0 B11R1.83 C=CC1=CC=C(CCC)C=C1 BB01-8159 [0,0,0,0,0,0|1,0,3]=4 1 B11R1.83 CCC1=CC=C(N=C=O)C=C1 BB01-6505 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.83 CCC1=CC=C(N=C=S)C=C1 BB01-8177 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.83 CCC1=CC=C(N=S=O)C=C1 BB58-0228 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.83 CNCC1=CC=C(OC)C=C1 BB58-0563 [0,0,0,0,0,0|1,0,1]=2 5 B11R1.83 COC1=CC=C(CC#N)C=C1 BB17-2807 [0,0,0,0,0,0|1,0,1]=2 6 B11R1.83 COC1=CC=C(N=C=O)C=C1 BB58-0027 [0,0,0,0,0,0|2,0,1]=3 7 B11R1.83 COC1=CC=C(N=C=S)C=C1 BB17-0166 [0,0,0,0,0,0|2,0,1]=3 8 B11R1.83 COC1=CC=C(N=S=O)C=C1 BB58-0212 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.83 CSC1=CC=C(N=C=O)C=C1 BB01-6582 [0,0,0,0,0,0|2,1,1]=4 10 B10R1.1 CC1=CC=C(N=C=S)C=C1 BB17-0178 [1,0,0,0,0,0|2,0,1]=4 11 B10R1.1 CC1=CC=C(N=S=O)C=C1 BB58-0235 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.1 CCNC1=CC=C(C)C=C1 BB01-3200 [1,0,0,0,0,0|1,0,2]=4 13 B10R1.1 CNCC1=CC=C(C)C=C1 BB58-0561 [1,0,0,0,0,0|1,0,1]=3 14 B10R1.1 CNCC1=CC=C(Cl)C=C1 BB58-0564 [1,0,0,0,0,0|2,0,1]=4 15 B10R1.1 FC1=CC=C(CCBr)C=C1 BB20-2544 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.1 NC1=CC=C(CCO)C=C1 BB01-6117 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.3 CCC1=CC=C(CN)C=C1 BB55-3614 [1,0,0,0,0,0|2,0,0]=3 18 B10R1.3 CNC1=CC=C(OC)C=C1 BB57-6647 [1,0,0,0,0,0|1,0,1]=3 19 B10R1.3 CSC1=CC=C(C=O)C=C1 BB17-2315 [1,0,0,0,0,0|1,1,0]=3 20 B10R1.3 CSC1=CC=C(CN)C=C1 BB01-5302 [1,0,0,0,0,0|1,1,0]=3 21 B10R1.3 N#CC1=CC=C(C=O)C=C1 BB01-6198 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.3 N#CC1=CC=C(CBr)C=C1 BB55-6360 [1,0,0,0,0,0|3,0,0]=4 23 B10R1.3 NCC1=CC=C(CBr)C=C1 BB55-7303 [1,0,0,0,0,0|3,0,0]=4 24 B12R1.4 COC1=CC=C(NC(=N)N)C=C1 BB01-2603 [0,1,0,0,0,0|2,0,0]=3 25 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 BB20-0241 [0,1,0,0,0,0|1,0,1]=3 26 B12R1.4 COC1=CC=C(NC(N)=O)C=C1 BB01-2858 [0,1,0,0,0,0|2,0,0]=3 27 B12R1.4 COC1=CC=C(NC(N)=S)C=C1 BB17-2703 [0,1,0,0,0,0|2,0,0]=3 28 B12R1.4 NNC1=CC=C(CC(=O)O)C=C1 BB55-4619 [0,1,0,0,0,0|3,0,0]=4 29 B12R1.5 CCC(=O)C1=CC=C(OC)C=C1 BB01-4890 [0,1,0,0,0,0|0,0,3]=4 30 B12R1.5 CCC(N)C1=CC=C(OC)C=C1 BB01-4902 [0,1,0,0,0,0|0,0,2]=3 31 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 BB58-1714 [0,1,0,0,0,0|1,0,2]=4 32 B12R1.5 COC1=CC=C(C(=O)NN)C=C1 BB01-3789 [0,1,0,0,0,0|2,0,1]=4 33 B12R1.5 COC1=CC=C(\C(N)=N\O)C=C1 BB01-2751 [0,1,0,0,0,0|2,0,1]=4 34 B12R1.71 C=CCOC1=CC=C(C=O)C=C1 BB55-0799 [0,1,0,0,0,0|2,0,0]=3 35 B12R1.71 CCC1=CC=C(OCCN)C=C1 BB55-4811 [0,1,0,0,0,0|2,0,1]=4 36 B12R1.71 COC1=CC=C(CN=C=O)C=C1 BB01-6562 [0,1,0,0,0,0|1,0,1]=3 37 B12R1.71 COC1=CC=C(OCCBr)C=C1 BB17-1652 [0,1,0,0,0,0|1,0,1]=3 38 B12R1.113 CCCC1=CC=C(C(C)N)C=C1 BB55-1062 [0,1,0,0,0,0|1,0,2]=4 39 B12R1.114 COC1=CC=C(N=C=O)C(C)=C1 BB01-6583 [0,1,0,0,0,0|2,0,1]=4 40 B12R1.116 CCOC1=CC=C(N=C=O)C=C1 BB01-4425 [0,1,0,0,0,0|2,0,1]=4 41 B12R1.116 CCOC1=CC=C(N=C=S)C=C1 BB01-8019 [0,1,0,0,0,0|2,0,1]=4 42 B12R1.116 CCOC1=CC=C(N=S=O)C=C1 BB58-0213 [0,1,0,0,0,0|3,0,0]=4 43 B12R1.288 CCNC1=CC(F)=C(OC)C=C1 BB01-3256 [0,1,0,0,0,0|1,0,2]=4 44 B12R1.288 COC1=C(Cl)C=C(N=C=S)C=C1 BB01-8188 [0,1,0,0,0,0|2,0,1]=4 45 B12R2.44 COC1=CC2=C(C=C1)NC=C2 BB01-4579 [0,0,0,1,0,0|1,0,0]=2 46 B12R2.44 COC1=CC2=C(C=C1)OCO2 BB57-6156 [0,0,0,1,0,0|2,0,1]=4 47 B12R2.44 COC1=CC2=C(C=CN2)C=C1 BB01-6798 [0,0,0,1,0,0|1,0,1]=3 48 B12R2.44 N#CC1=CC=C2NC=CC2=C1 BB57-4235 [0,0,0,1,0,0|3,0,0]=4 49 B12R2.44 O=CC1=CC=C2NC=CC2=C1 BB01-0974 [0,0,0,1,0,0|3,0,0]=4 50 B9R1.1 C=CC1=CC=C(Br)C=C1 BB01-8155 [2,0,0,0,0,0|1,0,0]=3 51 B9R1.1 C=CC1=CC=C(F)C=C1 BB01-8160 [2,0,0,0,0,0|1,0,0]=3 52 B9R1.1 CC1=CC=C(CN)C=C1 BB01-6086 [2,0,0,0,0,0|1,0,0]=3 53 B9R1.1 CC1=CC=C(NN)C=C1 BB17-0837 [2,0,0,0,0,0|2,0,0]=4 54 B9R1.1 CCC1=CC=C(C)N=C1 BB01-6153 [2,0,0,0,0,0|1,0,1]=4 55 B9R1.1 CNC1=CC=C(Br)C=C1 BB01-5218 [2,0,0,0,0,0|2,0,0]=4 56 B9R1.1 COC1=NC=C(N)C=C1 BB01-8347 [2,0,0,0,0,0|2,0,0]=4 57 B9R1.1 NCC1=CC=C(F)C=C1 BB01-6049 [2,0,0,0,0,0|2,0,0]=4 58 B9R1.1 O=CC1=CC=C(I)C=C1 BB17-1814 [2,0,0,0,0,0|2,0,0]=4 59 B9R1.8 NNCC1=CC=CC=C1 BB58-2846 [2,0,0,0,0,0|2,0,0]=4 60 B9R1.8 O=CCC1=CC=CC=C1 BB01-5910 [2,0,0,0,0,0|1,0,0]=3 61 B11R1.1 CC1=CC=C(CN=C=O)C=C1 BB57-0292 [1,1,0,0,0,0|1,0,1]=4 62 B11R1.1 O=C\C=C\C1=CC=C(Br)C=C1 BB17-2312 [1,1,0,0,0,0|1,0,1]=4 63 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 BB01-6131 [1,1,0,0,0,0|1,0,0]=3 64 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 BB01-2602 [1,1,0,0,0,0|2,0,0]=4 65 B11R1.20 CC1=CC=C(NC(N)=S)C=C1 BB01-7381 [1,1,0,0,0,0|2,0,0]=4 66 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 BB01-4680 [1,1,0,0,0,0|2,0,0]=4 67 B11R1.22 CCC(N)C1=CC=C(C)C=C1 BB55-1057 [1,1,0,0,0,0|0,0,2]=4 68 B11R1.3 CC(C)C1=CC=C(CN)C=C1 BB55-3617 [1,1,0,0,0,0|2,0,0]=4 69 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 BB20-1428 [1,1,0,0,0,0|2,0,0]=4 70 B11R1.3 CCC1=CC=C(C(C)N)C=C1 BB01-4897 [1,1,0,0,0,0|1,0,1]=4 71 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 BB01-6159 [1,1,0,0,0,0|2,0,0]=4 72 B11R1.3 CN(C)C1=CC=C(CN)C=C1 BB55-3616 [1,1,0,0,0,0|2,0,0]=4 73 B11R1.3 COC1=CC=C(B(O)O)C=C1 BB01-0920 [1,1,0,0,0,0|2,0,0]=4 74 B11R1.3 COC1=CC=C(C(C)N)C=C1 BB01-4842 [1,1,0,0,0,0|0,0,1]=3 75 B11R1.3 COC1=CC=C(C(N)=O)C=C1 BB01-2755 [1,1,0,0,0,0|1,0,0]=3 76 B11R1.3 COC1=CC=C(C(N)=S)C=C1 BB17-0865 [1,1,0,0,0,0|1,0,0]=3 77 B11R1.3 COC1=CC=C([N+](=O)[O-])C=C1 BB17-2165 [1,1,0,0,0,0|2,0,0]=4 78 B11R1.279 COC1=C(Br)C=C(C=O)C=C1 BB05-0519 [1,1,0,0,0,0|1,0,0]=3 79 B11R1.279 COC1=C(F)C=C(C#N)C=C1 BB01-6213 [1,1,0,0,0,0|1,0,1]=4 80 B11R1.279 COC1=C(O)C=C(C=O)C=C1 BB17-2318 [1,1,0,0,0,0|1,0,0]=3 81 B11R1.279 COC1=CC(O)=C(C=O)C=C1 BB17-2320 [1,1,0,0,0,0|1,0,0]=3 82 B11R1.279 COC1=CC=C(C=O)C=C1Br BB01-6256 [1,1,0,0,0,0|1,0,0]=3 83 B11R1.279 COC1=CC=C(C=O)C=C1Cl BB17-1569 [1,1,0,0,0,0|1,0,0]=3 84 B11R1.279 COC1=CC=C(CCl)C=C1F BB01-4987 [1,1,0,0,0,0|1,0,0]=3 85 B11R1.279 COC1=COC(CCl)=CC1=O BB58-0108 [1,1,0,0,0,0|2,0,0]=4 86 B13R1.5 C=CC(=O)NC1=CC=C(CC)C=C1 BB20-1289 [0,2,0,0,0,0|1,0,1]=4 87 B13R1.5 COC1=CC=C(CC(=O)NN)C=C1 BB55-0705 [0,2,0,0,0,0|1,0,0]=3 88 B13R1.5 COC1=CC=C(NC(=O)CCl)C=C1 BB01-1057 [0,2,0,0,0,0|1,0,1]=4 89 B13R1.5 COC1=CC=C(NC(=S)NN)C=C1 BB01-2876 [0,2,0,0,0,0|2,0,0]=4 90 B13R1.35 COC1=C(Cl)C=C(CC(=O)O)C=C1 BB01-7960 [0,2,0,0,0,0|1,0,0]=3 91 B13R1.35 COC1=C(F)C=C(CC(=O)O)C=C1 BB57-0256 [0,2,0,0,0,0|1,0,0]=3 92 B13R1.452 CCCC(=O)C1=CC=C(OC)C=C1 BB01-4257 [0,2,0,0,0,0|0,0,2]=4 93 B13R1.452 COC1=CC=C(C(=O)CC#N)C=C1 BB01-2557 [0,2,0,0,0,0|1,0,1]=4 94 B13R1.3 C=C(C)COC1=CC=C(C=O)C=C1 BB58-4834 [0,2,0,0,0,0|2,0,0]=4 95 B13R1.3 CCC1=CC=C(OCC(=O)O)C=C1 BB55-0079 [0,2,0,0,0,0|2,0,0]=4 96 B13R1.3 CCC1=CC=C(\C=C\C(=O)O)C=C1 BB01-2920 [0,2,0,0,0,0|1,0,1]=4 97 B13R1.3 COC1=CC=C(CCC(=O)O)C=C1 BB01-6132 [0,2,0,0,0,0|0,0,1]=3 98 B13R1.3 COC1=CC=C(CSC(=N)N)C=C1 BB01-2444 [0,2,0,0,0,0|1,0,0]=3 99 B13R1.3 COC1=CC=C(NCC(C)C)C=C1 BB01-3231 [0,2,0,0,0,0|0,0,2]=4 100 B13R1.3 COC1=CC=C(OCC(=N)N)C=C1 BB01-8152 [0,2,0,0,0,0|1,0,0]=3 101 B13R1.3 COC1=CC=C(OCC(=O)O)C=C1 BB01-4620 [0,2,0,0,0,0|1,0,0]=3 102 B13R1.3 COC1=CC=C(OCC(C)=O)C=C1 BB57-5297 [0,2,0,0,0,0|0,0,1]=3 103 B13R1.3 COC1=CC=C(OCC(C)N)C=C1 BB58-0602 [0,2,0,0,0,0|0,0,2]=4 104 B13R1.3 COC1=CC=C(\C=C\C(=O)Cl)C=C1 BB55-6091 [0,2,0,0,0,0|0,0,1]=3 105 B13R1.3 COC1=CC=C(\C=C\C(=O)O)C=C1 BB01-2913 [0,2,0,0,0,0|0,0,1]=3 106 B13R1.3 CSC1=CC=C(\C=C\C(=O)O)C=C1 BB01-7979 [0,2,0,0,0,0|0,1,1]=4 107 B13R1.74 C=CCOC1=CC=C(B(O)O)C=C1 BB55-6453 [0,2,0,0,0,0|2,0,0]=4 108 B13R1.74 C=CCOC1=CC=C(C(C)=O)C=C1 BB55-2307 [0,2,0,0,0,0|1,0,0]=3 109 B13R1.75 C=CCOC1=CC=C(C=O)C=C1Cl BB17-1437 [0,2,0,0,0,0|2,0,0]=4 110 B13R1.77 CCOC1=CC=C(CCCN)C=C1 BB58-0574 [0,2,0,0,0,0|0,0,2]=4 111 B13R1.577 CCCNC1=CC(Cl)=C(OC)C=C1 BB01-3250 [0,2,0,0,0,0|0,0,2]=4 112 B13R1.386 CNCC1=CC(OC)=C(OC)C=C1 BB58-0565 [0,2,0,0,0,0|1,0,1]=4 113 B13R1.386 COC1=C(OC)C=C(CCN)C=C1 BB01-2487 [0,2,0,0,0,0|1,0,1]=4 114 B11R2.36 BrC1=CC2=C(C=C1)NC=C2 BB01-6196 [1,0,0,1,0,0|2,0,0]=4 115 B11R2.36 CC1=CC=C2NC=CC2=C1 BB01-8311 [1,0,0,1,0,0|1,0,0]=3 116 B11R2.36 ClC1=CC2=C(C=C1)NC=C2 BB01-1062 [1,0,0,1,0,0|2,0,0]=4 117 B13R2.2121 COC1=CC2=C(C=C1)N=C(N)S2 BB01-5948 [0,1,0,1,0,0|2,0,0]=4 118 B13R2.2121 COC1=CC2=C(C=C1)NC(C)=C2 BB01-6538 [0,1,0,1,0,0|1,0,0]=3 119 B13R2.599 COC1=C(Cl)C=C2C=CNC2=C1 BB31-7385 [0,1,0,1,0,0|1,0,1]=4