(=O)C1=CC=C(N)C=C1 SBB043654 [0,2,0,0,0,0|0,0,0]=2 467 B14R1.125 CCCNS(=O)(=O)C1=CC=C(N)C=C1 SBB038209 [0,2,0,0,0,0|2,0,0]=4 468 B14R1.678 CC(=O)OCC(=O)C1=CC=C(Br)C=C1 SBB101819 [0,2,0,0,0,0|1,0,1]=4 469 B14R1.678 CC(C)COC(=O)C1=CC=C(N)C=C1 SBB073012 [0,2,0,0,0,0|0,0,0]=2 470 B14R1.678 CC(C)COC(=O)C1=CC=C(O)C=C1 SBB080168 [0,2,0,0,0,0|1,0,0]=3 471 B14R1.678 CN(C)CCC(=O)C1=CC=C(Cl)C=C1 SBB100369 [0,2,0,0,0,0|2,0,0]=4 472 B14R1.678 NC1=CC=C(C(=O)NCC(=O)O)C=C1 SBB000329 [0,2,0,0,0,0|1,0,1]=4 473 B14R1.678 NC1=CC=C(C(=O)NCC(=O)[O-])C=C1 SBB058025 [0,2,0,0,0,0|1,0,1]=4 474 B14R1.926 COC1=CC=C(C(=O)CCCCl)C=C1 SBB003419 [0,2,0,0,0,0|2,0,0]=4 475 B14R1.2523 O=C(NCCO)C1=C(O)C=C(O)C=C1 SBB057771 [0,2,0,0,0,0|2,0,0]=4 476 B14R1.2523 O=C(NCCO)C1=CC=C(Cl)C=C1Cl SBB098180 [0,2,0,0,0,0|2,0,0]=4 477 B14R1.88 CCN(CC)C(=O)C1=CC=C(C)C=C1 SBB005953 [0,2,0,0,0,0|2,0,0]=4 478 B14R1.88 CCN(CC)C(=O)C1=CC=C(N)C=C1 SBB072574 [0,2,0,0,0,0|1,0,0]=3 479 B14R1.694 CC(C)NS(=O)(=O)C1=CC=C(N)C=C1 SBB013758 [0,2,0,0,0,0|2,0,0]=4 480 B14R1.683 CC(C)(C)NC(=O)C1=CC=C(N)C=C1 SBB080096 [0,2,0,0,0,0|1,0,0]=3 481 B14R1.683 CC(C)(C)OC(=O)C1=CC=C(F)C=C1 SBB092009 [0,2,0,0,0,0|1,0,0]=3 482 B14R1.25 CCOC(=O)C1=CC=C(N=C=O)C=C1 SBB091273 [0,2,0,0,0,0|0,0,1]=3 483 B14R1.25 CCOC(=O)C1=CC=C(N=C=S)C=C1 SBB055493 [0,2,0,0,0,0|0,0,1]=3 484 B14R1.25 CCOC(=O)C1=CC=C(OCC)C=C1 SBB063746 [0,2,0,0,0,0|1,0,0]=3 485 B14R1.610 CCCC(=O)C1=CC=C(C(C)C)C=C1 SBB056544 [0,2,0,0,0,0|2,0,0]=4 486 B14R1.610 CCOC(=O)C1=CC=C(B(O)O)C=C1 SBB063240 [0,2,0,0,0,0|1,0,0]=3 487 B14R1.610 CCOC(=O)C1=CC=C(N(C)C)C=C1 SBB063817 [0,2,0,0,0,0|0,0,0]=2 488 B14R1.610 CCOC(=O)C1=CC=C([N+](=O)[O-])C=C1 SBB058453 [0,2,0,0,0,0|0,0,1]=3 489 B14R1.626 CCOC(=O)C1=CC=C(O)C(NC)=C1 SBB072964 [0,2,0,0,0,0|1,0,0]=3 490 B14R1.626 CCOC(=O)C1=CC=C(O)C(OC)=C1 SBB005892 [0,2,0,0,0,0|1,0,0]=3 491 B14R1.6821 CCOC(=O)C1=CC(Cl)=C(N)C(Cl)=C1 SBB098176 [0,2,0,0,0,0|0,0,0]=2 492 B14R1.6821 CCOC(=O)C1=CC(Cl)=C(O)C(Cl)=C1 SBB053719 [0,2,0,0,0,0|1,0,0]=3 493 B14R1.6821 CCOC(=O)C1=CC(I)=C(N)C(I)=C1 SBB053766 [0,2,0,0,0,0|0,0,0]=2 494 B14R1.6821 CCOC(=O)C1=CC(O)=C(O)C(O)=C1 SBB060353 [0,2,0,0,0,0|1,0,0]=3 495 B14R1.7264 CCCC(=O)C1=CC(O)=C(O)C=C1O SBB058286 [0,2,0,0,0,0|2,0,0]=4 496 B14R1.7264 CCOC(=O)C1=C(F)C=C(F)C(F)=C1 SBB093240 [0,2,0,0,0,0|1,0,0]=3 497 B14R1.7265 CCOC(=O)C1=C(Br)C(=O)C(O)=CO1 SBB074239 [0,2,0,0,0,0|2,0,0]=4 498 B14R1.7265 CCOC(=O)C1=C(O)C(Br)=C(O)N=C1 SBB053857 [0,2,0,0,0,0|2,0,0]=4 499 B14R1.18811 CCOC(=O)C1=C(C)C=C(O)C=C1C SBB062811 [0,2,0,0,0,0|1,0,0]=3 500 B14R1.18811 CCOC(=O)C1=C(C)OC(=O)C=C1C SBB008071 [0,2,0,0,0,0|2,0,0]=4 501 B14R1.18811 CCOC(=O)C1=C(Cl)C=C(C)N=C1Cl SBB098175 [0,2,0,0,0,0|2,0,0]=4 502 B14R1.18811 CCOC(=O)C1=C(N)N=C(N)N=C1C SBB092000 [0,2,0,0,0,0|2,0,0]=4 503 B14R1.18811 CCOC(=O)C1=C(O)C=C(C)N=C1O SBB053811 [0,2,0,0,0,0|2,0,0]=4 504 B12R2.24 NC1=CC2=C(C=C1)CCCC2 SBB013463 [1,0,0,1,0,0|1,0,1]=4 505 B12R2.2 C1=CC=C(C2=NCCN2)C=C1 SBB056523 [1,0,0,1,0,0|2,0,0]=4 506 B12R2.2 C1=CC=C(C2OCCO2)C=C1 SBB058599 [1,0,0,1,0,0|0,0,2]=4 507 B12R2.2 C1=CC=C(C2OCCS2)C=C1 SBB056712 [1,0,0,1,0,0|0,1,1]=4 508 B12R2.1081 O=C1CCCC2=C1C=CC=C2 SBB066987 [1,0,0,1,0,0|1,0,0]=3 509 B12R2.1081 O=C1CCOC2=CC=CC=C12 SBB056286 [1,0,0,1,0,0|2,0,0]=4 510 B12R2.2028 CC1CC(=O)C2=CC=CC=C21 SBB067569 [1,0,0,1,0,0|1,0,0]=3 511 B12R2.2028 O=C1OC(=O)C2=CC=CC=C12 SBB040869 [1,0,0,1,0,0|1,0,1]=4 512 B12R2.2028 O=C1OC(Br)C2=C1C=CC=C2 SBB063763 [1,0,0,1,0,0|1,0,0]=3 513 B12R2.2075 O=C(C1=CC=CC=C1)C2CC2 SBB065028 [1,0,0,1,0,0|1,0,0]=3 514 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 SBB056356 [1,0,0,1,0,0|1,0,0]=3 515 B12R2.612 NC1=CC=C2C(=O)OCC2=C1 SBB007358 [1,0,0,1,0,0|0,0,0]=2 516 B12R2.612 O=C1CCC2=C1C=CC(Cl)=C2 SBB069432 [1,0,0,1,0,0|1,0,0]=3 517 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 SBB054671 [1,0,0,1,0,0|1,0,0]=3 518 B12R2.612 O=C1CCC2=CC(F)=CC=C12 SBB054670 [1,0,0,1,0,0|1,0,0]=3 519 B12R2.612 O=C1COC2=CC(O)=CC=C12 SBB038967 [1,0,0,1,0,0|2,0,0]=4 520 B12R2.612 O=C1OCC2=C1C=CC(Br)=C2 SBB063188 [1,0,0,1,0,0|1,0,0]=3 521 B14R2.106 CCCC1=NC2=C(C=C(N)C=C2)S1 SBB010878 [0,0,0,1,0,1|1,1,0]=4 522 B14R2.106 CCCC1=NC2=CC(N)=CC=C2O1 SBB051990 [0,0,0,1,0,1|2,0,0]=4 523 B14R2.106 CCSC1=NC2=CC=C(N)C=C2S1 SBB072091 [0,0,0,1,0,1|0,2,0]=4 524 B14R2.926 CC1=CC=C(N2CCCC2=O)C=C1 SBB111723 [0,0,0,1,0,1|2,0,0]=4 525 B14R2.926 NC1=CC=C(N2CCCC2=O)C=C1 SBB001510 [0,0,0,1,0,1|1,0,0]=3 526 B14R2.926 O=C1CCCN1C2=CC=C(Br)C=C2 SBB099209 [0,0,0,1,0,1|2,0,0]=4 527 B14R2.926 O=C1CCCN1C2=CC=C(Cl)C=C2 SBB091932 [0,0,0,1,0,1|2,0,0]=4 528 B14R2.926 O=C1CCCN1C2=CC=C(F)C=C2 SBB054204 [0,0,0,1,0,1|2,0,0]=4 529 B14R2.926 O=C1CCCN1C2=CC=C(O)C=C2 SBB015086 [0,0,0,1,0,1|2,0,0]=4 530 B14R2.926 O=C1OCCN1C2=CC=C(O)C=C2 SBB050293 [0,0,0,1,0,1|1,0,0]=3 531 B14R2.949 NC1=CC=C(NC(=O)C2CC2)C=C1 SBB046819 [0,0,0,1,0,1|1,0,0]=3 532 B14R2.949 O=C(NC1=CC=C(I)C=C1)C2CC2 SBB015716 [0,0,0,1,0,1|2,0,0]=4 533 B14R2.8235 CC1=CC(=O)NC2=CC=C(N)C=C12 SBB018519 [0,0,0,1,0,1|1,0,1]=4 534 B14R2.20 CC1=CC=C(C2=CC=C(N)C=C2)O1 SBB010559 [0,1,0,1,0,0|1,0,1]=4 535 B14R2.20 CC1=NC=C(C2=CC=C(N)C=C2)O1 SBB071786 [0,1,0,1,0,0|1,0,1]=4 536 B14R2.933 NC1=CC=C(C(=O)NC2CC2)C=C1 SBB046814 [0,1,0,1,0,0|1,0,0]=3 537 B14R2.329 COC1=CC=C(C(=O)C2CC2)C=C1 SBB055275 [0,1,0,1,0,0|2,0,0]=4 538 B14R2.1801 COC1=CC=C2C(=O)CCCC2=C1 SBB007549 [0,1,0,1,0,0|2,0,0]=4 539 B10R1.11 CCOC(=O)C1=CC=CN1 SBB053894 [1,0,0,0,1,0|1,0,0]=3 540 B10R1.11 CCOC(=O)C1=CC=CO1 SBB067087 [1,0,0,0,1,0|1,0,0]=3 541 B10R1.11 CCOC(=O)C1=CC=CS1 SBB058448 [1,0,0,0,1,0|1,0,0]=3 542 B10R1.11 CCOC(=O)C1=CC=NN1 SBB017331 [1,0,0,0,1,0|2,0,0]=4 543 B10R1.11 CCOC(=O)C1=CNN=C1 SBB062799 [1,0,0,0,1,0|2,0,0]=4 544 B10R1.11 CCOC(=O)C1=COC=N1 SBB053931 [1,0,0,0,1,0|2,0,0]=4 545 B10R1.11 CCOC(=O)C1=CSC=C1 SBB066578 [1,0,0,0,1,0|1,0,0]=3 546 B10R1.11 CCOC(=O)C1=CSC=N1 SBB018687 [1,0,0,0,1,0|2,0,0]=4 547 B10R1.14 COC(=O)C1=CC(Br)=CN1 SBB053897 [1,0,0,0,1,0|2,0,0]=4 548 B10R1.14 COC(=O)C1=CC=C(Br)O1 SBB041085 [1,0,0,0,1,0|2,0,0]=4 549 B10R1.14 COC(=O)C1=CC=C(C)S1 SBB027056 [1,0,0,0,1,0|2,0,0]=4 550 B10R1.14 COC(=O)C1=CC=C(N)S1 SBB014204 [1,0,0,0,1,0|1,0,0]=3 551 B10R1.14 COC(=O)C1=CN=C(N)S1 SBB053918 [1,0,0,0,1,0|2,0,0]=4 552 B10R1.14 COC(=O)C1=CSC(N)=N1 SBB053903 [1,0,0,0,1,0|2,0,0]=4 553 B10R1.14 COC(=O)C1=NNC(N)=C1 SBB032975 [1,0,0,0,1,0|2,0,0]=4 554 B12R1.32 CCNC(=O)NC1=CC=CC=C1 SBB008390 [1,0,0,0,0,1|1,0,0]=3 555 B12R1.32 CCOC(=O)CC1=CC=CC=N1 SBB058275 [1,0,0,0,0,1|1,0,0]=3 556 B12R1.32 CCOC(=O)CC1=CC=NC=C1 SBB053836 [1,0,0,0,0,1|1,0,0]=3 557 B12R1.32 CCOC(=O)CC1=CN=CC=C1 SBB058276 [1,0,0,0,0,1|1,0,0]=3 558 B12R1.32 CCOC(=O)NC1=NC=CC=C1 SBB017258 [1,0,0,0,0,1|1,0,0]=3 559 B12R1.32 O=C(CCCl)OC1=CC=CC=C1 SBB053602 [1,0,0,0,0,1|2,0,0]=4 560 B14R1.502 CCOC(=O)CCC1=CC=C(Br)C=C1 SBB072991 [0,0,0,0,0,2|1,0,0]=3 561 B14R1.502 CCOC(=O)CCC1=CC=C(O)C=C1 SBB091746 [0,0,0,0,0,2|1,0,0]=3 562 B14R1.502 CCOC(=O)COC1=CC=C(I)C=C1 SBB073630 [0,0,0,0,0,2|1,0,0]=3