0 B10R1.15 CC(C#N)C1=CC=CC=C1 1204062 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.15 CC(NO)C1=CC=CC=C1 1204024 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.15 CCC(=O)C1=CC=CC=C1 1043816 [0,0,0,0,0,0|1,0,0]=1 3 B10R1.15 CCC(C)C1=CC=CC=C1 2827022 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.15 CCC(N)C1=CC=CC=C1 1146635 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.15 CN(C=O)C1=CC=CC=C1 2818161 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.15 CNC(=O)C1=CC=CC=C1 5032223 [0,0,0,0,0,0|1,0,0]=1 7 B10R1.15 COC(=O)C1=CC=CC=C1 2132029 [0,0,0,0,0,0|0,0,0]=0 8 B10R1.15 COC(=O)C1=CC=NC=C1 2084305 [0,0,0,0,0,0|1,0,0]=1 9 B10R1.15 COC(=O)C1=CCNCC1 7142295 [0,0,0,0,0,0|1,0,3]=4 10 B10R1.15 COC(=O)C1=NC=CC=C1 1311479 [0,0,0,0,0,0|1,0,0]=1 11 B10R1.15 CSC(=N)C1=CC=CC=C1 22430530 [0,0,0,0,0,0|1,1,0]=2 12 B10R1.15 C\C(=N/O)C1=CC=CC=C1 2827049 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.15 C\C(=N/O)C1=NC=CC=C1 5011323 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.15 NCC(=O)C1=CC=CC=C1 1042947 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.15 NNC(=O)C1=CC=CC=C1 1778868 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.15 N\C(=N\O)C1=CC=CC=C1 4434547 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.15 O=C(CBr)C1=CC=CC=C1 2125402 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.15 O=C(CBr)C1=CC=NC=C1 5980437 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.15 O=C(CBr)C1=CN=CC=C1 4763913 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.15 O=CC(=O)C1=CC=CC=C1 2826987 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.15 OC(CCl)C1=CC=CC=C1 1500436 [0,0,0,0,0,0|2,0,2]=4 22 B9R1.6 C=C(C)C1=CC=CC=C1 2826092 [1,0,0,0,0,0|1,0,0]=2 23 B9R1.6 CC(=O)C1=CC=CC=C1 1043797 [1,0,0,0,0,0|0,0,0]=1 24 B9R1.6 CC(=O)C1=CC=CN=C1 1778688 [1,0,0,0,0,0|1,0,0]=2 25 B9R1.6 CC(=O)C1=CC=NC=C1 2826148 [1,0,0,0,0,0|1,0,0]=2 26 B9R1.6 CC(=O)C1=NC=CC=C1 2826149 [1,0,0,0,0,0|1,0,0]=2 27 B9R1.6 CC(=O)C1=NC=CN=C1 15386267 [1,0,0,0,0,0|2,0,0]=3 28 B9R1.6 CC(Br)C1=CC=CC=C1 2024133 [1,0,0,0,0,0|1,0,1]=3 29 B9R1.6 CC(C)C1=CC=CC=C1 2826137 [1,0,0,0,0,0|1,0,1]=3 30 B9R1.6 CC(N)C1=CC=CC=C1 1500421 [1,0,0,0,0,0|1,0,1]=3 31 B9R1.6 CC(O)C1=NC=CC=C1 2422301 [1,0,0,0,0,0|1,0,2]=4 32 B9R1.6 CN(C)C1=CC=CC=C1 2826155 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.6 CN(C)C1=CC=NC=C1 2826184 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.6 N=C(N)C1=CC=CC=C1 3337437 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.6 NC(=O)C1=CC=CC=C1 7113222106 [1,0,0,0,0,0|1,0,0]=2 36 B9R1.6 NC(=O)C1=NC=CN=C1 1375193 [1,0,0,0,0,0|3,0,0]=4 37 B9R1.6 NC(=S)C1=CC=CC=C1 1001334 [1,0,0,0,0,0|1,1,0]=3 38 B9R1.6 NC(=S)C1=CC=CN=C1 2125389 [1,0,0,0,0,0|2,1,0]=4 39 B9R1.6 NC(=S)C1=CC=NC=C1 7020310245 [1,0,0,0,0,0|2,1,0]=4 40 B9R1.6 NC(=S)C1=NC=CC=C1 7213750105 [1,0,0,0,0,0|2,1,0]=4 41 B9R1.6 O=C(Cl)C1=CC=CN=C1 1051743 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.6 O=C(Cl)C1=CC=NC=C1 4787240 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.6 O=C(O)C1=CC=CC=C1 1778690 [1,0,0,0,0,0|0,0,0]=1 44 B9R1.6 O=C(O)C1=CC=CN=C1 2084332 [1,0,0,0,0,0|1,0,0]=2 45 B9R1.6 O=C(O)C1=CC=NC=C1 22430647 [1,0,0,0,0,0|1,0,0]=2 46 B9R1.6 O=C(O)C1=CC=NC=N1 0125330094 [1,0,0,0,0,0|2,0,0]=3 47 B9R1.6 O=C(O)C1=CN=CC=N1 1051746 [1,0,0,0,0,0|2,0,0]=3 48 B9R1.6 O=C(O)C1=NC=CC=C1 1051744 [1,0,0,0,0,0|1,0,0]=2 49 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 2826202 [1,0,0,0,0,0|1,0,1]=3 50 B9R1.6 OB(O)C1=CC=CC=C1 971211 [1,0,0,0,0,0|1,0,1]=3 51 B9R1.8 BrCCC1=CC=CC=C1 2889217 [1,0,0,0,0,0|2,0,1]=4 52 B9R1.8 CCCC1=CC=CC=C1 2826136 [1,0,0,0,0,0|1,0,1]=3 53 B9R1.8 CCNC1=CC=CC=C1 1220427 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.8 CCOC1=CC=CC=C1 2826174 [1,0,0,0,0,0|2,0,0]=3 55 B9R1.8 CNCC1=CC=CC=C1 1268163 [1,0,0,0,0,0|1,0,1]=3 56 B9R1.8 ClCCC1=CC=CC=C1 2827551 [1,0,0,0,0,0|2,0,1]=4 57 B9R1.8 N#CCC1=CC=CC=C1 1519434 [1,0,0,0,0,0|2,0,1]=4 58 B9R1.8 NCCC1=CC=CC=C1 1038619 [1,0,0,0,0,0|2,0,1]=4 59 B9R1.8 NNCC1=CC=CC=C1 1972969 [1,0,0,0,0,0|2,0,1]=4 60 B9R1.8 O=C=NC1=CC=CC=C1 1051736 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.8 O=CCC1=CC=CC=C1 1204419 [1,0,0,0,0,0|2,0,1]=4 62 B9R1.8 O=CNC1=CC=CC=C1 2826151 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.8 OCCC1=CC=CC=C1 1204382 [1,0,0,0,0,0|2,0,1]=4 64 B9R1.8 [C]=NCC1=CC=CC=C1 5679156 [1,0,0,0,0,0|1,0,2]=4 65 B11R1.7 CCC(C)(N)C1=CC=CC=C1 2248137 [0,1,0,0,0,0|2,0,1]=4 66 B11R1.12 CCC(CN)C1=CC=CC=C1 1201823 [0,1,0,0,0,0|2,0,1]=4 67 B11R1.12 CCN(CC)C1=CC=CC=C1 2829022 [0,1,0,0,0,0|3,0,0]=4 68 B11R1.12 CC\C(=N\O)C1=CC=CC=C1 19767653 [0,1,0,0,0,0|1,0,1]=3 69 B11R1.12 N#CC(C=O)C1=CC=CC=C1 1902003 [0,1,0,0,0,0|2,0,1]=4 70 B11R1.16 CC(CCN)C1=CC=CC=C1 1042418 [0,1,0,0,0,0|2,0,1]=4 71 B11R1.16 N#C\N=C(/N)C1=CC=CC=C1 5010119 [0,1,0,0,0,0|2,0,1]=4 72 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 3026336 [0,1,0,0,0,0|2,0,0]=3 73 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 0109160035 [0,1,0,0,0,0|2,0,0]=3 74 B11R1.22 CC1=CC=C(\C(N)=N\O)C=C1 2829097 [0,1,0,0,0,0|3,0,0]=4 75 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 1043826 [0,1,0,0,0,0|1,0,0]=2 76 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 1043817 [0,1,0,0,0,0|1,0,0]=2 77 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 1043824 [0,1,0,0,0,0|1,0,0]=2 78 B11R1.22 CCC(=O)C1=CC=C(N)C=C1 1271489 [0,1,0,0,0,0|1,0,0]=2 79 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 7210540047 [0,1,0,0,0,0|1,0,0]=2 80 B11R1.22 CNC(=O)C1=CC=C(Cl)C=C1 7112895235 [0,1,0,0,0,0|1,0,0]=2 81 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 1134985 [0,1,0,0,0,0|1,0,0]=2 82 B11R1.22 COC(=O)C1=CC=C(C)C=C1 2084121 [0,1,0,0,0,0|0,0,0]=1 83 B11R1.22 COC(=O)C1=CC=C(F)C=C1 2084250 [0,1,0,0,0,0|0,0,0]=1 84 B11R1.22 COC(=O)C1=CC=C(N)C=C1 974407 [0,1,0,0,0,0|0,0,0]=1 85 B11R1.22 COC(=O)C1=CC=C(O)C=C1 1310956 [0,1,0,0,0,0|0,0,0]=1 86 B11R1.22 COC(=O)C1=CC=C(S)C=C1 6137666 [0,1,0,0,0,0|0,0,0]=1 87 B11R1.22 COC(=O)C1=CC=[N+]([O-])C=C1 15298713 [0,1,0,0,0,0|1,0,0]=2 88 B11R1.22 COC(=O)C1=CN=C(N)C=C1 3354042 [0,1,0,0,0,0|1,0,0]=2 89 B11R1.22 COC(=O)C1=NC=C(Br)N=C1 6594998 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.22 COC(=O)C1=NC=C(C)N=C1 2829323 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.22 COC(=O)C1=NC=C(O)N=C1 6051767 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.22 COC(=O)C1C=CC(=O)NN1 3585974 [0,1,0,0,0,0|2,0,1]=4 93 B11R1.22 COC(C)C1=CC=C(F)C=C1 3644488 [0,1,0,0,0,0|1,0,1]=3 94 B11R1.22 C\C(=N/O)C1=CC=C(F)C=C1 5012413 [0,1,0,0,0,0|3,0,0]=4 95 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 4788108 [0,1,0,0,0,0|2,0,0]=3 96 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 1042955 [0,1,0,0,0,0|2,0,0]=3 97 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 7115241108 [0,1,0,0,0,0|2,0,0]=3 98 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 7119842867 [0,1,0,0,0,0|2,0,0]=3 99 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 7119846924 [0,1,0,0,0,0|2,0,0]=3 100 B11R1.22 N\C(=N\O)C1=CC=C(Br)C=C1 5012363 [0,1,0,0,0,0|3,0,0]=4 101 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 1106005 [0,1,0,0,0,0|2,0,0]=3 102 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 1106004 [0,1,0,0,0,0|2,0,0]=3 103 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 2125403 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 1313074 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 1312995 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.22 O=C(CO)C1=CC=C(F)C=C1 2829713 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.22 [NH3+]CC(=O)C1=CC=C(F)C=C1 0125210483 [0,1,0,0,0,0|2,0,0]=3 108 B11R1.23 CC1=CC=CC(C(=O)NN)=C1 7119846921 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.23 CNC(=O)C1=CC=CC(N)=C1 974790 [0,1,0,0,0,0|1,0,0]=2 110 B11R1.23 COC(=O)C1=CC(=O)CCC1 15296937 [0,1,0,0,0,0|0,0,3]=4 111 B11R1.23 COC(=O)C1=CC(N)=CC=C1 1232820 [0,1,0,0,0,0|0,0,0]=1 112 B11R1.23 COC(=O)C1=CC(N)=CC=C1 1311369 [0,1,0,0,0,0|0,0,0]=1 113 B11R1.23 COC(=O)C1=CC(N)=NC=C1 3669271 [0,1,0,0,0,0|1,0,0]=2 114 B11R1.23 COC(=O)C1=CC(O)=NC=C1 7135552 [0,1,0,0,0,0|1,0,0]=2 115 B11R1.23 COC(=O)C1=CC=CC(O)=C1 971220 [0,1,0,0,0,0|0,0,0]=1 116 B11R1.23 NCC(=O)C1=CC=CC(Cl)=C1 2237611 [0,1,0,0,0,0|2,0,0]=3 117 B11R1.23 NNC(=O)C1=CC(Cl)=CC=C1 0125160195 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.23 NNC(=O)C1=CC(O)=CC=C1 7119920344 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.23 N\C(=N/O)C1=CC(O)=CC=C1 2424046 [0,1,0,0,0,0|3,0,0]=4 120 B11R1.23 O=C(CBr)C1=CC=CC(Cl)=C1 3145804 [0,1,0,0,0,0|2,0,0]=3 121 B11R1.23 O=C(OO)C1=CC(Cl)=CC=C1 2845888 [0,1,0,0,0,0|1,0,0]=2 122 B11R1.36 CC(=O)C(O)C1=CC=CC=C1 3355149 [0,1,0,0,0,0|1,0,2]=4 123 B11R1.36 O=C(C1=CC=CC=C1)C(O)O 12405446 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.222 CC1=C(\C(N)=N\O)C=CC=C1 2829096 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.222 CCC(=O)C1=CC=CC=C1Br 1909091 [0,1,0,0,0,0|1,0,0]=2 126 B11R1.222 CCC(C)C1=C(N)C=CC=C1 2829031 [0,1,0,0,0,0|2,0,1]=4 127 B11R1.222 CNC(=O)C1=CC=CC=C1N 971816 [0,1,0,0,0,0|1,0,0]=2 128 B11R1.222 COC(=O)C1=C(F)C=CC=C1 2829710 [0,1,0,0,0,0|0,0,0]=1 129 B11R1.222 COC(=O)C1=C(N)C=CC=C1 1867348 [0,1,0,0,0,0|0,0,0]=1 130 B11R1.222 COC(=O)C1=C(N)C=CC=C1 7138607 [0,1,0,0,0,0|0,0,0]=1 131 B11R1.222 COC(=O)C1=C(O)C=CC=C1 1311035 [0,1,0,0,0,0|0,0,0]=1 132 B11R1.222 COC(=O)C1=C(S)C=CC=C1 2824881 [0,1,0,0,0,0|0,0,0]=1 133 B11R1.222 COC(=O)C1=CC=CC=C1C 2084120 [0,1,0,0,0,0|0,0,0]=1 134 B11R1.222 COC(=O)C1=CC=CC=C1Cl 2084248 [0,1,0,0,0,0|0,0,0]=1 135 B11R1.222 COC(=O)C1=NC=CN=C1N 15386266 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.222 NNC(=O)C1=CC=CC=C1Br 7119846925 [0,1,0,0,0,0|2,0,0]=3 137 B11R1.222 NNC(=O)C1=CC=CC=C1F 7119846922 [0,1,0,0,0,0|2,0,0]=3 138 B11R1.222 NNC(=O)C1=CC=CC=C1N 974743 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.222 O=C(CBr)C1=C(F)C=CC=C1 3015492 [0,1,0,0,0,0|2,0,0]=3 140 B11R1.222 O=C(NO)C1=CC=CC=C1O 7119720021 [0,1,0,0,0,0|2,0,0]=3 141 B11R2.1 BrC1=NNC2=C1C=CC=C2 0111070064 [0,0,0,1,0,0|3,0,0]=4 142 B11R2.1 CN1CCC2=CC=CC=C21 3585918 [0,0,0,1,0,0|3,0,0]=4 143 B11R2.1 NC1=C2C=CC=CC2=NS1 7110952728 [0,0,0,1,0,0|2,1,0]=4 144 B11R2.1 NC1=NNC2=C1C=CC=C2 1218431 [0,0,0,1,0,0|3,0,0]=4 145 B11R2.1 O=C1CCC2=CC=CC=C12 1202552 [0,0,0,1,0,0|1,0,0]=2 146 B11R2.1 O=C1NCC2=C1C=CC=C2 2422687 [0,0,0,1,0,0|1,0,0]=2 147 B11R2.1 O=C1OCC2=C1C=CC=C2 2826988 [0,0,0,1,0,0|0,0,0]=1 148 B11R2.1 OC1=NNC2=CC=CC=C21 7020542804 [0,0,0,1,0,0|2,0,1]=4 149 B11R2.1 OC1=NOC2=CC=CC=C21 5011377 [0,0,0,1,0,0|2,0,1]=4 150 B11R2.40 NC1(C2=CC=CC=C2)CC1 1058906 [0,0,0,1,0,0|2,0,1]=4 151 B9R1.11 CCC(=O)C1=CC=CS1 1043815 [0,0,0,0,1,0|2,0,0]=3 152 B9R1.11 COC(=O)C1=CC=CN1 6300636 [0,0,0,0,1,0|1,0,0]=2 153 B9R1.11 COC(=O)C1=CC=CO1 2826302 [0,0,0,0,1,0|1,0,0]=2 154 B9R1.11 COC(=O)C1=CC=NO1 6902354 [0,0,0,0,1,0|2,0,0]=3 155 B9R1.11 NNC(=O)C1=CC=CO1 7113240459 [0,0,0,0,1,0|3,0,0]=4 156 B9R1.11 NNC(=O)C1=CC=CS1 7210740705 [0,0,0,0,1,0|3,0,0]=4 157 B9R1.11 O=C(CCl)C1=CC=CS1 1313194 [0,0,0,0,1,0|3,0,0]=4 158 B9R1.11 O=C(CO)C1=CC=CO1 2826306 [0,0,0,0,1,0|3,0,0]=4 159 B11R1.40 COC(=O)CC1=CC=CC=C1 1902120 [0,0,0,0,0,1|0,0,0]=1 160 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 1902056 [0,0,0,0,0,1|3,0,0]=4 161 B11R1.40 NCC(=O)NC1=CC=CC=C1 7020432301 [0,0,0,0,0,1|2,0,0]=3 162 B11R1.40 NNC(=S)NC1=CC=CC=C1 2125396 [0,0,0,0,0,1|2,1,0]=4 163 B11R1.40 N\C(CC1=CC=CC=C1)=N/O 5011248 [0,0,0,0,0,1|3,0,0]=4 164 B11R1.40 O=C(CCl)NC1=CC=CC=C1 1195629 [0,0,0,0,0,1|2,0,0]=3 165 B11R1.40 O=C(CCl)NC1=NC=CC=C1 1194680 [0,0,0,0,0,1|3,0,0]=4 166 B11R1.40 O=C(CO)NC1=CC=CC=C1 1015594 [0,0,0,0,0,1|2,0,0]=3 167 B11R1.40 O=C(CS)NC1=CC=CC=C1 7414270001 [0,0,0,0,0,1|2,0,0]=3 168 B8R1.2 BrCC1=CC=CC=C1 2844339 [2,0,0,0,0,0|1,0,1]=4 169 B8R1.2 C=CC1=CC=NC=C1 2825664 [2,0,0,0,0,0|1,0,1]=4 170 B8R1.2 CCC1=CC=CC=C1 2825676 [2,0,0,0,0,0|0,0,1]=3 171 B8R1.2 CNC1=CC=CC=C1 1366528 [2,0,0,0,0,0|1,0,0]=3 172 B8R1.2 COC1=CC=CC=C1 2825706 [2,0,0,0,0,0|0,0,0]=2 173 B8R1.2 CSC1=CC=CC=C1 2826254 [2,0,0,0,0,0|0,1,0]=3 174 B8R1.2 ClCC1=CC=CC=C1 1778716 [2,0,0,0,0,0|1,0,1]=4 175 B8R1.2 N#CC1=CC=CC=C1 1778585 [2,0,0,0,0,0|1,0,1]=4 176 B8R1.2 NCC1=CC=CC=C1 1038608 [2,0,0,0,0,0|1,0,1]=4 177 B8R1.2 NCC1=CC=CC=C1 6057147 [2,0,0,0,0,0|1,0,1]=4 178 B8R1.2 NNC1=CC=CC=C1 1156632 [2,0,0,0,0,0|2,0,0]=4 179 B8R1.2 NNC1=CC=CC=C1 6057168 [2,0,0,0,0,0|2,0,0]=4 180 B8R1.2 O=CC1=CC=CC=C1 988591 [2,0,0,0,0,0|0,0,0]=2 181 B8R1.2 O=CC1=CC=CN=C1 2084334 [2,0,0,0,0,0|1,0,0]=3 182 B8R1.2 O=CC1=CC=NC=C1 988524 [2,0,0,0,0,0|1,0,0]=3 183 B8R1.2 O=CC1=NC=CC=C1 2084333 [2,0,0,0,0,0|1,0,0]=3 184 B8R1.2 OCC1=CC=CC=C1 1778593 [2,0,0,0,0,0|0,0,1]=3 185 B8R1.2 SCC1=CC=CC=C1 1972971 [2,0,0,0,0,0|0,1,1]=4 186 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 1043807 [1,1,0,0,0,0|0,0,0]=2 187 B10R1.13 CC(=O)C1=CC=C(C)C=C1 1043798 [1,1,0,0,0,0|0,0,0]=2 188 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 1043806 [1,1,0,0,0,0|0,0,0]=2 189 B10R1.13 CC(=O)C1=CC=C(F)C=C1 1043805 [1,1,0,0,0,0|0,0,0]=2 190 B10R1.13 CC(=O)C1=CC=C(N)C=C1 7119850616 [1,1,0,0,0,0|0,0,0]=2 191 B10R1.13 CC(=O)C1=CC=C(O)C=C1 1778865 [1,1,0,0,0,0|0,0,0]=2 192 B10R1.13 CC(C)C1=CC=C(N)C=C1 2827066 [1,1,0,0,0,0|1,0,1]=4 193 B10R1.13 CC(C)C1=CC=C(N)C=C1 3585954 [1,1,0,0,0,0|1,0,1]=4 194 B10R1.13 CC(C)C1=CC=C(O)C=C1 2827119 [1,1,0,0,0,0|1,0,1]=4 195 B10R1.13 CC(Cl)C1=CC=C(F)C=C1 1366992 [1,1,0,0,0,0|1,0,1]=4 196 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 1051709 [1,1,0,0,0,0|1,0,0]=3 197 B10R1.13 CC1=CC=C(C(=O)O)C=C1 7119561590 [1,1,0,0,0,0|0,0,0]=2 198 B10R1.13 CC1=CC=C(C(C)Br)C=C1 2024134 [1,1,0,0,0,0|1,0,1]=4 199 B10R1.13 CC1=CC=C(C(C)C)C=C1 2827025 [1,1,0,0,0,0|1,0,1]=4 200 B10R1.13 CC1=CC=C(C(C)O)C=C1 1366658 [1,1,0,0,0,0|0,0,2]=4 201 B10R1.13 CC1=CC=C(C(N)=O)C=C1 1106851 [1,1,0,0,0,0|1,0,0]=3 202 B10R1.13 CC1=CC=C(C(N)=S)C=C1 7020331312 [1,1,0,0,0,0|1,1,0]=4 203 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 2839025 [1,1,0,0,0,0|1,0,1]=4 204 B10R1.13 CC1=CC=C([N+](=O)[O-])C=C1 2827170 [1,1,0,0,0,0|1,0,1]=4 205 B10R1.13 CC1=CC=C([SH](=O)=O)C=C1 22430375 [1,1,0,0,0,0|1,0,1]=4 206 B10R1.13 CC1=NC=C(C(=O)O)C=C1 19767694 [1,1,0,0,0,0|1,0,0]=3 207 B10R1.13 CC1=NC=C(C(=O)O)N=C1 2827230 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.13 CC1=NC=C(C(N)=O)C=C1 2827093 [1,1,0,0,0,0|2,0,0]=4 209 B10R1.13 CN(C)C1=CC=C(Br)C=C1 1362066 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.13 CN(C)C1=CC=C(N)C=C1 1512285 [1,1,0,0,0,0|2,0,0]=4 211 B10R1.13 CN(N)C1=CC=C(F)C=C1 1778934 [1,1,0,0,0,0|2,0,0]=4 212 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 22588257 [1,1,0,0,0,0|2,0,0]=4 213 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 6057545 [1,1,0,0,0,0|2,0,0]=4 214 B10R1.13 N=C(N)C1=CC=C(F)C=C1 22588245 [1,1,0,0,0,0|2,0,0]=4 215 B10R1.13 N=C(N)C1=CC=C(N)C=C1 6300646 [1,1,0,0,0,0|2,0,0]=4 216 B10R1.13 N=C(N)C1=CC=C(O)C=C1 2827095 [1,1,0,0,0,0|2,0,0]=4 217 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 1375914 [1,1,0,0,0,0|1,0,0]=3 218 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 1375258 [1,1,0,0,0,0|1,0,0]=3 219 B10R1.13 NC(=O)C1=CC=C(F)C=C1 1375215 [1,1,0,0,0,0|1,0,0]=3 220 B10R1.13 NC(=O)C1=CC=C(I)C=C1 1445657 [1,1,0,0,0,0|1,0,0]=3 221 B10R1.13 NC(=O)C1=CC=C(N)C=C1 1375210 [1,1,0,0,0,0|1,0,0]=3 222 B10R1.13 NC(=O)C1=CC=C(O)C=C1 1375211 [1,1,0,0,0,0|1,0,0]=3 223 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 1792547 [1,1,0,0,0,0|1,1,0]=4 224 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 7020331320 [1,1,0,0,0,0|1,1,0]=4 225 B10R1.13 NC(=S)C1=CC=C(F)C=C1 7020331313 [1,1,0,0,0,0|1,1,0]=4 226 B10R1.13 NC1=CC=C(B(O)O)C=C1 19767697 [1,1,0,0,0,0|1,0,1]=4 227 B10R1.13 NC1=CC=C(C(=O)O)C=C1 1509951 [1,1,0,0,0,0|0,0,0]=2 228 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 2827229 [1,1,0,0,0,0|1,0,1]=4 229 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 1051742 [1,1,0,0,0,0|1,0,0]=3 230 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 1051712 [1,1,0,0,0,0|1,0,0]=3 231 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 1312865 [1,1,0,0,0,0|0,0,0]=2 232 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 1312854 [1,1,0,0,0,0|0,0,0]=2 233 B10R1.13 O=C(O)C1=CC=C(F)C=C1 1506397 [1,1,0,0,0,0|0,0,0]=2 234 B10R1.13 O=C(O)C1=CC=C(I)C=C1 3054307 [1,1,0,0,0,0|0,0,0]=2 235 B10R1.13 O=C(O)C1=CC=C(O)C=C1 1195424 [1,1,0,0,0,0|0,0,0]=2 236 B10R1.13 O=C(O)C1=CC=C(S)C=C1 2829768 [1,1,0,0,0,0|0,0,0]=2 237 B10R1.13 O=C(O)C1=CC=N(=O)C=C1 12405061 [1,1,0,0,0,0|1,0,0]=3 238 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 2830995 [1,1,0,0,0,0|1,0,0]=3 239 B10R1.13 O=C(O)C1=CN=C(O)C=C1 5970174 [1,1,0,0,0,0|1,0,0]=3 240 B10R1.13 O=C(O)C1=NC=C(Br)N=C1 4015292 [1,1,0,0,0,0|2,0,0]=4 241 B10R1.13 O=C(O)C1=NC=C(O)C=C1 3354843 [1,1,0,0,0,0|1,0,0]=3 242 B10R1.13 O=C(O)C1=NC=C(O)N=C1 5010111 [1,1,0,0,0,0|2,0,0]=4 243 B10R1.13 O=C(O)C1=NN=C(Cl)C=C1 3458596 [1,1,0,0,0,0|2,0,0]=4 244 B10R1.13 O=C1C=CC(C(=O)O)=CN1 1313836 [1,1,0,0,0,0|1,0,0]=3 245 B10R1.13 O=C1C=CC(C(=O)O)=NN1 7020410148 [1,1,0,0,0,0|2,0,0]=4 246 B10R1.13 O=S(Cl)C1=CC=C(Cl)C=C1 3519061 [1,1,0,0,0,0|2,0,0]=4 247 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 2830996 [1,1,0,0,0,0|1,0,1]=4 248 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 2827558 [1,1,0,0,0,0|1,0,1]=4 249 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 2827327 [1,1,0,0,0,0|1,0,1]=4 250 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 1179227 [1,1,0,0,0,0|1,0,1]=4 251 B10R1.13 OB(O)C1=CC=C(F)C=C1 1179206 [1,1,0,0,0,0|1,0,1]=4 252 B10R1.28 CC(C)(C)C1=CC=CC=C1 2827021 [1,1,0,0,0,0|1,0,1]=4 253 B10R1.28 O=S(=O)(Cl)C1=CC=CC=C1 1051762 [1,1,0,0,0,0|1,0,1]=4 254 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 4194516 [1,1,0,0,0,0|1,0,0]=3 255 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 1287341 [1,1,0,0,0,0|0,0,0]=2 256 B10R1.61 CC(=O)C1=C(F)C=NC=C1 6902362 [1,1,0,0,0,0|1,0,0]=3 257 B10R1.61 CC(=O)C1=C(O)C=CC=C1 1778867 [1,1,0,0,0,0|0,0,0]=2 258 B10R1.61 CC(=O)C1=CC=CC=C1N 2827048 [1,1,0,0,0,0|0,0,0]=2 259 B10R1.61 CC(C)C1=C(N)C=CC=C1 2827067 [1,1,0,0,0,0|1,0,1]=4 260 B10R1.61 CC(C)C1=C(O)C=CC=C1 2827124 [1,1,0,0,0,0|1,0,1]=4 261 B10R1.61 CC1=C(C(=O)Cl)C=CC=C1 1051707 [1,1,0,0,0,0|1,0,0]=3 262 B10R1.61 CC1=C(C(=O)O)N=CC=C1 2818254 [1,1,0,0,0,0|1,0,0]=3 263 B10R1.61 CC1=C(C(N)=O)C=CC=C1 1375207 [1,1,0,0,0,0|1,0,0]=3 264 B10R1.61 CC1=C([N+](=O)[O-])C=CC=C1 2827169 [1,1,0,0,0,0|1,0,1]=4 265 B10R1.61 CC1=CC=CC=C1C(=O)O 1901857 [1,1,0,0,0,0|0,0,0]=2 266 B10R1.61 CC1=CC=CC=C1C(N)=S 1288011 [1,1,0,0,0,0|1,1,0]=4 267 B10R1.61 CC1=NN=CC=C1C(=O)O 4059593 [1,1,0,0,0,0|2,0,0]=4 268 B10R1.61 CN(C)C1=C(Br)C=CC=C1 3485526 [1,1,0,0,0,0|2,0,0]=4 269 B10R1.61 N=C(N)C1=C(F)C=CC=C1 3515450 [1,1,0,0,0,0|2,0,0]=4 270 B10R1.61 NC(=O)C1=CC=CC=C1N 0125330235 [1,1,0,0,0,0|1,0,0]=3 271 B10R1.61 NC(=O)C1=CC=CC=C1O 2131902 [1,1,0,0,0,0|1,0,0]=3 272 B10R1.61 NC(=S)C1=C(Cl)C=CC=C1 7020331321 [1,1,0,0,0,0|1,1,0]=4 273 B10R1.61 NC(=S)C1=C(F)C=CC=C1 7020331314 [1,1,0,0,0,0|1,1,0]=4 274 B10R1.61 NC1=C(C(=O)O)C=CC=C1 3585810 [1,1,0,0,0,0|0,0,0]=2 275 B10R1.61 NC1=CC=CC=C1[N+](=O)[O-] 2128520 [1,1,0,0,0,0|1,0,1]=4 276 B10R1.61 O=C(Cl)C1=CC=CC=C1Cl 1051740 [1,1,0,0,0,0|1,0,0]=3 277 B10R1.61 O=C(Cl)C1=CC=CC=C1F 1051710 [1,1,0,0,0,0|1,0,0]=3 278 B10R1.61 O=C(O)C1=C(Br)C=CC=N1 3686191 [1,1,0,0,0,0|1,0,0]=3 279 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 1902292 [1,1,0,0,0,0|0,0,0]=2 280 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 2830994 [1,1,0,0,0,0|1,0,0]=3 281 B10R1.61 O=C(O)C1=C(I)C=CC=C1 3054308 [1,1,0,0,0,0|0,0,0]=2 282 B10R1.61 O=C(O)C1=C(S)C=CC=C1 2829766 [1,1,0,0,0,0|0,0,0]=2 283 B10R1.61 O=C(O)C1=CC=CC=C1Br 7119571920 [1,1,0,0,0,0|0,0,0]=2 284 B10R1.61 O=C(O)C1=CC=CC=C1F 1901890 [1,1,0,0,0,0|0,0,0]=2 285 B10R1.61 O=C(O)C1=CC=CC=C1O 2129564 [1,1,0,0,0,0|0,0,0]=2 286 B10R1.61 O=C(O)C1=CC=CNC1=O 4059409 [1,1,0,0,0,0|1,0,0]=3 287 B10R1.61 O=C(O)C1=NC=NC=C1Br 1157350 [1,1,0,0,0,0|2,0,0]=4 288 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CC=C1 2830993 [1,1,0,0,0,0|1,0,1]=4 289 B10R1.61 O=[N+]([O-])C1=C(F)C=CC=C1 2827556 [1,1,0,0,0,0|1,0,1]=4 290 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 7211720040 [1,1,0,0,0,0|1,0,1]=4 291 B10R1.61 O=[N+]([O-])C1=CC=CC=C1Br 1362061 [1,1,0,0,0,0|1,0,1]=4 292 B10R1.61 OB(O)C1=C(F)C=CC=C1 1586067 [1,1,0,0,0,0|1,0,1]=4 293 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 1287349 [1,1,0,0,0,0|0,0,0]=2 294 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 1287348 [1,1,0,0,0,0|0,0,0]=2 295 B10R1.113 CC(=O)C1=CC(N)=CC=C1 1366640 [1,1,0,0,0,0|0,0,0]=2 296 B10R1.113 CC(=O)C1=CC=CC(O)=C1 1901859 [1,1,0,0,0,0|0,0,0]=2 297 B10R1.113 CC(C)C1=CC=CC(O)=C1 2827127 [1,1,0,0,0,0|1,0,1]=4 298 B10R1.113 CC1=CC(C(=O)O)=CN=C1 2818253 [1,1,0,0,0,0|1,0,0]=3 299 B10R1.113 CC1=CC([N+](=O)[O-])=CC=C1 2827171 [1,1,0,0,0,0|1,0,1]=4 300 B10R1.113 CC1=CC=CC(C(=N)N)=C1 5012379 [1,1,0,0,0,0|2,0,0]=4 301 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 1051708 [1,1,0,0,0,0|1,0,0]=3 302 B10R1.113 CC1=CC=CC(C(=O)O)=C1 1901858 [1,1,0,0,0,0|0,0,0]=2 303 B10R1.113 CC1=CC=CC(C(=O)O)=N1 2214917 [1,1,0,0,0,0|1,0,0]=3 304 B10R1.113 CC1=CC=CC(C(N)=O)=C1 1375208 [1,1,0,0,0,0|1,0,0]=3 305 B10R1.113 CC1=NC=CC(C(=O)O)=C1 3666565 [1,1,0,0,0,0|1,0,0]=3 306 B10R1.113 CN(C)C1=CC=CC(Br)=C1 1287426 [1,1,0,0,0,0|2,0,0]=4 307 B10R1.113 CN(C)C1=CC=CC(N)=C1 1232815 [1,1,0,0,0,0|2,0,0]=4 308 B10R1.113 NC(=O)C1=CC(Cl)=CC=C1 1375257 [1,1,0,0,0,0|1,0,0]=3 309 B10R1.113 NC(=O)C1=CC=C[N+]([O-])=C1 3463886 [1,1,0,0,0,0|2,0,0]=4 310 B10R1.113 NC1=CC([N+](=O)[O-])=CC=C1 7217960159 [1,1,0,0,0,0|1,0,1]=4 311 B10R1.113 NC1=CC=CC(C(=O)O)=C1 2827166 [1,1,0,0,0,0|0,0,0]=2 312 B10R1.113 NC1=CN=CC(C(=O)O)=C1 7017520056 [1,1,0,0,0,0|1,0,0]=3 313 B10R1.113 NC1=NC(C(=O)O)=CC=C1 1218791 [1,1,0,0,0,0|1,0,0]=3 314 B10R1.113 NC1=NC=CC(C(=O)O)=C1 2214529 [1,1,0,0,0,0|1,0,0]=3 315 B10R1.113 O=C(Cl)C1=CC=CC(Br)=C1 1051714 [1,1,0,0,0,0|1,0,0]=3 316 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=C1 1051741 [1,1,0,0,0,0|1,0,0]=3 317 B10R1.113 O=C(Cl)C1=CC=CC(F)=C1 1051711 [1,1,0,0,0,0|1,0,0]=3 318 B10R1.113 O=C(O)C1=CC(=S)NC=C1 13577371 [1,1,0,0,0,0|1,0,0]=3 319 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 973807 [1,1,0,0,0,0|0,0,0]=2 320 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 2214915 [1,1,0,0,0,0|1,0,0]=3 321 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 3508030 [1,1,0,0,0,0|2,0,0]=4 322 B10R1.113 O=C(O)C1=CC(F)=CC=C1 1901891 [1,1,0,0,0,0|0,0,0]=2 323 B10R1.113 O=C(O)C1=CC(O)=NC=C1 2223344 [1,1,0,0,0,0|1,0,0]=3 324 B10R1.113 O=C(O)C1=CC(S)=NC=C1 2223361 [1,1,0,0,0,0|1,0,0]=3 325 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 1906408 [1,1,0,0,0,0|0,0,0]=2 326 B10R1.113 O=C(O)C1=CC=CC(O)=C1 2827221 [1,1,0,0,0,0|0,0,0]=2 327 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 0109160011 [1,1,0,0,0,0|1,0,0]=3 328 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 5110090024 [1,1,0,0,0,0|1,0,0]=3 329 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 7017520050 [1,1,0,0,0,0|1,0,0]=3 330 B10R1.113 O=C(O)C1=NC=CC(O)=C1 7017520047 [1,1,0,0,0,0|1,0,0]=3 331 B10R1.113 O=C1C=C(C(=O)O)N=CN1 3508017 [1,1,0,0,0,0|2,0,0]=4 332 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 1362062 [1,1,0,0,0,0|1,0,1]=4 333 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 2827328 [1,1,0,0,0,0|1,0,1]=4 334 B10R1.113 OB(O)C1=CC=CC(Cl)=C1 1179274 [1,1,0,0,0,0|1,0,1]=4 335 B10R1.113 OB(O)C1=CC=CC(F)=C1 1586087 [1,1,0,0,0,0|1,0,1]=4 336 B10R1.1 CCCC1=CC=C(O)C=C1 2818223 [1,1,0,0,0,0|1,0,1]=4 337 B10R1.1 CCOC1=CC=C(N)C=C1 1314575 [1,1,0,0,0,0|2,0,0]=4 338 B10R1.1 CCOC1=CC=C(O)C=C1 1506720 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.1 O\N=C\C1=CC=C(Cl)C=C1 1288010 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.4 CCOC1=C(O)C=CC=C1 2827244 [1,1,0,0,0,0|2,0,0]=4 341 B10R1.4 CCOC1=CC=CC=C1N 1314577 [1,1,0,0,0,0|2,0,0]=4 342 B10R1.10 CCNC1=CC=CC(C)=C1 1220439 [1,1,0,0,0,0|2,0,0]=4 343 B10R1.10 CNCC1=CC(O)=CC=C1 1268164 [1,1,0,0,0,0|1,0,1]=4 344 B10R1.10 CNCC1=CC=CC(O)=C1 3644490 [1,1,0,0,0,0|1,0,1]=4 345 B10R1.10 CSCC1=CC(O)=CC=C1 7575917 [1,1,0,0,0,0|0,1,1]=4 346 B10R1.10 C\N=C\C1=CC=CC(O)=C1 3644500 [1,1,0,0,0,0|1,0,0]=3 347 B10R1.17 BrCCCC1=CC=CC=C1 1275152 [1,1,0,0,0,0|1,0,1]=4 348 B10R1.17 BrCCOC1=CC=CC=C1 7110952510 [1,1,0,0,0,0|2,0,0]=4 349 B10R1.17 CCCCC1=CC=CC=C1 2827024 [1,1,0,0,0,0|1,0,1]=4 350 B10R1.17 CCNCC1=CC=CC=C1 1366645 [1,1,0,0,0,0|1,0,1]=4 351 B10R1.17 ClC\C=C\C1=CC=CC=C1 5970146 [1,1,0,0,0,0|1,0,0]=3 352 B10R1.17 NCCOC1=CC=CC=C1 7020330514 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.17 NCCSC1=CC=CC=C1 6137840 [1,1,0,0,0,0|2,0,0]=4 354 B10R1.17 O=C\C=C\C1=CC=CC=C1 1778825 [1,1,0,0,0,0|1,0,1]=4 355 B10R1.17 OCCNC1=CC=CC=C1 1866520 [1,1,0,0,0,0|2,0,0]=4 356 B10R1.17 OCCOC1=CC=CC=C1 1275759 [1,1,0,0,0,0|2,0,0]=4 357 B10R1.17 SCCOC1=CC=CC=C1 1310591 [1,1,0,0,0,0|2,0,0]=4 358 B10R1.18 CC(=O)NC1=CC=CC=C1 0118671148 [1,1,0,0,0,0|2,0,0]=4 359 B10R1.18 CC(=O)OC1=CC=CC=C1 5970182 [1,1,0,0,0,0|2,0,0]=4 360 B10R1.18 CC(C)NC1=CC=CC=C1 1220423 [1,1,0,0,0,0|2,0,0]=4 361 B10R1.18 CN(C)CC1=CC=CC=C1 2827061 [1,1,0,0,0,0|1,0,1]=4 362 B10R1.11 CCOC(=O)C1=CSC=N1 2821504 [0,1,0,0,1,0|2,0,0]=4 363 B10R1.14 COC(=O)C1=CC=C(Br)O1 7214930010 [0,1,0,0,1,0|1,0,0]=3 364 B10R1.14 COC(=O)C1=NNC(C)=C1 2422976 [0,1,0,0,1,0|2,0,0]=4 365 B10R1.149 COC(=O)C1=C(C)C=CS1 2084295 [0,1,0,0,1,0|1,0,0]=3 366 B10R1.149 COC(=O)C1=C(N)C=CS1 2830652 [0,1,0,0,1,0|1,0,0]=3 367 B10R1.149 COC(=O)C1=C(N)SC=C1 1209883 [0,1,0,0,1,0|1,0,0]=3 368 B10R1.149 COC(=O)C1=C(O)C=CS1 7020542495 [0,1,0,0,1,0|1,0,0]=3 369 B12R1.32 CCOC(=O)CC1=CC=CC=C1 1902606 [0,1,0,0,0,1|0,0,0]=2 370 B12R1.32 COCC(=O)NC1=CC=CC=C1 5441566 [0,1,0,0,0,1|0,0,0]=2 371 B12R1.32 N#CCC(=O)NC1=CC=CC=C1 1179087 [0,1,0,0,0,1|1,0,1]=4 372 B12R1.32 O=C(CCCl)NC1=CC=CC=C1 1194691 [0,1,0,0,0,1|1,0,0]=3 373 B12R1.32 O=C(CCS)NC1=CC=CC=C1 1864080 [0,1,0,0,0,1|1,0,0]=3 374 B12R1.34 CCC(=O)N(C)C1=CC=CC=C1 7020290661 [0,1,0,0,0,1|1,0,0]=3 375 B12R1.34 CN(C(=O)CCl)C1=CC=CC=C1 1782314 [0,1,0,0,0,1|2,0,0]=4 376 B12R1.34 COC(=O)C(Br)C1=CC=CC=C1 3644543 [0,1,0,0,0,1|0,0,0]=2 377 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 2285152 [0,1,0,0,0,1|0,0,0]=2 378 B12R1.43 CC(Br)C(=O)NC1=CC=CC=C1 1897922 [0,1,0,0,0,1|1,0,0]=3 379 B12R1.49 CC1=CC=C(NC(=O)CCl)C=C1 0133160093 [0,1,0,0,0,1|2,0,0]=4 380 B12R1.49 CC1=CC=C(NC(=O)CO)C=C1 1015597 [0,1,0,0,0,1|2,0,0]=4 381 B12R1.49 CC1=CC=C(NC(=O)CS)C=C1 7414270004 [0,1,0,0,0,1|2,0,0]=4 382 B12R1.49 CC1=CC=C(OC(=O)CN)C=C1 1902649 [0,1,0,0,0,1|2,0,0]=4 383 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 0104820394 [0,1,0,0,0,1|1,0,0]=3 384 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 2318624 [0,1,0,0,0,1|0,0,0]=2 385 B12R1.49 O=C(CCl)NC1=CC=C(Br)C=C1 1195628 [0,1,0,0,0,1|2,0,0]=4 386 B12R1.49 O=C(CCl)NC1=CC=C(Cl)C=C1 0133160100 [0,1,0,0,0,1|2,0,0]=4 387 B12R1.49 O=C(CCl)NC1=CC=C(F)C=C1 0115030421 [0,1,0,0,0,1|2,0,0]=4 388 B12R1.49 O=C(CCl)NC1=CC=C(I)C=C1 4802721 [0,1,0,0,0,1|2,0,0]=4 389 B12R1.49 O=C(CO)NC1=CC=C(F)C=C1 1015636 [0,1,0,0,0,1|2,0,0]=4 390 B12R1.49 O=C(CS)NC1=CC=C(Br)C=C1 7414270017 [0,1,0,0,0,1|2,0,0]=4 391 B12R1.49 O=C(CS)NC1=CC=C(F)C=C1 7414270021 [0,1,0,0,0,1|2,0,0]=4 392 B12R1.50 CC1=CC(NC(=O)CCl)=CC=C1 1195627 [0,1,0,0,0,1|2,0,0]=4 393 B12R1.50 CC1=CC(OC(=O)CN)=CC=C1 1902648 [0,1,0,0,0,1|2,0,0]=4 394 B12R1.50 CC1=CC=CC(NC(=O)CN)=C1 7020691551 [0,1,0,0,0,1|2,0,0]=4 395 B12R1.50 CC1=CC=CC(NC(=O)CO)=C1 1015596 [0,1,0,0,0,1|2,0,0]=4 396 B12R1.50 CC1=CC=CC(NC(=O)CS)=C1 7414270003 [0,1,0,0,0,1|2,0,0]=4 397 B12R1.50 CCC(=O)NC1=CC=CC(O)=C1 0104820393 [0,1,0,0,0,1|1,0,0]=3 398 B12R1.50 O=C(CCl)NC1=CC(Cl)=CC=C1 1895474 [0,1,0,0,0,1|2,0,0]=4 399 B12R1.50 O=C(CCl)NC1=CC=CC(Br)=C1 7020410099 [0,1,0,0,0,1|2,0,0]=4 400 B12R1.50 O=C(CO)NC1=CC(Cl)=CC=C1 1015638 [0,1,0,0,0,1|2,0,0]=4 401 B12R1.371 CC1=CC=CC=C1NC(=O)CCl 1195626 [0,1,0,0,0,1|2,0,0]=4 402 B12R1.371 CC1=CC=CC=C1OC(=O)CN 1902647 [0,1,0,0,0,1|2,0,0]=4 403 B12R1.371 COC(=O)CC1=C(C)C=CC=C1 1902607 [0,1,0,0,0,1|0,0,0]=2 404 B12R1.371 COC(=O)CC1=C(F)C=CC=C1 1902759 [0,1,0,0,0,1|0,0,0]=2 405 B12R1.371 O=C(CCl)NC1=C(Cl)C=CC=C1 1195624 [0,1,0,0,0,1|2,0,0]=4 406 B12R1.371 O=C(CCl)NC1=C(F)C=CC=C1 1102825 [0,1,0,0,0,1|2,0,0]=4 407 B12R1.371 O=C(CCl)NC1=CC=CC=C1Br 1195637 [0,1,0,0,0,1|2,0,0]=4 408 B12R1.371 O=C(CCl)NC1=CC=CC=C1O 1894453 [0,1,0,0,0,1|2,0,0]=4 409 B12R1.9 CNS(=O)(=O)C1=CC=C(C)C=C1 2927698 [0,2,0,0,0,0|2,0,0]=4 410 B12R1.9 COS(=O)(=O)C1=CC=C(C)C=C1 2928838 [0,2,0,0,0,0|1,0,0]=3 411 B12R1.39 NCCS(=O)(=O)C1=CC=CC=C1 1047189 [0,2,0,0,0,0|2,0,0]=4 412 B12R1.253 CC(C)S(=O)(=O)C1=CC=CC=C1 6922306 [0,2,0,0,0,0|2,0,0]=4 413 B12R1.478 CC(C)C(C=O)C1=CC=CC=C1 1367104 [0,2,0,0,0,0|1,0,1]=4 414 B12R1.16 CCCC(=O)C1=CC=C(Cl)C=C1 1313072 [0,2,0,0,0,0|1,0,0]=3 415 B12R1.16 CCCC(=O)C1=CC=C(F)C=C1 1312993 [0,2,0,0,0,0|1,0,0]=3 416 B12R1.16 CCOC(=O)C1=CC=C(F)C=C1 2132107 [0,2,0,0,0,0|0,0,0]=2 417 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 1556375 [0,2,0,0,0,0|0,0,0]=2 418 B12R1.16 CCOC(=O)C1=NC=C(C)N=C1 2833381 [0,2,0,0,0,0|2,0,0]=4 419 B12R1.16 CCOC(=O)C1=NNC(=O)C=C1 7020649725 [0,2,0,0,0,0|2,0,0]=4 420 B12R1.16 O=C(CCBr)C1=CC=C(Br)C=C1 2014884 [0,2,0,0,0,0|1,0,0]=3 421 B12R1.17 CCOC(=O)C1=CC(N)=NC=C1 3672897 [0,2,0,0,0,0|1,0,0]=3 422 B12R1.17 CCOC(=O)C1=CC=CC(O)=C1 973252 [0,2,0,0,0,0|0,0,0]=2 423 B12R1.30 N#CCCC(=O)C1=CN=CC=C1 1361083 [0,2,0,0,0,0|2,0,0]=4 424 B12R1.30 N#CCOC(=O)C1=CC=CC=C1 2125372 [0,2,0,0,0,0|0,0,0]=2 425 B12R1.30 NCCNC(=O)C1=CC=CC=C1 1137843 [0,2,0,0,0,0|1,0,0]=3 426 B12R1.30 O=C(CCCCl)C1=CC=CC=C1 1368234 [0,2,0,0,0,0|1,0,0]=3 427 B12R1.30 O=C(NCCO)C1=CC=CC=C1 1272306 [0,2,0,0,0,0|1,0,0]=3 428 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 1902541 [0,2,0,0,0,0|1,0,0]=3 429 B12R1.107 CC(=O)\C=C(/[OH2+])C1=CC=CC=C1 7015160012 [0,2,0,0,0,0|1,0,1]=4 430 B12R1.107 CC(C)CC(=O)C1=CC=CC=C1 1367105 [0,2,0,0,0,0|1,0,0]=3 431 B12R1.107 O=C(C[N+](=O)[O-])C1=CC=CC=C1 11639257 [0,2,0,0,0,0|2,0,0]=4 432 B12R1.308 CCCC(=O)C1=C(F)C=CC=C1 1505986 [0,2,0,0,0,0|1,0,0]=3 433 B12R1.308 CCOC(=O)C1=C(C)C=CC=C1 2832924 [0,2,0,0,0,0|0,0,0]=2 434 B12R1.308 CCOC(=O)C1=C(N)C=CC=C1 1867347 [0,2,0,0,0,0|0,0,0]=2 435 B12R1.308 CCOC(=O)C1=CC=CN=C1N 7020542808 [0,2,0,0,0,0|1,0,0]=3 436 B12R1.308 CCOC(=O)C1=CC=NN=C1C 10355373 [0,2,0,0,0,0|2,0,0]=4 437 B12R1.5 CCC(=O)C1=CC=C(OC)C=C1 1043827 [0,2,0,0,0,0|1,0,0]=3 438 B12R1.5 CCC1=CC=C(C(=O)CCl)C=C1 1312905 [0,2,0,0,0,0|2,0,0]=4 439 B12R1.5 CNC(=O)C1=CC=C(OC)C=C1 5032238 [0,2,0,0,0,0|1,0,0]=3 440 B12R1.5 COC(=O)C1=CC=C(C=O)C=C1 7018801965 [0,2,0,0,0,0|0,0,0]=2 441 B12R1.5 COC(=O)C1=CC=C(CBr)C=C1 1444473 [0,2,0,0,0,0|0,0,0]=2 442 B12R1.5 COC(=O)C1=CC=C(CN)C=C1 1218432 [0,2,0,0,0,0|0,0,0]=2 443 B12R1.5 COC(=O)C1=CC=C(CN)C=C1 3037013 [0,2,0,0,0,0|0,0,0]=2 444 B12R1.5 COC(=O)C1=CN=C(C#N)C=C1 3671694 [0,2,0,0,0,0|1,0,0]=3 445 B12R1.5 COC(=O)C1=CN=C(CN)C=C1 6624346 [0,2,0,0,0,0|1,0,0]=3 446 B12R1.5 COC(=O)C1=NC=C(C=O)N=C1 7135549 [0,2,0,0,0,0|2,0,0]=4 447 B12R1.5 COC(=O)C1=NC=C(OC)N=C1 6051761 [0,2,0,0,0,0|2,0,0]=4 448 B12R1.5 COC1=CC=C(C(=O)CBr)C=C1 1106003 [0,2,0,0,0,0|2,0,0]=4 449 B12R1.5 COC1=CC=C(C(=O)CCl)C=C1 1313000 [0,2,0,0,0,0|2,0,0]=4 450 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 4435230 [0,2,0,0,0,0|2,0,0]=4 451 B12R1.5 COC1=CC=C(C(=O)NN)C=C1 7210740504 [0,2,0,0,0,0|2,0,0]=4 452 B12R1.20 CC(=O)C(=O)C1=CC=C(Br)C=C1 1981792 [0,2,0,0,0,0|1,0,0]=3 453 B12R1.20 CC(=O)C(=O)C1=CC=C(Cl)C=C1 1974702 [0,2,0,0,0,0|1,0,0]=3 454 B12R1.20 CC(=O)C(=O)C1=CC=C(F)C=C1 1973666 [0,2,0,0,0,0|1,0,0]=3 455 B12R1.20 CC(C)C(=O)C1=CC=C(Cl)C=C1 1043845 [0,2,0,0,0,0|1,0,0]=3 456 B12R1.20 CC(C)C(=O)C1=CC=C(F)C=C1 1043844 [0,2,0,0,0,0|1,0,0]=3 457 B12R1.20 CC1=CC=C(C(=O)C(C)Br)C=C1 2014750 [0,2,0,0,0,0|1,0,0]=3 458 B12R1.20 CC1=CC=C(C(=O)C(C)C)C=C1 1043837 [0,2,0,0,0,0|1,0,0]=3 459 B12R1.20 CN(C)C(=O)C1=CC=C(O)C=C1 0117380127 [0,2,0,0,0,0|1,0,0]=3 460 B12R1.20 O=C(C1=CC=C(Br)C=C1)C(O)O 7006448 [0,2,0,0,0,0|2,0,0]=4 461 B12R1.20 O=C(C1=CC=C(Cl)C=C1)C(Br)Br 5980483 [0,2,0,0,0,0|2,0,0]=4 462 B12R1.20 O=C(C1=CC=C(F)C=C1)C(O)O 13577356 [0,2,0,0,0,0|2,0,0]=4 463 B12R1.367 CC1=C(C)C=C(C(=O)CCl)C=C1 1313115 [0,2,0,0,0,0|2,0,0]=4 464 B12R1.367 CC1=CC=C(C(=O)CBr)C=C1C 3116512 [0,2,0,0,0,0|2,0,0]=4 465 B12R1.367 CCC(=O)C1=CC=C(C)C(C)=C1 1043821 [0,2,0,0,0,0|1,0,0]=3 466 B12R1.367 COC(=O)C1=CC(C)=C(N)C=C1 1867556 [0,2,0,0,0,0|0,0,0]=2 467 B12R1.367 COC(=O)C1=CC(Cl)=C(C)C=C1 22430653 [0,2,0,0,0,0|0,0,0]=2 468 B12R1.367 COC(=O)C1=CC(N)=C(C)C=C1 1867580 [0,2,0,0,0,0|0,0,0]=2 469 B12R1.367 COC(=O)C1=CC(N)=C(N)C=C1 2824057 [0,2,0,0,0,0|0,0,0]=2 470 B12R1.367 COC(=O)C1=CC=C(Cl)C(N)=C1 1218539 [0,2,0,0,0,0|0,0,0]=2 471 B12R1.367 COC(=O)C1=CC=C(N)C(O)=C1 1514173 [0,2,0,0,0,0|0,0,0]=2 472 B12R1.367 COC(=O)C1=CC=C(O)C(N)=C1 1516656 [0,2,0,0,0,0|0,0,0]=2 473 B12R1.367 NCC(=O)C1=CC(Cl)=C(Cl)C=C1 6595014 [0,2,0,0,0,0|2,0,0]=4 474 B12R1.367 O=C(CBr)C1=CC(Cl)=C(Cl)C=C1 3464025 [0,2,0,0,0,0|2,0,0]=4 475 B12R1.367 O=C(CCl)C1=CC(Cl)=C(Cl)C=C1 1313090 [0,2,0,0,0,0|2,0,0]=4 476 B12R1.367 O=C(CCl)C1=CC(F)=C(F)C=C1 1500736 [0,2,0,0,0,0|2,0,0]=4 477 B12R1.367 O=C(CCl)C1=CC(O)=C(O)C=C1 2930095 [0,2,0,0,0,0|2,0,0]=4 478 B12R1.1703 CC1=CC=C(C(=O)CCl)C(C)=C1 1306258 [0,2,0,0,0,0|2,0,0]=4 479 B12R1.1703 CCC(=O)C1=CC=C(C)C=C1C 1500446 [0,2,0,0,0,0|1,0,0]=3 480 B12R1.1703 CCC(=O)C1=CC=C(F)C=C1F 1902857 [0,2,0,0,0,0|1,0,0]=3 481 B12R1.1703 CNC(=O)C1=CC=C(N)C=C1Cl 1134991 [0,2,0,0,0,0|1,0,0]=3 482 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 0125160228 [0,2,0,0,0,0|0,0,0]=2 483 B12R1.1703 COC(=O)C1=C(O)C=C(O)N=C1 3673785 [0,2,0,0,0,0|1,0,0]=3 484 B12R1.1703 COC(=O)C1=CC=C(N)C=C1O 1867457 [0,2,0,0,0,0|0,0,0]=2 485 B12R1.1703 COC(=O)C1=CN=C(S)NC1=O 8653772 [0,2,0,0,0,0|2,0,0]=4 486 B12R1.1703 NC1=CC=C(C(=O)O[Na])C(O)=C1 22430613 [0,2,0,0,0,0|1,0,0]=3 487 B12R1.1703 NNC(=O)C1=CC=C(Cl)C=C1Cl 7217890083 [0,2,0,0,0,0|2,0,0]=4 488 B12R1.1703 O=C(CCl)C1=CC=C(O)C=C1O 1089662 [0,2,0,0,0,0|2,0,0]=4 489 B12R1.24 CCC(=O)C1=CC=CC(C)=C1C 1779859 [0,2,0,0,0,0|1,0,0]=3 490 B12R1.24 COC(=O)C1=C(Br)C(F)=CC=C1 9078751 [0,2,0,0,0,0|0,0,0]=2 491 B12R1.24 COC(=O)C1=CC=CC(C)=C1N 1220773 [0,2,0,0,0,0|0,0,0]=2 492 B12R1.24 COC(=O)C1=CC=CC(N)=C1O 3673134 [0,2,0,0,0,0|0,0,0]=2 493 B12R1.225 CN(C)C(=O)C1=CC=CC(N)=C1 0117380095 [0,2,0,0,0,0|1,0,0]=3 494 B12R1.354 CC1=CC=C(C)C(C(=O)CCl)=C1 1368233 [0,2,0,0,0,0|2,0,0]=4 495 B12R1.354 CCC(=O)C1=C(C)C=CC(Br)=C1 4804958 [0,2,0,0,0,0|1,0,0]=3 496 B12R1.354 CCC(=O)C1=CC(Cl)=CC=C1Cl 1313107 [0,2,0,0,0,0|1,0,0]=3 497 B12R1.354 CCC(=O)C1=CC(Cl)=CC=C1O 1782456 [0,2,0,0,0,0|1,0,0]=3 498 B12R1.354 COC(=O)C1=C(Cl)C=CC(N)=C1 7020693933 [0,2,0,0,0,0|0,0,0]=2 499 B12R1.354 COC(=O)C1=C(O)C=CC(N)=C1 1867531 [0,2,0,0,0,0|0,0,0]=2 500 B12R1.354 COC(=O)C1=CC(Br)=CC=C1O 0117381020 [0,2,0,0,0,0|0,0,0]=2 501 B12R1.354 COC(=O)C1=CC(Cl)=CC=C1O 0117381019 [0,2,0,0,0,0|0,0,0]=2 502 B12R1.354 COC(=O)C1=CC(N)=NC=C1Br 12482611 [0,2,0,0,0,0|1,0,0]=3 503 B12R1.354 COC(=O)C1=CC(O)=NC=C1Br 7135559 [0,2,0,0,0,0|1,0,0]=3 504 B12R1.354 COC(=O)C1=NC(N)=CC=C1Br 12482614 [0,2,0,0,0,0|1,0,0]=3 505 B12R1.358 COC(=O)C1=CC(Cl)=CC(Cl)=C1 3041352 [0,2,0,0,0,0|0,0,0]=2 506 B12R1.358 COC(=O)C1=CC(Cl)=NC(Cl)=C1 6902363 [0,2,0,0,0,0|1,0,0]=3 507 B12R1.358 COC(=O)C1=CC(O)=CC(O)=C1 7020640005 [0,2,0,0,0,0|0,0,0]=2 508 B12R1.435 CCC(=O)C1=CC=CC(C#N)=C1 1367000 [0,2,0,0,0,0|1,0,0]=3 509 B12R1.435 COC(=O)C1=CC(C#N)=NC=C1 5662525 [0,2,0,0,0,0|1,0,0]=3 510 B12R1.435 COC(=O)C1=CC(CN)=NC=C1 10354685 [0,2,0,0,0,0|1,0,0]=3 511 B12R1.435 COC1=CC(C(=O)CN)=CC=C1 11185346 [0,2,0,0,0,0|2,0,0]=4 512 B12R1.435 COC1=CC=CC(C(=O)CBr)=C1 2125400 [0,2,0,0,0,0|2,0,0]=4 513 B12R1.124 CN(C)C(=O)C1=CC=CC=C1N 0117380096 [0,2,0,0,0,0|1,0,0]=3 514 B12R1.124 CN(C)C(=O)C1=CC=CC=C1O 0117380125 [0,2,0,0,0,0|1,0,0]=3 515 B12R1.77 COC(=O)C1=C(C#N)N=CC=C1 3671693 [0,2,0,0,0,0|1,0,0]=3 516 B12R1.77 COC(=O)C1=C(C=O)C=CC=C1 2832870 [0,2,0,0,0,0|0,0,0]=2 517 B12R1.77 COC1=C(C(=O)CBr)C=CC=C1 2125404 [0,2,0,0,0,0|2,0,0]=4 518 B12R1.77 COC1=CC=CC=C1C(=O)NN 7117190031 [0,2,0,0,0,0|2,0,0]=4 519 B10R1.20 COC1=C(C=O)C=CC=C1 1180631 [0,0,1,1,0,0|2,0,0]=4 520 B10R1.27 COC(=O)CC1=CC=CS1 1973364 [0,0,1,1,0,0|1,0,1]=4 521 B10R1.172 COC1=CC=CC(C=O)=C1 1180630 [0,0,1,1,0,0|2,0,0]=4 522 B10R2.6 C1=CC=C(C2CN2)C=C1 4194135 [1,0,0,1,0,0|1,0,1]=4 523 B10R2.6 C1=CC=C(C2CO2)C=C1 1205184 [1,0,0,1,0,0|0,0,2]=4 524 B10R2.7 C1=CC2=C(C=C1)NCC2 2826118 [1,0,0,1,0,0|2,0,0]=4 525 B10R2.7 C1=CC2=C(C=C1)OCC2 2826125 [1,0,0,1,0,0|2,0,0]=4 526 B10R2.7 C1=CC=C2CCCC2=C1 1778681 [1,0,0,1,0,0|1,0,1]=4 527 B10R2.7 C1=CC=C2CNCC2=C1 2087229 [1,0,0,1,0,0|1,0,1]=4 528 B10R2.7 C1=CC=C2NC=CC2=C1 2826038 [1,0,0,1,0,0|2,0,0]=4 529 B10R2.7 C1=CC=C2NN=CC2=C1 1435639 [1,0,0,1,0,0|2,0,0]=4 530 B12R2.18 CC1=CC2=CC=CC=C2N1C 3458594 [0,0,0,1,0,1|2,0,0]=4 531 B12R2.18 CC1C(=O)NC2=C1C=CC=C2 4247509 [0,0,0,1,0,1|1,0,0]=3 532 B12R2.18 CN1C(=O)NC2=C1C=CC=C2 1435637 [0,0,0,1,0,1|1,0,0]=3 533 B12R2.18 CN1C(S)=NC2=C1C=CC=C2 7119620350 [0,0,0,1,0,1|1,1,0]=4 534 B12R2.18 NC1C(=O)NC2=C1C=CC=C2 6850887 [0,0,0,1,0,1|2,0,0]=4 535 B12R2.18 O=C1NC2=CC=CC=C2C1=O 2828769 [0,0,0,1,0,1|2,0,0]=4 536 B12R2.24 NC1=NC2=CC=CC=C2CS1 5009562 [0,0,0,1,0,1|1,1,0]=4 537 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 2828560 [0,0,0,1,0,1|1,0,1]=4 538 B12R2.24 O=C1C=NC2=CC=CC=C2N1 7020204758 [0,0,0,1,0,1|2,0,0]=4 539 B12R2.24 O=C1CCC2=C(C=CC=C2)O1 2819843 [0,0,0,1,0,1|1,0,0]=3 540 B12R2.24 O=C1CCC2=CC=CC=C2N1 1655132 [0,0,0,1,0,1|1,0,0]=3 541 B12R2.24 O=C1CNC2=CC=CC=C2N1 0111910003 [0,0,0,1,0,1|2,0,0]=4 542 B12R2.24 O=C1COC2=CC=CC=C2N1 7020041238 [0,0,0,1,0,1|2,0,0]=4 543 B12R2.24 O=C1CSC2=C(C=CC=C2)N1 7119930006 [0,0,0,1,0,1|2,0,0]=4 544 B12R2.32 CNC1=NC2=C(C=CC=C2)N1 1218388 [0,0,0,1,0,1|2,0,0]=4 545 B12R2.1 O=CC1=CNC2=CC=CC=C12 1107042 [0,1,0,1,0,0|2,0,0]=4 546 B12R2.1081 O=C1C=CNC2=CC=CC=C12 3644587 [0,1,0,1,0,0|1,0,1]=4 547 B12R2.1081 O=C1C=NNC2=CC=CC=C12 7020542795 [0,1,0,1,0,0|2,0,0]=4 548 B12R2.1081 O=C1CCCC2=C1C=CC=C2 1202501 [0,1,0,1,0,0|1,0,0]=3 549 B12R2.1081 O=C1CCNC2=CC=CC=C12 1366766 [0,1,0,1,0,0|1,0,0]=3 550 B12R2.1081 O=C1CCOC2=CC=CC=C12 1392616 [0,1,0,1,0,0|1,0,0]=3 551 B12R2.1081 O=C1NC=CC2=CC=CC=C12 1522001 [0,1,0,1,0,0|1,0,1]=4 552 B12R2.1081 O=C1NC=NC2=CC=CC=C12 7010010203 [0,1,0,1,0,0|1,0,1]=4 553 B12R2.1081 O=C1NN=CC2=C1C=CC=C2 3463424 [0,1,0,1,0,0|1,0,1]=4 554 B12R2.1081 O=C1NN=NC2=CC=CC=C12 7015160142 [0,1,0,1,0,0|2,0,0]=4 555 B12R2.2028 O=C1NC(=O)C2=CC=CC=C12 1195498 [0,1,0,1,0,0|1,0,1]=4 556 B12R2.2028 O=C1OC(=O)C2=CC=CC=C12 2828876 [0,1,0,1,0,0|0,0,1]=3 557 B12R2.2028 O=C1[N-]C(=O)C2=C1C=CC=C2 2889482 [0,1,0,1,0,0|1,0,1]=4 558 B12R2.2075 O=C(C1=CC=CC=C1)C2CC2 1041752 [0,1,0,1,0,0|1,0,0]=3 559 B12R2.612 NC1=CC2=C(C=C1)C(=O)OC2 3668641 [0,1,0,1,0,0|0,0,0]=2 560 B12R2.612 O=C1COC2=CC(O)=CC=C12 7014000096 [0,1,0,1,0,0|2,0,0]=4 561 B12R2.132 NC1=CC=C2CNC(=O)C2=C1 2212785 [0,1,0,1,0,0|1,0,0]=3 562 B12R2.132 O=C1CCC2=CC=C(Cl)C=C12 1202555 [0,1,0,1,0,0|1,0,0]=3 563 B12R2.196 O=C1CCC2=C(Cl)C=CC=C12 1202565 [0,1,0,1,0,0|1,0,0]=3 564 B12R2.196 O=C1CCC2=C(O)C=CC=C12 2828882 [0,1,0,1,0,0|1,0,0]=3 565 B8R1.7 C1=NC(C(=O)O)=CS1 1088027 [1,0,0,0,1,0|2,0,0]=4 566 B8R1.7 CC(=O)C1=CC=CO1 1778595 [1,0,0,0,1,0|1,0,0]=3 567 B8R1.7 CC(=O)C1=CC=CS1 14605036 [1,0,0,0,1,0|1,0,0]=3 568 B8R1.7 CC(=O)C1=CN=CS1 2422437 [1,0,0,0,1,0|2,0,0]=4 569 B8R1.7 O=C(Cl)C1=CC=CO1 1051704 [1,0,0,0,1,0|2,0,0]=4 570 B8R1.7 O=C(Cl)C1=CC=CS1 1051705 [1,0,0,0,1,0|2,0,0]=4 571 B8R1.7 O=C(O)C1=CC=CN1 2825772 [1,0,0,0,1,0|1,0,0]=3 572 B8R1.7 O=C(O)C1=CC=CO1 2825796 [1,0,0,0,1,0|1,0,0]=3 573 B8R1.7 O=C(O)C1=CC=CS1 1509751 [1,0,0,0,1,0|1,0,0]=3 574 B8R1.7 O=C(O)C1=CN=CO1 3488494 [1,0,0,0,1,0|2,0,0]=4 575 B8R1.7 O=C(O)C1=COC=C1 2825797 [1,0,0,0,1,0|1,0,0]=3 576 B8R1.7 O=C(O)C1=CSC=N1 2225865 [1,0,0,0,1,0|2,0,0]=4 577 B8R1.7 O=C(O)C1=NNC=C1 2128182 [1,0,0,0,1,0|2,0,0]=4 578 B12R1.27 COC(=O)CCC1=CN=CN=C1 7138613 [0,0,0,0,0,2|2,0,0]=4 579 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 11186114 [0,0,0,0,0,2|0,0,0]=2 580 B12R1.27 COC(=O)\C=C\C1=CN=CN=C1 7138612 [0,0,0,0,0,2|2,0,0]=4 581 B12R1.27 NNC(=O)COC1=CC=CC=C1 0103480076 [0,0,0,0,0,2|2,0,0]=4 582 B12R1.27 O=C(CBr)CCC1=CC=CC=C1 4764459 [0,0,0,0,0,2|2,0,0]=4 583 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 3585822 [0,0,0,0,0,2|2,0,0]=4 584 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 0104820635 [0,0,0,0,0,2|2,0,0]=4 585 B12R1.27 O=C(CO)NCC1=CC=CC=C1 1015681 [0,0,0,0,0,2|2,0,0]=4 586 B12R1.27 [NH3+]CC(=O)OCC1=CC=CC=C1 15298737 [0,0,0,0,0,2|2,0,0]=4