0 B10R1.11 CCCC(N)C1=CC=CS1 SBB048342 [0,0,0,0,0,0|1,1,1]=3 1 B10R1.11 CCNC(=O)C1=CNN=C1 SBB116142 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.11 CCOC(=O)C1=CC=CN1 SBB053894 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.11 CCOC(=O)C1=CC=CO1 SBB067087 [0,0,0,0,0,0|1,0,0]=1 4 B10R1.11 CCOC(=O)C1=CC=CS1 SBB058448 [0,0,0,0,0,0|1,1,0]=2 5 B10R1.11 CCOC(=O)C1=CC=NN1 SBB017331 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.11 CCOC(=O)C1=CNN=C1 SBB062799 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.11 CCOC(=O)C1=COC=N1 SBB053931 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.11 CCOC(=O)C1=CSC=C1 SBB066578 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.11 CCOC(=O)C1=CSC=N1 SBB018687 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.11 CCOC(=O)C1=CSN=N1 SBB087297 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.11 CCOC(=O)C1=NOC=N1 SBB050948 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.11 N#CCC(=O)C1=CC=CO1 SBB085884 [0,0,0,0,0,0|1,0,1]=2 13 B10R1.11 N#CCC(=O)C1=CC=CS1 SBB005814 [0,0,0,0,0,0|1,1,1]=3 14 B9R1.11 CCC(=O)C1=CC=CS1 SBB028613 [1,0,0,0,0,0|0,1,0]=2 15 B9R1.11 CCC(=O)C1=NC=CS1 SBB109622 [1,0,0,0,0,0|1,1,0]=3 16 B9R1.11 CCC(N)C1=CC=CS1 SBB018551 [1,0,0,0,0,0|1,1,1]=4 17 B9R1.11 CNC(=O)C1=CC=CS1 SBB086206 [1,0,0,0,0,0|1,1,0]=3 18 B9R1.11 CNC(=O)C1=NNC=C1 SBB073741 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.11 CNC(C)C1=CC=CO1 SBB302114 [1,0,0,0,0,0|2,0,1]=4 20 B9R1.11 COC(=O)C1=CC=CN1 SBB013762 [1,0,0,0,0,0|2,0,0]=3 21 B9R1.11 COC(=O)C1=CC=CO1 SBB059585 [1,0,0,0,0,0|1,0,0]=2 22 B9R1.11 COC(=O)C1=CC=CS1 SBB058305 [1,0,0,0,0,0|1,1,0]=3 23 B9R1.11 COC(=O)C1=CC=NO1 SBB019121 [1,0,0,0,0,0|2,0,0]=3 24 B9R1.11 COC(=O)C1=CNC=N1 SBB053938 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.11 COC(=O)C1=CSC=C1 SBB066577 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.11 COC(=O)C1=CSC=N1 SBB066586 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.11 COC(=O)C1=NNC=C1 SBB000006 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.11 C\C(=N/O)C1=CC=CO1 SBB020245 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.11 NNC(=O)C1=CC=CO1 SBB028222 [1,0,0,0,0,0|2,0,0]=3 30 B9R1.11 NNC(=O)C1=CC=CS1 SBB028266 [1,0,0,0,0,0|2,1,0]=4 31 B9R1.11 O=C(CBr)C1=CC=CO1 SBB010227 [1,0,0,0,0,0|1,0,0]=2 32 B9R1.11 O=C(CBr)C1=CC=CS1 SBB005904 [1,0,0,0,0,0|1,1,0]=3 33 B9R1.11 O=C(CCl)C1=CC=CS1 SBB051673 [1,0,0,0,0,0|1,1,0]=3 34 B9R1.11 O=CC(=O)C1=CC=CS1 SBB076918 [1,0,0,0,0,0|1,1,1]=4 35 B9R1.12 C(=O)\C=C\C1=CC=CO1 SBB004286 [1,0,0,0,0,0|1,0,2]=4 36 B9R1.12 CCNCC1=CC=CO1 SBB047492 [1,0,0,0,0,0|1,0,1]=3 37 B9R1.12 CSSCC1=CC=CO1 SBB057326 [1,0,0,0,0,0|2,0,1]=4 38 B9R1.12 NCCCC1=CC=CO1 SBB047796 [1,0,0,0,0,0|1,0,1]=3 39 B11R1.15 CCNC(=O)C1=CC=C(Br)O1 SBB047049 [0,1,0,0,0,0|1,0,0]=2 40 B11R1.15 CCNC(=O)C1=CC=C(Br)S1 SBB047069 [0,1,0,0,0,0|1,1,0]=3 41 B11R1.15 CCOC(=O)C1=CC(C)=NN1 SBB053932 [0,1,0,0,0,0|3,0,0]=4 42 B11R1.15 CCOC(=O)C1=CC=C(Br)S1 SBB068484 [0,1,0,0,0,0|1,1,0]=3 43 B11R1.15 CCOC(=O)C1=CC=C(Cl)S1 SBB068483 [0,1,0,0,0,0|1,1,0]=3 44 B11R1.15 CCOC(=O)C1=CC=C(F)S1 SBB073634 [0,1,0,0,0,0|1,1,0]=3 45 B11R1.15 CCOC(=O)C1=CN=C(Br)S1 SBB053906 [0,1,0,0,0,0|2,1,0]=4 46 B11R1.15 CCOC(=O)C1=CN=C(C)S1 SBB053908 [0,1,0,0,0,0|2,1,0]=4 47 B11R1.15 CCOC(=O)C1=CN=C(N)O1 SBB053929 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.15 CCOC(=O)C1=CN=C(N)S1 SBB066388 [0,1,0,0,0,0|2,1,0]=4 49 B11R1.15 CCOC(=O)C1=CNC(S)=N1 SBB088664 [0,1,0,0,0,0|3,0,0]=4 50 B11R1.15 CCOC(=O)C1=COC(C)=N1 SBB053930 [0,1,0,0,0,0|3,0,0]=4 51 B11R1.15 CCOC(=O)C1=COC(Cl)=N1 SBB067111 [0,1,0,0,0,0|3,0,0]=4 52 B11R1.15 CCOC(=O)C1=COC(N)=N1 SBB053928 [0,1,0,0,0,0|3,0,0]=4 53 B11R1.15 CCOC(=O)C1=CSC(Br)=N1 SBB053905 [0,1,0,0,0,0|3,0,0]=4 54 B11R1.15 CCOC(=O)C1=CSC(C)=N1 SBB088520 [0,1,0,0,0,0|3,0,0]=4 55 B11R1.15 CCOC(=O)C1=CSC(N)=N1 SBB000178 [0,1,0,0,0,0|3,0,0]=4 56 B11R1.15 CCOC(=O)C1=NN(C)C=C1 SBB030498 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.15 CCOC(=O)C1=NN=C(N)O1 SBB005498 [0,1,0,0,0,0|3,0,0]=4 58 B11R1.15 CCOC(=O)C1=NNC(N)=C1 SBB025726 [0,1,0,0,0,0|3,0,0]=4 59 B11R1.15 CCOC(=O)C1=NNC(O)=C1 SBB026848 [0,1,0,0,0,0|3,0,0]=4 60 B11R1.15 CCOC(=O)C1=NOC(C)=C1 SBB050105 [0,1,0,0,0,0|3,0,0]=4 61 B11R1.15 CCOC(=O)C1=NOC(O)=C1 SBB026075 [0,1,0,0,0,0|3,0,0]=4 62 B11R1.29 CCCCC(=O)C1=CC=CS1 SBB048219 [0,1,0,0,0,0|0,1,0]=2 63 B11R1.29 CCCNC(=O)C1=CNN=C1 SBB116139 [0,1,0,0,0,0|3,0,0]=4 64 B11R1.29 NCCNC(=O)C1=NNC=C1 SBB033436 [0,1,0,0,0,0|3,0,0]=4 65 B11R1.29 O=C(NCCO)C1=CC=NN1 SBB000121 [0,1,0,0,0,0|3,0,0]=4 66 B11R1.77 CC(=O)CC(=O)C1=CC=CS1 SBB017377 [0,1,0,0,0,0|0,1,1]=3 67 B11R1.199 CCOC(=O)C1=C(C)N=CN1 SBB057641 [0,1,0,0,0,0|3,0,0]=4 68 B11R1.199 CCOC(=O)C1=C(C)N=CO1 SBB013591 [0,1,0,0,0,0|2,0,0]=3 69 B11R1.199 CCOC(=O)C1=C(C)OC=N1 SBB087057 [0,1,0,0,0,0|3,0,0]=4 70 B11R1.199 CCOC(=O)C1=C(I)C=NN1 SBB073964 [0,1,0,0,0,0|3,0,0]=4 71 B11R1.199 CCOC(=O)C1=C(N)SC=C1 SBB017968 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.199 CCOC(=O)C1=CC=NN1C SBB025013 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.199 CCOC(=O)C1=NC=CN1C SBB013235 [0,1,0,0,0,0|3,0,0]=4 74 B11R1.199 CCOC(=O)C1=NNC=C1N SBB013514 [0,1,0,0,0,0|3,0,0]=4 75 B11R2.2 C1=COC(C2=NCCN2)=C1 SBB017911 [0,0,0,1,0,0|2,0,0]=3 76 B11R2.2 C1=COC(C2CCCN2)=C1 SBB025605 [0,0,0,1,0,0|1,0,1]=3 77 B11R2.2 C1=COC(C2NCCS2)=C1 SBB027762 [0,0,0,1,0,0|1,1,1]=4 78 B11R2.2 C1=CSC(C2CCCN2)=C1 SBB025607 [0,0,0,1,0,0|1,1,1]=4 79 B11R2.2 C1=CSC(N2CCCC2)=C1 SBB059083 [0,0,0,1,0,0|2,1,0]=4 80 B11R2.106 O=C1CCCC2=C1C=CS2 SBB038712 [0,0,0,1,0,0|2,0,0]=3 81 B11R2.106 O=C1CCCC2=C1C=NN2 SBB019306 [0,0,0,1,0,0|3,0,0]=4 82 B11R1.16 CCCC(=O)C1=CC=CC=C1 SBB058761 [0,0,0,0,0,1|1,0,0]=2 83 B11R1.16 CCC[C@@H](N)C1=CC=CC=C1 SBB070021 [0,0,0,0,0,1|2,0,1]=4 84 B11R1.16 CCNC(=O)C1=CC=CC=C1 SBB058216 [0,0,0,0,0,1|2,0,0]=3 85 B11R1.16 CCOC(=O)C1=CC=CC=C1 SBB058595 [0,0,0,0,0,1|2,0,0]=3 86 B11R1.16 CCOC(=O)C1=CC=CN=C1 SBB065600 [0,0,0,0,0,1|2,0,0]=3 87 B11R1.16 CCOC(=O)C1=CC=NC=C1 SBB065225 [0,0,0,0,0,1|2,0,0]=3 88 B11R1.16 CCOC(=O)C1=NC=CC=C1 SBB065219 [0,0,0,0,0,1|2,0,0]=3 89 B11R1.16 N#CCC(=O)C1=CC=CC=C1 SBB004121 [0,0,0,0,0,1|2,0,1]=4 90 B11R1.16 N#CCC(=O)C1=CC=NC=C1 SBB055710 [0,0,0,0,0,1|2,0,1]=4 91 B11R1.16 O=C(CCCl)C1=CC=CC=C1 SBB063710 [0,0,0,0,0,1|2,0,0]=3 92 B11R1.16 O=C(CCF)C1=CC=CC=C1 SBB063711 [0,0,0,0,0,1|2,0,0]=3 93 B11R1.16 O=C(SCO)C1=CC=CC=C1 SBB088192 [0,0,0,0,0,1|3,0,0]=4 94 B11R1.30 CCOC(=O)CC1=CSC=N1 SBB018924 [0,0,0,0,0,1|3,0,0]=4 95 B11R1.30 CCOC(=O)CN1C=CC=N1 SBB087005 [0,0,0,0,0,1|3,0,0]=4 96 B8R0.1 C=CCOC(=O)CCC SBB061324 [1,0,1,0,0,0|0,0,1]=3 97 B8R1.7 CC(=O)C1=CC=CN1 SBB066752 [2,0,0,0,0,0|1,0,0]=3 98 B8R1.7 CC(=O)C1=CC=CO1 SBB040248 [2,0,0,0,0,0|0,0,0]=2 99 B8R1.7 CC(=O)C1=CC=CS1 SBB038710 [2,0,0,0,0,0|0,1,0]=3 100 B8R1.7 CC(=O)C1=CC=NN1 SBB086523 [2,0,0,0,0,0|2,0,0]=4 101 B8R1.7 CC(=O)C1=CSC=C1 SBB048022 [2,0,0,0,0,0|2,0,0]=4 102 B8R1.7 CC(=O)C1=NC=CS1 SBB085685 [2,0,0,0,0,0|1,1,0]=4 103 B8R1.7 CC(N)C1=CC=CO1 SBB017903 [2,0,0,0,0,0|1,0,1]=4 104 B8R1.7 NC(=O)C1=CC=CO1 SBB028188 [2,0,0,0,0,0|1,0,0]=3 105 B8R1.7 NC(=O)C1=CC=CS1 SBB028227 [2,0,0,0,0,0|1,1,0]=4 106 B8R1.7 NC(=S)C1=CC=CO1 SBB055768 [2,0,0,0,0,0|1,1,0]=4 107 B8R1.7 O=C(Cl)C1=CC=CO1 SBB004224 [2,0,0,0,0,0|1,0,0]=3 108 B8R1.7 O=C(Cl)C1=CC=CS1 SBB004099 [2,0,0,0,0,0|1,1,0]=4 109 B8R1.7 O=C(Cl)C1=CC=NO1 SBB005469 [2,0,0,0,0,0|2,0,0]=4 110 B8R1.7 O=C(O)C1=CC=CN1 SBB004332 [2,0,0,0,0,0|2,0,0]=4 111 B8R1.7 O=C(O)C1=CC=CO1 SBB004324 [2,0,0,0,0,0|1,0,0]=3 112 B8R1.7 O=C(O)C1=CC=CS1 SBB004241 [2,0,0,0,0,0|1,1,0]=4 113 B8R1.7 O=C(O)C1=CC=NO1 SBB004319 [2,0,0,0,0,0|2,0,0]=4 114 B8R1.7 O=C(O)C1=CN=CO1 SBB053191 [2,0,0,0,0,0|2,0,0]=4 115 B8R1.8 CCCC1=CC=CS1 SBB073407 [2,0,0,0,0,0|0,1,0]=3 116 B8R1.8 CCCC1=NC=CS1 SBB055797 [2,0,0,0,0,0|1,1,0]=4 117 B8R1.8 CCCN1C=CC=N1 SBB024228 [2,0,0,0,0,0|2,0,0]=4 118 B8R1.8 CNCC1=CC=CO1 SBB079004 [2,0,0,0,0,0|1,0,0]=3 119 B8R1.8 NCCC1=CC=CO1 SBB013333 [2,0,0,0,0,0|1,0,0]=3 120 B8R1.8 NCCC1=CC=CS1 SBB013250 [2,0,0,0,0,0|1,1,0]=4 121 B8R1.8 NCCC1=CC=CS1 SBB013650 [2,0,0,0,0,0|1,1,0]=4 122 B8R1.8 OCCC1=CC=CS1 SBB062831 [2,0,0,0,0,0|1,1,0]=4 123 B10R1.9 CCC(NC)C1=CC=CO1 SBB302388 [1,1,0,0,0,0|1,0,1]=4 124 B10R1.14 COC(=O)C1=CC(Br)=CN1 SBB053897 [1,1,0,0,0,0|2,0,0]=4 125 B10R1.14 COC(=O)C1=CC(C)=NO1 SBB026808 [1,1,0,0,0,0|2,0,0]=4 126 B10R1.14 COC(=O)C1=CC=C(Br)O1 SBB041085 [1,1,0,0,0,0|1,0,0]=3 127 B10R1.14 COC(=O)C1=CC=C(C)S1 SBB027056 [1,1,0,0,0,0|1,1,0]=4 128 B10R1.14 COC(=O)C1=CC=C(N)S1 SBB014204 [1,1,0,0,0,0|1,1,0]=4 129 B10R1.14 NNC(=O)C1=CC=C(Br)O1 SBB017765 [1,1,0,0,0,0|2,0,0]=4 130 B10R1.23 CC(C)C(=O)C1=CC=CS1 SBB019524 [1,1,0,0,0,0|0,1,0]=3 131 B10R1.23 NC(=O)C(=O)C1=CC=CO1 SBB058265 [1,1,0,0,0,0|1,0,1]=4 132 B10R1.23 O=C(O)C(=O)C1=CC=CO1 SBB058266 [1,1,0,0,0,0|1,0,1]=4 133 B10R1.149 CN1C=CC=C1C(=O)CCl SBB010396 [1,1,0,0,0,0|2,0,0]=4 134 B10R1.149 COC(=O)C1=C(C)C=CO1 SBB069525 [1,1,0,0,0,0|1,0,0]=3 135 B10R1.149 COC(=O)C1=C(C)C=NO1 SBB053926 [1,1,0,0,0,0|2,0,0]=4 136 B10R1.149 COC(=O)C1=C(Cl)C=CS1 SBB053879 [1,1,0,0,0,0|1,1,0]=4 137 B10R1.149 COC(=O)C1=C(N)C=CS1 SBB017942 [1,1,0,0,0,0|1,1,0]=4 138 B10R1.149 COC(=O)C1=C(O)C=CS1 SBB016862 [1,1,0,0,0,0|1,1,0]=4 139 B10R1.149 COC(=O)C1=CC=CN1C SBB086060 [1,1,0,0,0,0|2,0,0]=4 140 B10R1.21 CNCCCC1=CC=CO1 SBB301605 [1,1,0,0,0,0|0,0,1]=3 141 B10R1.21 NCCSCC1=CC=CO1 SBB010394 [1,1,0,0,0,0|1,0,1]=4 142 B10R1.21 OCCNCC1=CC=CO1 SBB017330 [1,1,0,0,0,0|1,0,1]=4 143 B10R1.27 CCC(=O)CC1=CC=CO1 SBB014951 [1,1,0,0,0,0|0,0,2]=4 144 B10R1.66 CC(=O)\C=C\C1=CC=CO1 SBB056697 [1,1,0,0,0,0|0,0,2]=4 145 B10R1.66 CC(N)CCC1=CC=CO1 SBB007120 [1,1,0,0,0,0|0,0,1]=3 146 B12R1.16 CC1=CC=C(C(=O)CCCl)C=C1 SBB063951 [0,1,0,0,0,1|2,0,0]=4 147 B12R1.16 CCCC(=O)C1=CC=C(Br)C=C1 SBB065069 [0,1,0,0,0,1|1,0,0]=3 148 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 SBB017369 [0,1,0,0,0,1|1,0,0]=3 149 B12R1.16 CCCC(=O)C1=CC=C(F)C=C1 SBB088007 [0,1,0,0,0,1|1,0,0]=3 150 B12R1.16 CCCC(=O)C1=CC=C(N)C=C1 SBB017672 [0,1,0,0,0,1|1,0,0]=3 151 B12R1.16 CCCC(=O)C1=CC=C(O)C=C1 SBB001584 [0,1,0,0,0,1|1,0,0]=3 152 B12R1.16 CCNC(=O)C1=CC=C(N)C=C1 SBB017849 [0,1,0,0,0,1|2,0,0]=4 153 B12R1.16 CCOC(=O)C1=CC=C(Br)C=C1 SBB065108 [0,1,0,0,0,1|2,0,0]=4 154 B12R1.16 CCOC(=O)C1=CC=C(C)C=C1 SBB064875 [0,1,0,0,0,1|2,0,0]=4 155 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 SBB040855 [0,1,0,0,0,1|2,0,0]=4 156 B12R1.16 CCOC(=O)C1=CC=C(Cl)N=C1 SBB053795 [0,1,0,0,0,1|2,0,0]=4 157 B12R1.16 CCOC(=O)C1=CC=C(F)C=C1 SBB063137 [0,1,0,0,0,1|2,0,0]=4 158 B12R1.16 CCOC(=O)C1=CC=C(I)C=C1 SBB058455 [0,1,0,0,0,1|2,0,0]=4 159 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 SBB028356 [0,1,0,0,0,1|2,0,0]=4 160 B12R1.16 CCOC(=O)C1=CC=C(O)C=C1 SBB038536 [0,1,0,0,0,1|2,0,0]=4 161 B12R1.16 CCOC(=O)C1=NNC(=O)C=C1 SBB053958 [0,1,0,0,0,1|2,0,0]=4 162 B12R1.16 CNCC(=O)C1=CC=C(O)C=C1 SBB013970 [0,1,0,0,0,1|2,0,0]=4 163 B12R1.16 O=C(CCCl)C1=CC=C(Cl)C=C1 SBB063212 [0,1,0,0,0,1|2,0,0]=4 164 B12R1.16 O=C(CCCl)C1=CC=C(F)C=C1 SBB042481 [0,1,0,0,0,1|2,0,0]=4 165 B12R1.17 CCNC(=O)C1=CC(N)=CC=C1 SBB080262 [0,1,0,0,0,1|2,0,0]=4 166 B12R1.17 CCOC(=O)C1=CC(Br)=CN=C1 SBB005820 [0,1,0,0,0,1|2,0,0]=4 167 B12R1.17 CCOC(=O)C1=CC(Cl)=NC=C1 SBB019078 [0,1,0,0,0,1|2,0,0]=4 168 B12R1.17 CCOC(=O)C1=CC(F)=CN=C1 SBB053804 [0,1,0,0,0,1|2,0,0]=4 169 B12R1.17 CCOC(=O)C1=CC(N)=CN=C1 SBB088001 [0,1,0,0,0,1|2,0,0]=4 170 B12R1.17 CCOC(=O)C1=CC(N)=NC=C1 SBB053850 [0,1,0,0,0,1|2,0,0]=4 171 B12R1.17 CCOC(=O)C1=CC=CC(C)=C1 SBB064988 [0,1,0,0,0,1|2,0,0]=4 172 B12R1.17 CCOC(=O)C1=CC=CC(Cl)=C1 SBB064614 [0,1,0,0,0,1|2,0,0]=4 173 B12R1.17 CCOC(=O)C1=CC=CC(F)=C1 SBB064679 [0,1,0,0,0,1|2,0,0]=4 174 B12R1.17 CCOC(=O)C1=CC=CC(N)=C1 SBB064162 [0,1,0,0,0,1|2,0,0]=4 175 B12R1.17 CCOC(=O)C1=CC=CC(O)=C1 SBB038646 [0,1,0,0,0,1|2,0,0]=4 176 B12R1.17 CCOC(=O)C1=CN=CC(O)=C1 SBB088061 [0,1,0,0,0,1|2,0,0]=4 177 B12R1.17 CCOC(=O)C1=NC(Br)=CC=C1 SBB065220 [0,1,0,0,0,1|2,0,0]=4 178 B12R1.17 CCOC(=O)C1=NC(O)=CC=C1 SBB014301 [0,1,0,0,0,1|2,0,0]=4 179 B12R1.30 CCCCC(=O)C1=CC=CC=C1 SBB064862 [0,1,0,0,0,1|1,0,0]=3 180 B12R1.30 CCCNC(=O)C1=CC=CC=C1 SBB058554 [0,1,0,0,0,1|1,0,0]=3 181 B12R1.30 CCCOC(=O)C1=CC=CC=C1 SBB061241 [0,1,0,0,0,1|1,0,0]=3 182 B12R1.30 CCCOC(=O)C1=CN=CC=C1 SBB061278 [0,1,0,0,0,1|1,0,0]=3 183 B12R1.30 N#CCCC(=O)C1=CC=CC=C1 SBB087363 [0,1,0,0,0,1|1,0,1]=4 184 B12R1.30 NCCNC(=O)C1=CC=NC=C1 SBB044912 [0,1,0,0,0,1|2,0,0]=4 185 B12R1.30 O=C(NCCCl)C1=CC=CC=C1 SBB008196 [0,1,0,0,0,1|2,0,0]=4 186 B12R1.30 O=C(NCCO)C1=CC=NC=C1 SBB055661 [0,1,0,0,0,1|2,0,0]=4 187 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 SBB040798 [0,1,0,0,0,1|1,0,1]=4 188 B12R1.107 CC(C)NC(=O)C1=CC=CC=C1 SBB058207 [0,1,0,0,0,1|2,0,0]=4 189 B12R1.107 C[S+](C)CC(=O)C1=CC=CC=C1 SBB063237 [0,1,0,0,0,1|2,0,0]=4 190 B12R1.308 CCNC(=O)C1=CC=CC=C1N SBB079897 [0,1,0,0,0,1|2,0,0]=4 191 B12R1.308 CCNC(=O)C1=CC=CN=C1Cl SBB047046 [0,1,0,0,0,1|2,0,0]=4 192 B12R1.308 CCOC(=O)C1=C(Cl)C=CC=C1 SBB064139 [0,1,0,0,0,1|2,0,0]=4 193 B12R1.308 CCOC(=O)C1=C(Cl)N=CC=C1 SBB065272 [0,1,0,0,0,1|2,0,0]=4 194 B12R1.308 CCOC(=O)C1=CC=CC=C1Br SBB065109 [0,1,0,0,0,1|2,0,0]=4 195 B12R1.308 CCOC(=O)C1=CC=CC=C1C SBB064989 [0,1,0,0,0,1|2,0,0]=4 196 B12R1.308 CCOC(=O)C1=CC=CC=C1F SBB064678 [0,1,0,0,0,1|2,0,0]=4 197 B12R1.308 CCOC(=O)C1=CC=CC=C1N SBB064986 [0,1,0,0,0,1|2,0,0]=4 198 B12R1.308 CCOC(=O)C1=CC=CC=C1O SBB058594 [0,1,0,0,0,1|2,0,0]=4 199 B12R1.308 CCOC(=O)C1=CC=CN=C1C SBB053824 [0,1,0,0,0,1|2,0,0]=4 200 B12R1.308 CCOC(=O)C1=CC=NC=C1N SBB053810 [0,1,0,0,0,1|2,0,0]=4 201 B12R1.308 CCOC(=O)C1=CN=CC=C1Cl SBB053818 [0,1,0,0,0,1|2,0,0]=4 202 B12R1.31 CCOC(=O)NC1=CC=C(C)S1 SBB000253 [0,1,0,0,0,1|1,1,0]=4 203 B12R1.53 O=C(CCCCl)NC1=NC=CS1 SBB038269 [0,1,0,0,0,1|1,1,0]=4 204 B12R1.55 CCOC(=O)C(=O)C1=CC=CS1 SBB059548 [0,1,0,0,0,1|1,1,0]=4 205 B12R1.295 CO\N=C(/C(=O)[O-])C1=CC=CO1 SBB070280 [0,2,0,0,0,0|2,0,0]=4 206 B12R1.29 CC1=CC=C(C(=O)CSC#N)O1 SBB072235 [0,2,0,0,0,0|1,0,1]=4 207 B12R1.29 CCCNC(=O)C1=CC=C(Br)O1 SBB047048 [0,2,0,0,0,0|0,0,0]=2 208 B12R1.29 CCCNC(=O)C1=CC=C(Br)S1 SBB047063 [0,2,0,0,0,0|0,1,0]=3 209 B12R1.312 CCOC(=O)C1=CC(C=O)=CN1 SBB067763 [0,2,0,0,0,0|2,0,0]=4 210 B12R1.312 CCOC(=O)C1=CC=C(CCl)O1 SBB054930 [0,2,0,0,0,0|1,0,0]=3 211 B12R1.312 CCOC(=O)C1=CC=C(CN)O1 SBB001502 [0,2,0,0,0,0|1,0,0]=3 212 B12R1.313 CCOC(=O)C1=C(C)C=C(C)N1 SBB019119 [0,2,0,0,0,0|2,0,0]=4 213 B12R1.35 CCCCCC(=O)C1=CC=CO1 SBB008342 [0,2,0,0,0,0|0,0,0]=2 214 B12R1.35 CCCCCC(=O)C1=CC=CS1 SBB061352 [0,2,0,0,0,0|0,1,0]=3 215 B12R1.35 NCCCNC(=O)C1=CC=CO1 SBB301583 [0,2,0,0,0,0|0,0,0]=2 216 B12R1.35 O=C(CCCCCl)C1=CC=CS1 SBB013607 [0,2,0,0,0,0|0,1,0]=3 217 B12R1.54 CN(C)CCC(=O)C1=CC=CS1 SBB090070 [0,2,0,0,0,0|0,1,0]=3 218 B12R1.54 CN(C)\C=C/C(=O)C1=CC=CO1 SBB021397 [0,2,0,0,0,0|0,0,2]=4 219 B12R1.54 O=C(O)CCC(=O)C1=CC=CO1 SBB010490 [0,2,0,0,0,0|0,0,1]=3 220 B12R1.54 O=C(O)CCC(=O)C1=CC=CS1 SBB006959 [0,2,0,0,0,0|0,1,1]=4 221 B12R1.460 CCCOC(=O)C1=C(N)SC=C1 SBB030263 [0,2,0,0,0,0|2,0,0]=4 222 B12R1.144 CC(C)CC(=O)C1=NC=CN1C SBB019406 [0,2,0,0,0,0|2,0,0]=4 223 B12R1.265 CC(C)(C)NC(=O)C1=CC=CS1 SBB090071 [0,2,0,0,0,0|1,1,0]=4 224 B12R1.316 CCOC(=O)C1=C(CN)C=CO1 SBB013135 [0,2,0,0,0,0|1,0,0]=3 225 B10R1.10 CCOC1=CC=CC(O)=C1 SBB005788 [0,0,1,1,0,0|2,0,0]=4 226 B10R1.10 CNCC1=CC(O)=CC=C1 SBB046532 [0,0,1,1,0,0|2,0,0]=4 227 B10R1.96 CCCC1=CC=C(C=O)O1 SBB302490 [0,0,1,1,0,0|0,0,2]=4 228 B10R1.96 CCCC1=CC=C(C=O)S1 SBB010356 [0,0,1,1,0,0|0,1,1]=4 229 B10R1.4 CCCC1=CC=CC=C1N SBB085906 [0,0,1,1,0,0|2,0,0]=4 230 B10R1.4 CCOC1=CC=CC=C1O SBB060424 [0,0,1,1,0,0|2,0,0]=4 231 B12R2.1081 O=C1CCCC2=C1C=CC=C2 SBB066987 [0,0,0,1,0,1|1,0,0]=3 232 B12R2.1081 O=C1CCOC2=CC=CC=C12 SBB056286 [0,0,0,1,0,1|2,0,0]=4 233 B12R2.2028 CC1CC(=O)C2=CC=CC=C21 SBB067569 [0,0,0,1,0,1|1,0,0]=3 234 B12R2.2075 O=C(C1=CC=CC=C1)C2CC2 SBB065028 [0,0,0,1,0,1|1,0,0]=3 235 B12R2.202 NC1=NC2=C(S1)C(=O)CCC2 SBB017962 [0,1,0,1,0,0|1,1,0]=4 236 B10R1.15 CCC(=O)C1=CC=CC=C1 SBB058853 [1,0,0,0,0,1|1,0,0]=3 237 B10R1.15 CCC(=O)C1=CC=NC=C1 SBB068976 [1,0,0,0,0,1|1,0,0]=3 238 B10R1.15 CNC(=O)C1=CC=CC=C1 SBB051421 [1,0,0,0,0,1|2,0,0]=4 239 B10R1.15 COC(=O)C1=CC=CC=C1 SBB058212 [1,0,0,0,0,1|2,0,0]=4 240 B10R1.15 COC(=O)C1=CC=CC=N1 SBB008127 [1,0,0,0,0,1|2,0,0]=4 241 B10R1.15 COC(=O)C1=CC=NC=C1 SBB058848 [1,0,0,0,0,1|2,0,0]=4 242 B10R1.15 COC(=O)C1=CN=CC=C1 SBB040924 [1,0,0,0,0,1|2,0,0]=4 243 B10R1.15 COC(=O)C1=NC=CC=N1 SBB053945 [1,0,0,0,0,1|2,0,0]=4 244 B10R1.15 COC(=O)C1=NC=CN=C1 SBB053939 [1,0,0,0,0,1|2,0,0]=4 245 B10R1.15 COC(=O)C1=NC=NC=C1 SBB053949 [1,0,0,0,0,1|2,0,0]=4 246 B10R1.15 NCC(=O)C1=CC=CC=C1 SBB063139 [1,0,0,0,0,1|2,0,0]=4 247 B10R1.15 NCC(=O)C1=CC=CC=C1 SBB066026 [1,0,0,0,0,1|2,0,0]=4 248 B10R1.15 O=C(CBr)C1=CC=NC=C1 SBB051672 [1,0,0,0,0,1|2,0,0]=4 249 B10R1.15 O=C(CBr)C1=CN=CC=C1 SBB005582 [1,0,0,0,0,1|2,0,0]=4 250 B10R1.15 O=C(CBr)C1=NC=CC=C1 SBB005581 [1,0,0,0,0,1|2,0,0]=4 251 B10R1.15 O=C(CO)C1=CC=CC=C1 SBB085926 [1,0,0,0,0,1|2,0,0]=4 252 B10R1.15 [NH3+]CC(=O)C1=CC=CC=C1 SBB061439 [1,0,0,0,0,1|2,0,0]=4 253 B10R1.17 CCCNC1=CC=CC=C1 SBB059800 [1,0,0,0,0,1|2,0,0]=4 254 B10R1.17 CCCOC1=CC=CC=C1 SBB061098 [1,0,0,0,0,1|2,0,0]=4 255 B12R1.32 CCNC(=O)NC1=CC=CC=C1 SBB008390 [0,0,0,0,0,2|2,0,0]=4 256 B12R1.32 CCOC(=O)CC1=CC=CC=N1 SBB058275 [0,0,0,0,0,2|2,0,0]=4 257 B12R1.32 CCOC(=O)CC1=CC=NC=C1 SBB053836 [0,0,0,0,0,2|2,0,0]=4 258 B12R1.32 CCOC(=O)CC1=CN=CC=C1 SBB058276 [0,0,0,0,0,2|2,0,0]=4 259 B12R1.32 CCOC(=O)NC1=NC=CC=C1 SBB017258 [0,0,0,0,0,2|2,0,0]=4 260 B12R1.32 O=C(CCCl)OC1=CC=CC=C1 SBB053602 [0,0,0,0,0,2|2,0,0]=4 261 B12R1.51 CCOC(=O)\C=C\C1=CC=CO1 SBB001549 [0,0,0,0,0,2|1,0,0]=3 262 B12R1.51 N#CCC(=O)NCC1=CC=CO1 SBB000149 [0,0,0,0,0,2|1,0,1]=4 263 B12R1.51 O=C(CCCl)NCC1=CC=CS1 SBB047039 [0,0,0,0,0,2|1,1,0]=4