0 B10R1.1 C=CCC1=CC=C(C)C=C1 D76863 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.1 CC1=CC=C(SCCl)C=C1 T70798 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.1 CCCC1=CC=C(C)C=C1 D92007 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.1 CCNC1=CC=C(C)C=C1 D90452 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.1 CCNC1=NC=C(Br)C=C1 97201 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.1 CCOC1=CC=C(Cl)C=C1 D89219 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.1 CCOC1=CC=C(S)C=C1 AT20902 [0,0,0,0,0,0|2,1,0]=3 7 B10R1.1 CCOC1=NC=C(F)C=C1 D74953 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.1 CCOC1=NC=C(N)C=C1 O11589 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.1 CNCC1=CC=C(F)C=C1 26027 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.1 ClC1=CC=C(C#CI)C=C1 AT14282 [0,0,0,0,0,0|2,0,2]=4 11 B10R1.1 FC1=CC=C(C#CI)C=C1 AT14285 [0,0,0,0,0,0|2,0,2]=4 12 B10R1.1 FC1=CC=C(CCCl)C=C1 D90675 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.1 N#C[Se]C1=CC=C(Br)C=C1 97866 [0,0,0,0,0,0|2,0,2]=4 14 B10R1.1 NCCC1=CC=C(F)C=C1 D90699 [0,0,0,0,0,0|1,0,0]=1 15 B10R1.1 NCCC1=CC=C(F)C=C1 D90702 [0,0,0,0,0,0|1,0,0]=1 16 B10R1.1 NNCC1=CC=C(Br)C=C1 P10525 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.1 NNCC1=CC=C(Cl)C=C1 D86183 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.1 NNCC1=CC=C(F)C=C1 P10415 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.1 O=C=NC1=CC=C(Br)C=C1 D88673 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.1 BC1=CC=C(OC)C=C1 F10893 [1,0,0,0,0,0|2,0,0]=3 21 B9R1.1 C=CC1=CC=C(Cl)C=C1 W15543 [1,0,0,0,0,0|1,0,2]=4 22 B9R1.1 CC1=CC=C(CS)C=C1 D91373 [1,0,0,0,0,0|2,0,0]=3 23 B9R1.1 CC1=CC=C(NN)C=C1 W10666 [1,0,0,0,0,0|2,0,0]=3 24 B9R1.1 CCC1=CC=C(S)C=C1 H11883 [1,0,0,0,0,0|0,1,0]=2 25 B9R1.1 CCC1=CN=C(C)C=C1 D88165 [1,0,0,0,0,0|2,0,0]=3 26 B9R1.1 CSC1=CC=C(C)C=C1 D91411 [1,0,0,0,0,0|2,0,0]=3 27 B9R1.1 FC1=CC=C(CS)C=C1 AT13678 [1,0,0,0,0,0|2,0,0]=3 28 B9R1.1 NCC1=CC=C(F)C=C1 D90701 [1,0,0,0,0,0|1,0,0]=2 29 B9R1.1 NCC1=CC=C(O)C=C1 A10196 [1,0,0,0,0,0|0,0,0]=1 30 B9R1.1 NCC1=NC=C(Cl)C=N1 P10947 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.1 NNC1=CC=C(Cl)C=C1 O10106 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.1 O=CC1=CN=C(O)C=C1 BL005396 [1,0,0,0,0,0|2,0,1]=4 33 B9R1.1 SCC1=CC=C(Br)C=C1 A12220 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.8 CSCC1=CC=CC=C1 D88728 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.8 CSCC1=CN=CC=C1 E72352 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.8 C\C=C/C1=CC=CC=C1 D91456 [1,0,0,0,0,0|1,0,2]=4 37 B9R1.8 C\C=C\C1=CC=CC=C1 H10852 [1,0,0,0,0,0|1,0,2]=4 38 B9R1.8 ClCCC1=NC=CC=C1 D83590 [1,0,0,0,0,0|2,0,0]=3 39 B11R1.1 C#CCOC1=CC=C(Br)C=C1 C78146 [0,1,0,0,0,0|2,0,1]=4 40 B11R1.1 C#CCOC1=CC=C(C)C=C1 C78308 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.1 C=CCOC1=CC=C(C)C=C1 H10881 [0,1,0,0,0,0|2,0,1]=4 42 B11R1.1 CC1=CC=C(C#CCO)C=C1 A50686 [0,1,0,0,0,0|2,0,1]=4 43 B11R1.1 CCCOC1=CC=C(N)C=C1 71058 [0,1,0,0,0,0|2,0,0]=3 44 B11R1.1 CCCOC1=NC=C(Br)C=C1 F19674 [0,1,0,0,0,0|3,0,0]=4 45 B11R1.1 CNCCC1=CC=C(Cl)C=C1 29906 [0,1,0,0,0,0|1,0,0]=2 46 B11R1.1 CNCCC1=CC=C(F)C=C1 C15824 [0,1,0,0,0,0|1,0,0]=2 47 B11R1.1 CN\N=N\C1=CC=C(C)C=C1 A12264 [0,1,0,0,0,0|3,0,0]=4 48 B11R1.1 N#CCSC1=CC=C(Cl)C=C1 77531 [0,1,0,0,0,0|1,0,2]=4 49 B11R1.1 NC1=CC=C(CCCO)C=C1 A50572 [0,1,0,0,0,0|2,0,0]=3 50 B11R1.1 NCCCC1=CC=C(Br)C=C1 C78387 [0,1,0,0,0,0|1,0,0]=2 51 B11R1.1 NCCCC1=CC=C(F)C=C1 C77698 [0,1,0,0,0,0|1,0,0]=2 52 B11R1.1 NCCOC1=CC=C(Br)C=C1 C78109 [0,1,0,0,0,0|1,0,0]=2 53 B11R1.1 NCCOC1=CC=C(I)C=C1 C14896 [0,1,0,0,0,0|1,0,0]=2 54 B11R1.1 OCC#CC1=CC=C(Cl)C=C1 A50683 [0,1,0,0,0,0|2,0,1]=4 55 B11R1.1 OCC#CC1=CC=C(F)C=C1 A50677 [0,1,0,0,0,0|2,0,1]=4 56 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 D91021 [0,1,0,0,0,0|1,0,1]=3 57 B11R1.20 CC1=CC=C(CC(=O)Cl)C=C1 AC5981 [0,1,0,0,0,0|2,0,1]=4 58 B11R1.20 CC1=CC=C(OC(F)F)C=C1 F20986 [0,1,0,0,0,0|3,0,0]=4 59 B11R1.20 N=C(N)NC1=CC=C(Br)C=C1 D95501 [0,1,0,0,0,0|2,0,1]=4 60 B11R1.20 NC(=S)CC1=CC=C(Cl)C=C1 A10506 [0,1,0,0,0,0|1,0,1]=3 61 B11R1.20 O=C(Cl)CC1=CC=C(Cl)C=C1 S10930 [0,1,0,0,0,0|2,0,1]=4 62 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 28966 [0,1,0,0,0,0|2,0,1]=4 63 B11R1.22 C=C[C@H](O)C1=CC=C(F)C=C1 D87378 [0,1,0,0,0,0|2,0,1]=4 64 B11R1.22 CCN(N)C1=CC=C(C)C=C1 D90542 [0,1,0,0,0,0|3,0,0]=4 65 B11R1.22 CC[C@H](O)C1=CC=C(C)C=C1 N12074 [0,1,0,0,0,0|2,0,0]=3 66 B11R1.22 CC[C@H](O)C1=CC=C(Cl)C=C1 N12135 [0,1,0,0,0,0|2,0,0]=3 67 B11R1.22 CC[C@H](O)C1=CC=C(F)C=C1 N11970 [0,1,0,0,0,0|2,0,0]=3 68 B11R1.22 CN[C@@H](C)C1=CC=C(C)C=C1 N12436 [0,1,0,0,0,0|3,0,0]=4 69 B11R1.22 C[C@H](C#N)C1=CC=C(N)C=C1 C15494 [0,1,0,0,0,0|1,0,2]=4 70 B11R1.22 C\C(=N/O)C1=CC=C(O)C=C1 44467 [0,1,0,0,0,0|2,0,1]=4 71 B11R1.22 N#C[C@@H](O)C1=CC=C(O)C=C1 D90902 [0,1,0,0,0,0|0,0,2]=3 72 B11R1.22 NC[C@H](O)C1=CC=C(Br)C=C1 79799 [0,1,0,0,0,0|1,0,0]=2 73 B11R1.22 NC[C@H](O)C1=CC=C(Cl)C=C1 AR2879 [0,1,0,0,0,0|1,0,0]=2 74 B11R1.22 OC[C@H](Cl)C1=CC=C(Cl)C=C1 58244 [0,1,0,0,0,0|2,0,0]=3 75 B11R1.22 O[C@@H](CCl)C1=CC=C(F)C=C1 D97158 [0,1,0,0,0,0|2,0,0]=3 76 B11R1.81 CNCC1=C(C)C=C(C)C=C1 C78452 [0,1,0,0,0,0|3,0,0]=4 77 B11R1.81 CNCC1=C(F)C=C(Br)C=C1 N11594 [0,1,0,0,0,0|3,0,0]=4 78 B11R1.81 FC1=CC(F)=C(CCBr)C=C1 C78053 [0,1,0,0,0,0|2,0,0]=3 79 B11R1.83 CCC1=CC=C(CCN)C=C1 C78380 [0,1,0,0,0,0|1,0,0]=2 80 B11R1.83 CCOC1=CC=C(CBr)C=C1 O10318 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.83 COC1=CC=C(CCN)C=C1 30800 [0,1,0,0,0,0|0,0,0]=1 82 B11R1.83 CSC1=CC=C(CC#N)C=C1 W13500 [0,1,0,0,0,0|0,1,2]=4 83 B11R1.192 CNCC1=CC(Cl)=C(Cl)C=C1 74960 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.192 N#CCC1=CC(Cl)=C(Br)C=C1 F13315 [0,1,0,0,0,0|1,0,2]=4 85 B11R1.192 NCCC1=CC(O)=C(O)C=C1 F21485 [0,1,0,0,0,0|0,0,0]=1 86 B11R2.34 ClC1=CC=C([C@@H]2CO2)C=C1 58242 [0,0,0,1,0,0|2,0,0]=3 87 B11R2.34 FC1=CC=C([C@@H]2CO2)C=C1 V10033 [0,0,0,1,0,0|2,0,0]=3 88 B11R2.36 BrC1=CC2=C(C=C1)NCC2 F13820 [0,0,0,1,0,0|3,0,0]=4 89 B11R2.36 ClC1=CC2=C(C=C1)N=CN2 71658 [0,0,0,1,0,0|2,0,1]=4 90 B11R2.36 NC1=CC2=C(C=C1)N=CN2 F11742 [0,0,0,1,0,0|2,0,1]=4 91 B11R2.36 NC1=CC2=C(C=C1)N=NN2 D81725 [0,0,0,1,0,0|3,0,0]=4 92 B11R2.36 O=C1C=CC2=CNNC2=C1 29235 [0,0,0,1,0,0|1,0,2]=4 93 B11R2.36 OC1=CC2=C(C=C1)NCC2 F19200 [0,0,0,1,0,0|2,0,0]=3 94 B9R1.7 NCCN1C=C(Cl)C=N1 AT16046 [0,0,0,0,1,0|3,0,0]=4 95 B8R1.2 BrCC1=NC=CC=C1 D87709 [2,0,0,0,0,0|2,0,0]=4 96 B8R1.2 C#CC1=CC=CC=C1 D90456 [2,0,0,0,0,0|0,0,2]=4 97 B8R1.2 CCC1=CC=CN=C1 D87724 [2,0,0,0,0,0|1,0,0]=3 98 B8R1.2 CCC1=CC=NC=C1 D90449 [2,0,0,0,0,0|1,0,0]=3 99 B8R1.2 CCC1=NC=CC=C1 AT23190 [2,0,0,0,0,0|1,0,0]=3 100 B8R1.2 ClCC1=CC=NC=C1 D88171 [2,0,0,0,0,0|2,0,0]=4 101 B8R1.2 ICC1=CN=CC=C1 AC6646 [2,0,0,0,0,0|2,0,0]=4 102 B8R1.2 NCC1=CC=CC=C1 T70936 [2,0,0,0,0,0|0,0,0]=2 103 B8R1.2 NCC1=CN=CN=C1 P15266 [2,0,0,0,0,0|2,0,0]=4 104 B8R1.2 NNC1=CC=CC=C1 D91920 [2,0,0,0,0,0|1,0,0]=3 105 B8R1.2 NNC1=CC=NC=C1 76124 [2,0,0,0,0,0|2,0,0]=4 106 B8R1.2 NNC1=CC=NC=C1 W10667 [2,0,0,0,0,0|2,0,0]=4 107 B8R1.3 CC1=NN=C(O)C=C1 P10046 [2,0,0,0,0,0|2,0,0]=4 108 B8R1.3 NC1=CC=C(F)C=C1 D78529 [2,0,0,0,0,0|1,0,0]=3 109 B8R1.3 NC1=CC=C(N)C=C1 D92210 [2,0,0,0,0,0|1,0,0]=3 110 B8R1.3 NC1=CN=C(I)C=C1 C15518 [2,0,0,0,0,0|2,0,0]=4 111 B8R1.3 NC1=CN=C(N)C=C1 A10321 [2,0,0,0,0,0|2,0,0]=4 112 B8R1.3 NC1=CN=C(N)C=C1 O12059 [2,0,0,0,0,0|2,0,0]=4 113 B8R1.3 NC1=CN=C(O)C=C1 A11653 [2,0,0,0,0,0|1,0,0]=3 114 B8R1.3 NC1=NC=C(O)C=C1 F16234 [2,0,0,0,0,0|1,0,0]=3 115 B8R1.3 OC1=CN=C(O)C=C1 O12060 [2,0,0,0,0,0|2,0,0]=4 116 B10R1.3 C=CC1=CC=C(CN)C=C1 CK2398 [1,1,0,0,0,0|1,0,0]=3 117 B10R1.3 CCC1=CC=C(CC)C=C1 D88164 [1,1,0,0,0,0|1,0,0]=3 118 B10R1.3 CSC1=CC=C(CBr)C=C1 79951 [1,1,0,0,0,0|1,1,0]=4 119 B10R1.3 CSC1=CC=C(CN)C=C1 AT20993 [1,1,0,0,0,0|0,1,0]=3 120 B10R1.13 C=C(C)C1=CC=C(Br)C=C1 AC1305 [1,1,0,0,0,0|1,0,1]=4 121 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 N12036 [1,1,0,0,0,0|1,0,0]=3 122 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 D97156 [1,1,0,0,0,0|1,0,0]=3 123 B10R1.13 CN(C)C1=CC=C(N)C=C1 D89717 [1,1,0,0,0,0|2,0,0]=4 124 B10R1.13 C[C@H](Cl)C1=CC=C(Br)C=C1 W15990 [1,1,0,0,0,0|1,0,0]=3 125 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 61144 [1,1,0,0,0,0|1,0,0]=3 126 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 N11998 [1,1,0,0,0,0|1,0,0]=3 127 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 Y10878 [1,1,0,0,0,0|0,0,0]=2 128 B10R1.13 C[S+](C)C1=CC=C(O)C=C1 D90991 [1,1,0,0,0,0|1,0,0]=3 129 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 F13696 [1,1,0,0,0,0|1,0,1]=4 130 B10R1.25 CC1=CC(Br)=C(NN)C=C1 H11426 [1,1,0,0,0,0|2,0,0]=4 131 B10R1.25 CC1=CC(C)=C(NN)C=C1 S11306 [1,1,0,0,0,0|2,0,0]=4 132 B10R1.25 CCC1=C(C)C=C(C)C=C1 T73021 [1,1,0,0,0,0|1,0,0]=3 133 B10R1.25 CNC1=C(F)C=C(F)C=C1 F11384 [1,1,0,0,0,0|2,0,0]=4 134 B10R1.25 COC1=C(Br)C=C(N)C=C1 C13363 [1,1,0,0,0,0|2,0,0]=4 135 B10R1.25 COC1=C(Cl)C=C(N)C=C1 CL8418 [1,1,0,0,0,0|2,0,0]=4 136 B10R1.25 COC1=C(Cl)C=C(O)C=C1 D82682 [1,1,0,0,0,0|1,0,0]=3 137 B10R1.25 COC1=C(N)C=C(N)C=C1 E10142 [1,1,0,0,0,0|2,0,0]=4 138 B10R1.25 ClC1=CC(Br)=C(CBr)C=C1 N10597 [1,1,0,0,0,0|2,0,0]=4 139 B10R1.25 NC1=CC(Cl)=C(CO)C=C1 A50711 [1,1,0,0,0,0|2,0,0]=4 140 B10R1.25 NNC1=C(Cl)C=C(Cl)C=C1 D88055 [1,1,0,0,0,0|2,0,0]=4 141 B10R1.25 OCC1=C(Cl)C=C(Br)C=C1 93736 [1,1,0,0,0,0|2,0,0]=4 142 B10R1.176 CCC1=CC(O)=C(N)C=C1 D82162 [1,1,0,0,0,0|1,0,0]=3 143 B10R1.176 CN1C=CC(CN)=CC1=O P11874 [1,1,0,0,0,0|2,0,0]=4 144 B10R1.176 COC1=CC(Br)=C(N)C=C1 F20764 [1,1,0,0,0,0|2,0,0]=4 145 B10R1.176 COC1=CC(F)=C(N)C=C1 75541 [1,1,0,0,0,0|2,0,0]=4 146 B10R1.176 COC1=CC(I)=C(N)C=C1 D87380 [1,1,0,0,0,0|2,0,0]=4 147 B10R1.176 CSC1=CC(F)=C(Br)C=C1 A10661 [1,1,0,0,0,0|2,0,0]=4 148 B10R1.176 ClC1=C(Br)C=C(CBr)C=C1 D95462 [1,1,0,0,0,0|2,0,0]=4 149 B10R1.176 ClCC1=CC(Cl)=C(Cl)C=C1 75667 [1,1,0,0,0,0|2,0,0]=4 150 B10R1.176 NCC1=CC(F)=C(Cl)C=C1 N12136 [1,1,0,0,0,0|1,0,0]=3 151 B10R1.176 NNC1=CC(Cl)=C(F)C=C1 75787 [1,1,0,0,0,0|2,0,0]=4 152 B10R1.176 NNC1=CC(F)=C(F)C=C1 F12482 [1,1,0,0,0,0|2,0,0]=4 153 B10R1.176 O=C1C=C(C[O-])OC=C1O T72850 [1,1,0,0,0,0|2,0,0]=4 154 B10R1.4 C=CCC1=C(C)C=CC=C1 D97323 [1,1,0,0,0,0|1,0,1]=4 155 B10R1.4 C=CCC1=C(N)C=CC=C1 D88543 [1,1,0,0,0,0|1,0,1]=4 156 B10R1.4 CC1=C(N=NN)C=CC=C1 D88287 [1,1,0,0,0,0|2,0,0]=4 157 B10R1.4 CCCC1=C(O)C=CC=C1 D86075 [1,1,0,0,0,0|1,0,0]=3 158 B10R1.4 CCOC1=C(Cl)C=CC=C1 D89218 [1,1,0,0,0,0|2,0,0]=4 159 B10R1.4 CCOC1=C(N)C=CC=C1 D91895 [1,1,0,0,0,0|2,0,0]=4 160 B10R1.4 COCC1=C(Br)C=CC=C1 CK2442 [1,1,0,0,0,0|2,0,0]=4 161 B10R1.4 NCCC1=C(N)C=CC=C1 51438 [1,1,0,0,0,0|0,0,0]=2 162 B10R1.4 NCCN1C=CC=CC1=O AT13457 [1,1,0,0,0,0|1,0,0]=3 163 B10R1.4 NOCC1=C(Cl)C=CC=C1 D87707 [1,1,0,0,0,0|1,0,0]=3 164 B10R1.4 N\N=C\C1=C(O)C=CC=C1 F15584 [1,1,0,0,0,0|1,0,1]=4 165 B10R1.4 OC1=C(CCBr)C=CC=C1 C78317 [1,1,0,0,0,0|1,0,0]=3 166 B10R1.10 CCCC1=CC(C)=CC=C1 D92006 [1,1,0,0,0,0|1,0,0]=3 167 B10R1.10 CCOC1=CC(O)=CC=C1 CK1178 [1,1,0,0,0,0|2,0,0]=4 168 B10R1.10 CCSC1=CC=CC(Br)=C1 AT20878 [1,1,0,0,0,0|2,0,0]=4 169 B10R1.10 CNCC1=CC=CC(Cl)=C1 L10045 [1,1,0,0,0,0|2,0,0]=4 170 B10R1.10 NNCC1=CC=CC(Br)=C1 P10524 [1,1,0,0,0,0|1,0,0]=3 171 B10R1.10 NNCC1=CC=CC(Cl)=C1 74963 [1,1,0,0,0,0|1,0,0]=3 172 B10R1.10 NNCC1=CC=CC(F)=C1 75838 [1,1,0,0,0,0|1,0,0]=3 173 B10R1.15 C=C[C@H](O)C1=CC=CC=C1 AB10386 [1,1,0,0,0,0|1,0,1]=4 174 B10R1.15 CCN(N)C1=CC=CC=C1 F14622 [1,1,0,0,0,0|2,0,0]=4 175 B10R1.15 CC[C@H](C)C1=CC=CC=C1 N11903 [1,1,0,0,0,0|1,0,0]=3 176 B10R1.15 C[C@@H](CBr)C1=CC=CC=C1 C80054 [1,1,0,0,0,0|1,0,0]=3 177 B10R1.15 C[C@@H](CO)C1=CC=CC=C1 AT25357 [1,1,0,0,0,0|1,0,0]=3 178 B10R1.15 C[C@@H](CO)C1=CC=CC=C1 AT25361 [1,1,0,0,0,0|1,0,0]=3 179 B10R1.15 C\C(=N/N)C1=CC=CC=C1 I11141 [1,1,0,0,0,0|1,0,1]=4 180 B10R1.15 N#C[C@@H](N)C1=CC=CC=C1 N11950 [1,1,0,0,0,0|0,0,2]=4 181 B10R1.17 C=CCCC1=CC=CC=C1 D91916 [1,1,0,0,0,0|1,0,0]=3 182 B10R1.17 CCC#CC1=CC=CC=C1 D91952 [1,1,0,0,0,0|1,0,1]=4 183 B10R1.17 COCCC1=NC=CC=C1 D91306 [1,1,0,0,0,0|2,0,0]=4 184 B10R1.17 NCC#CC1=CC=CC=C1 AB10165 [1,1,0,0,0,0|0,0,1]=3 185 B10R1.17 NCCNC1=NC=CC=C1 C78639 [1,1,0,0,0,0|1,0,0]=3 186 B10R1.17 NCCNC1=NC=CC=N1 O12010 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.17 NCCNC1=NC=CN=C1 O12008 [1,1,0,0,0,0|2,0,0]=4 188 B10R1.17 NCCOC1=CN=CC=C1 E71907 [1,1,0,0,0,0|1,0,0]=3 189 B10R1.17 OCCNC1=CC=NC=C1 AT18123 [1,1,0,0,0,0|2,0,0]=4 190 B10R1.18 C[C@H](Br)CC1=CC=CC=C1 75436 [1,1,0,0,0,0|1,0,0]=3 191 B10R1.18 C[C@H](N)CC1=CC=CN=C1 S12145 [1,1,0,0,0,0|1,0,0]=3 192 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 AT26580 [1,1,0,0,0,0|2,0,0]=4 193 B12R1.1 CC1=CC=C(OCCCN)C=C1 AC6263 [0,2,0,0,0,0|1,0,0]=3 194 B12R1.1 CNCCOC1=CC=C(N)C=C1 C78105 [0,2,0,0,0,0|1,0,0]=3 195 B12R1.1 ClCCCSC1=CC=C(Br)C=C1 71101 [0,2,0,0,0,0|2,0,0]=4 196 B12R1.1 O=C=NCCC1=CC=C(F)C=C1 A12731 [0,2,0,0,0,0|1,0,1]=4 197 B12R1.1 OCCCCC1=CC=C(Br)C=C1 F13982 [0,2,0,0,0,0|2,0,0]=4 198 B12R1.16 CNC[C@H](O)C1=CC=C(O)C=C1 70046 [0,2,0,0,0,0|0,0,0]=2 199 B12R1.16 COCC(=O)C1=CC=C(O)C=C1 C74644 [0,2,0,0,0,0|1,0,1]=4 200 B12R1.16 N[C@@H](CCO)C1=CC=C(Br)C=C1 55911 [0,2,0,0,0,0|2,0,0]=4 201 B12R1.21 CC(C)CNC1=CC=C(Br)C=C1 F53163 [0,2,0,0,0,0|2,0,0]=4 202 B12R1.21 CC1=CC=C(OC[C@H](C)O)C=C1 D91440 [0,2,0,0,0,0|2,0,0]=4 203 B12R1.21 N=C(N)NCC1=CC=C(N)C=C1 AC8833 [0,2,0,0,0,0|1,0,1]=4 204 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 D90832 [0,2,0,0,0,0|1,0,1]=4 205 B12R1.69 ClC1=CC(Cl)=C(OCCBr)C=C1 76852 [0,2,0,0,0,0|2,0,0]=4 206 B12R1.69 OCCOC1=C(Cl)C=C(Cl)C=C1 W10510 [0,2,0,0,0,0|2,0,0]=4 207 B12R1.71 COC1=CC=C(C#CCO)C=C1 A50681 [0,2,0,0,0,0|1,0,1]=4 208 B12R1.71 COC1=CC=C(CN=[N+]=[N-])C=C1 D87636 [0,2,0,0,0,0|1,0,1]=4 209 B12R1.71 COC1=CC=C(CNC#N)C=C1 E72121 [0,2,0,0,0,0|0,0,2]=4 210 B12R1.71 OCC1=CC=C(OCCBr)C=C1 E71728 [0,2,0,0,0,0|1,0,0]=3 211 B12R1.385 CNCCC1=CC(O)=C(O)C=C1 H12011 [0,2,0,0,0,0|0,0,0]=2 212 B12R1.385 NCCCC1=CC(Cl)=C(Cl)C=C1 VT1067 [0,2,0,0,0,0|1,0,0]=3 213 B12R1.4 COC1=CC=C(CC(=N)N)C=C1 71303 [0,2,0,0,0,0|0,0,1]=3 214 B12R1.4 COC1=CC=C(NC(N)=O)C=C1 D97658 [0,2,0,0,0,0|1,0,1]=4 215 B12R1.20 C[C@H](N)[C@H](O)C1=CC=C(Cl)C=C1 AC8012 [0,2,0,0,0,0|1,0,0]=3 216 B12R1.106 CC(C)(N)CC1=CC=C(F)C=C1 75091 [0,2,0,0,0,0|1,0,0]=3 217 B12R1.106 CC1=CC=C(CC(C)(C)O)C=C1 D78400 [0,2,0,0,0,0|2,0,0]=4 218 B12R1.106 FC(F)(F)CC1=CC=C(Br)C=C1 72051 [0,2,0,0,0,0|2,0,0]=4 219 B12R1.106 O=P(O)(O)CC1=CC=C(O)C=C1 T73053 [0,2,0,0,0,0|2,0,0]=4 220 B12R1.5 CC[C@H](O)C1=CC=C(OC)C=C1 N12428 [0,2,0,0,0,0|1,0,0]=3 221 B12R1.5 CN[C@@H](C)C1=CC=C(OC)C=C1 N12139 [0,2,0,0,0,0|2,0,0]=4 222 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 W17814 [0,2,0,0,0,0|0,0,1]=3 223 B12R1.367 CC1=C(O)C=CC(C(=O)CBr)=C1 C15775 [0,2,0,0,0,0|1,0,1]=4 224 B12R1.367 CC[C@H](N)C1=CC(C)=C(C)C=C1 N10936 [0,2,0,0,0,0|2,0,0]=4 225 B12R1.367 NCC(=O)C1=CC(Cl)=C(Cl)C=C1 93654 [0,2,0,0,0,0|1,0,1]=4 226 B12R1.367 NC[C@H](O)C1=CC(O)=C(O)C=C1 A12631 [0,2,0,0,0,0|0,0,0]=2 227 B12R1.367 O[C@@H](CCl)C1=CC(Cl)=C(Cl)C=C1 D97157 [0,2,0,0,0,0|2,0,0]=4 228 B12R1.1703 CC[C@H](N)C1=C(C)C=C(C)C=C1 N10937 [0,2,0,0,0,0|2,0,0]=4 229 B12R1.1703 O[C@@H](CCl)C1=C(F)C=C(F)C=C1 D97161 [0,2,0,0,0,0|2,0,0]=4 230 B12R1.113 CCCC1=CC=C(C(=O)Cl)C=C1 F20464 [0,2,0,0,0,0|1,0,1]=4 231 B12R1.113 CCCC1=CC=C([N+](=O)[O-])C=C1 D85876 [0,2,0,0,0,0|1,0,1]=4 232 B12R1.113 CCNC1=CC=C(C(=O)O)C=C1 CK2248 [0,2,0,0,0,0|2,0,0]=4 233 B12R1.113 NCCC1=CC=C([N+](=O)[O-])C=C1 AB7683 [0,2,0,0,0,0|0,0,1]=3 234 B12R1.116 CCOC1=CC=C(CCN)C=C1 C78368 [0,2,0,0,0,0|0,0,0]=2 235 B12R1.116 OCCC1=CC=C(CCO)C=C1 T70987 [0,2,0,0,0,0|1,0,0]=3 236 B12R1.288 COC1=C(Cl)C=C(CCN)C=C1 AT26592 [0,2,0,0,0,0|0,0,0]=2 237 B12R1.288 COC1=C(F)C=C(CCN)C=C1 D87617 [0,2,0,0,0,0|0,0,0]=2 238 B12R1.286 COC1=C(O)C=CC(CC#N)=C1 E72174 [0,2,0,0,0,0|0,0,2]=4 239 B12R1.286 COC1=C(O)C=CC(CCN)=C1 52802 [0,2,0,0,0,0|0,0,0]=2 240 B12R2.24 BrC1=CC2=C(C=C1)NCCC2 SC1104 [0,1,0,1,0,0|2,0,0]=4 241 B12R2.24 BrC1=CC2=C(C=C1)NCCS2 77076 [0,1,0,1,0,0|2,0,0]=4 242 B12R2.24 BrC1=CC2=C(C=C1)SCCN2 77077 [0,1,0,1,0,0|1,0,0]=3 243 B12R2.24 ClC1=CC2=C(C=C1)NCCC2 Y10693 [0,1,0,1,0,0|2,0,0]=4 244 B12R2.24 ClC1=CC2=C(C=C1)OCCO2 78110 [0,1,0,1,0,0|2,0,0]=4 245 B12R2.24 FC1=CC2=C(C=C1)OCCN2 26344 [0,1,0,1,0,0|1,0,0]=3 246 B12R2.24 IC1=CC2=C(C=C1)OCCO2 I10085 [0,1,0,1,0,0|2,0,0]=4 247 B12R2.24 NC1=CC2=C(C=C1)CCCC2 AB10169 [0,1,0,1,0,0|2,0,0]=4 248 B12R2.24 OC1=CC2=C(C=C1)CCNC2 O10335 [0,1,0,1,0,0|0,0,0]=2 249 B12R2.132 N[C@H]1CCC2=C1C=C(O)C=C2 N10909 [0,1,0,1,0,0|0,0,0]=2 250 B12R2.132 N[C@H]1COC2=C1C=C(F)C=C2 59809 [0,1,0,1,0,0|1,0,0]=3 251 B12R2.606 O=C1CC2=C(C=C(O)C=C2)N1 S11541 [0,1,0,1,0,0|0,0,1]=3 252 B12R2.290 CC1=CC=C(C2(N)CC2)C=C1 N12313 [0,1,0,1,0,0|2,0,0]=4 253 B8R1.8 CCCC1=CC=CO1 D92136 [1,0,0,0,1,0|2,0,0]=4 254 B8R1.8 NCCC1=CC=CS1 F14846 [1,0,0,0,1,0|1,0,0]=3 255 B8R1.8 OCCN1C=CC=C1 T72813 [1,0,0,0,1,0|2,0,0]=4