0 B10R1.13 C=C(C)C1CC=C(C)CC1 8591AJ [0,0,0,0,0,0|0,0,4]=4 1 B10R1.13 CC(=O)C1=CC=C(C)C=N1 7521AB [0,0,0,0,0,0|2,0,2]=4 2 B10R1.13 CC(=O)C1CC=C(C)CC1 Z4935 [0,0,0,0,0,0|1,0,3]=4 3 B10R1.13 CC(Br)C1=CC=C(F)C=C1 9966AB [0,0,0,0,0,0|2,0,2]=4 4 B10R1.13 CC(C)C1=CC=C(N)C=N1 Z4708 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.13 CC(C)C1=CN=C(Cl)N=C1 W7245 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.13 CC(C)C1=NN=C(Cl)C=C1 Z4894 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.13 CC(C)C1CCC(=O)CC1 7826AB [0,0,0,0,0,0|1,0,3]=4 8 B10R1.13 CC(Cl)C1=CC=C(F)C=C1 Z2196 [0,0,0,0,0,0|2,0,2]=4 9 B10R1.13 CC(N)C1=CC=C(Br)C=C1 V8869 [0,0,0,0,0,0|2,0,2]=4 10 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 V6495 [0,0,0,0,0,0|2,0,2]=4 11 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 Y9670 [0,0,0,0,0,0|2,0,2]=4 12 B10R1.13 CC(N)C1=CC=C(F)C=C1 V5775 [0,0,0,0,0,0|2,0,2]=4 13 B10R1.13 CC(O)C1=CC=C(O)C=C1 Z4466 [0,0,0,0,0,0|2,0,2]=4 14 B10R1.13 CC(O)C1=NC=C(Br)C=C1 8022AA [0,0,0,0,0,0|3,0,1]=4 15 B10R1.13 CC1=CC=C(C(C)N)C=C1 8708AB [0,0,0,0,0,0|1,0,2]=3 16 B10R1.13 CC1=NC=C(C(C)O)C=C1 0117AA [0,0,0,0,0,0|2,0,1]=3 17 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 6145AJ [0,0,0,0,0,0|2,0,2]=4 18 B10R1.13 CN(C)C1=CC=C(F)C=C1 2692AE [0,0,0,0,0,0|2,0,2]=4 19 B10R1.13 CN(C)C1=CC=C(O)C=C1 Z4951 [0,0,0,0,0,0|2,0,2]=4 20 B10R1.13 CN(C)C1=NC=C(I)C=C1 Z0561 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.13 CN(C)C1=NC=C(N)C=C1 Z8075 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 4787AJ [0,0,0,0,0,0|2,0,2]=4 23 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 X9175 [0,0,0,0,0,0|2,0,2]=4 24 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 W5396 [0,0,0,0,0,0|2,0,2]=4 25 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 1808AC [0,0,0,0,0,0|2,0,2]=4 26 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 X8527 [0,0,0,0,0,0|2,0,2]=4 27 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 6983AC [0,0,0,0,0,0|2,0,2]=4 28 B10R1.13 C[S+](C)C1=CC=C(O)C=C1 6544AL [0,0,0,0,0,0|2,0,2]=4 29 B9R1.1 CC1=CC=C(CS)C=C1 7913AF [1,0,0,0,0,0|1,0,2]=4 30 B9R1.1 CC1=CN=C(CCl)C=C1 Y5002 [1,0,0,0,0,0|2,0,1]=4 31 B9R1.1 CC1=CN=C(CO)C=C1 1457AB [1,0,0,0,0,0|2,0,1]=4 32 B9R1.1 CC1=NC=C(CCl)C=C1 Z3855 [1,0,0,0,0,0|2,0,1]=4 33 B9R1.1 CCC1=CC=C(Br)N=C1 0198AB [1,0,0,0,0,0|2,0,1]=4 34 B9R1.1 CCC1=CC=C(Cl)C=C1 6872AE [1,0,0,0,0,0|1,0,2]=4 35 B9R1.1 CCC1=CC=C(F)C=C1 W6384 [1,0,0,0,0,0|1,0,2]=4 36 B9R1.1 CCC1=CN=C(N)C=C1 Y5080 [1,0,0,0,0,0|2,0,1]=4 37 B9R1.1 CCC1=NC=C(Br)C=C1 W5934 [1,0,0,0,0,0|2,0,1]=4 38 B9R1.1 CSC1=CC=C(C)C=C1 I356 [1,0,0,0,0,0|1,0,2]=4 39 B9R1.6 CC(Br)C1=NC=CN=C1 5526AC [1,0,0,0,0,0|3,0,0]=4 40 B9R1.6 CC(C)C1=NC=CC=C1 W7610 [1,0,0,0,0,0|1,0,1]=3 41 B9R1.6 CC(N)C1=CC=CC=N1 4915AJ [1,0,0,0,0,0|2,0,1]=4 42 B9R1.6 CC(N)C1=NC=CN=C1 Z2224 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.6 CC(O)C1=NC=CC=C1 Z2356 [1,0,0,0,0,0|2,0,1]=4 44 B9R1.6 CN(C)C1=CN=CC=C1 9643AA [1,0,0,0,0,0|2,0,1]=4 45 B9R1.6 CP(C)C1=CC=CC=C1 0349AC [1,0,0,0,0,0|1,0,2]=4 46 B9R1.6 C[C@@H](N)C1=NC=CC=C1 W6374 [1,0,0,0,0,0|2,0,1]=4 47 B9R1.6 C[C@@H](O)C1=CN=CC=C1 1829AC [1,0,0,0,0,0|2,0,1]=4 48 B9R1.6 C[C@H](N)C1=NC=CC=C1 5348AB [1,0,0,0,0,0|2,0,1]=4 49 B9R1.6 C[C@H](N)C1=NC=CC=C1 W5086 [1,0,0,0,0,0|2,0,1]=4 50 B9R1.6 C[C@H](O)C1=CN=CC=C1 7054AB [1,0,0,0,0,0|2,0,1]=4 51 B9R1.6 C[C@H](O)C1=NC=CC=C1 8783AB [1,0,0,0,0,0|2,0,1]=4 52 B11R1.3 C#CC1=CC=C(C(C)C)C=C1 W4698 [0,1,0,0,0,0|0,0,3]=4 53 B11R1.3 CN(C)C1=CC=C(CO)C=C1 O083 [0,1,0,0,0,0|1,0,2]=4 54 B11R1.3 COC1=CC=C(C(C)C)C=C1 X8289 [0,1,0,0,0,0|0,0,2]=3 55 B11R1.3 COC1=CC=C(C(C)N)C=C1 9546AB [0,1,0,0,0,0|1,0,2]=4 56 B11R1.3 COC1=CC=C([C@@H](C)N)C=C1 W9359 [0,1,0,0,0,0|1,0,2]=4 57 B11R1.3 COC1=CC=C([C@@H](C)O)C=C1 7612AA [0,1,0,0,0,0|1,0,2]=4 58 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 7882AA [0,1,0,0,0,0|1,0,2]=4 59 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 Z0369 [0,1,0,0,0,0|1,0,2]=4 60 B11R1.21 CC(C)C1=CC(N)=C(O)C=C1 3701AB [0,1,0,0,0,0|1,0,2]=4 61 B11R1.21 CC(C)C1=CC=C(Cl)C(Br)=C1 Z1055 [0,1,0,0,0,0|1,0,2]=4 62 B11R1.21 CC(C)C1=CC=C(I)C(Br)=C1 Y3499 [0,1,0,0,0,0|1,0,2]=4 63 B11R1.166 CC1=CC(C)=C(C(C)N)C=C1 7695AC [0,1,0,0,0,0|1,0,2]=4 64 B11R1.166 CC1CCC(C(C)C)C(=O)C1 5752AF [0,1,0,0,0,0|0,0,3]=4 65 B11R1.220 CC1=CC[C@](O)(C(C)C)CC1 3962AL [0,1,0,0,0,0|0,0,2]=3 66 B11R2.34 BrC1=CC=C(C2CC2)C=C1 2180AA [0,0,0,1,0,0|1,0,2]=4 67 B11R2.34 FC1=NC=C(C2CC2)C=C1 Y3567 [0,0,0,1,0,0|2,0,1]=4 68 B11R2.34 OC1=CC=C(C2CC2)C=C1 Z3817 [0,0,0,1,0,0|1,0,2]=4 69 B11R2.39 CC1=CCC2C(C1)C2(C)C 8046AJ [0,0,0,1,0,0|0,0,2]=3 70 B11R2.533 [C@H]12CC=C(C)[C@H](C1)C2(C)C 8366AJ [0,0,0,1,0,0|0,0,2]=3 71 B9R1.35 CC(C)C1=CC(N)=NO1 Z2690 [0,0,0,0,1,0|3,0,0]=4 72 B9R1.35 CC(C)C1=CN=C(Br)S1 Y7137 [0,0,0,0,1,0|3,0,0]=4 73 B9R1.35 CC(C)C1=NC(Br)=CS1 V5583 [0,0,0,0,1,0|3,0,0]=4 74 B9R1.35 CC(C)C1=NNC(N)=C1 Y9482 [0,0,0,0,1,0|3,0,0]=4 75 B9R1.35 CC(C)N1C=C(N)C=N1 X6115 [0,0,0,0,1,0|3,0,0]=4 76 B9R1.35 CC(C)N1C=NC(Br)=C1 6885AE [0,0,0,0,1,0|3,0,0]=4 77 B9R1.35 CC1=CSC(C(C)N)=N1 3800AD [0,0,0,0,1,0|3,0,0]=4 78 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 V4230 [0,0,0,0,0,1|1,0,2]=4 79 B11R1.20 CC(C)CC1=CC=C(N)C=C1 3122AB [0,0,0,0,0,1|1,0,2]=4 80 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 Z8271 [0,0,0,0,0,1|1,0,2]=4 81 B11R1.20 CC(C)OC1=CC=C(Br)C=C1 Z0788 [0,0,0,0,0,1|1,0,2]=4 82 B11R1.20 CC(C)OC1=CC=C(N)C=C1 V4472 [0,0,0,0,0,1|1,0,2]=4 83 B11R1.20 CC(C)OC1=CC=C(O)C=C1 Y9996 [0,0,0,0,0,1|1,0,2]=4 84 B11R1.20 CC(C)OC1=NC=C(Br)C=C1 Y6445 [0,0,0,0,0,1|2,0,1]=4 85 B8R1.2 COC1=CCC=CC1 Y5373 [2,0,0,0,0,0|1,0,0]=3 86 B10R0.3 CC(C)=CCC\C(C)=C\CBr 9201AB [0,1,1,0,0,0|0,0,2]=4 87 B10R1.1 CC1=CC=C(CCBr)C=C1 W7663 [1,1,0,0,0,0|0,0,2]=4 88 B10R1.1 CC1=CC=C(CCN)C=C1 1184AJ [1,1,0,0,0,0|0,0,2]=4 89 B10R1.1 CNCC1=CC=C(C)C=C1 7294AJ [1,1,0,0,0,0|0,0,2]=4 90 B10R1.1 CNCC1=CC=C(C)C=C1 W7964 [1,1,0,0,0,0|0,0,2]=4 91 B10R1.25 CCC1=CN=C(C)C=C1Br 6901AC [1,1,0,0,0,0|1,0,1]=4 92 B10R1.25 CCC1=NC=C(C)N=C1C 6750AA [1,1,0,0,0,0|2,0,0]=4 93 B10R1.176 CCC1=CN=C(C)C(C)=N1 L039 [1,1,0,0,0,0|2,0,0]=4 94 B10R1.15 CC(CBr)C1=CC=CC=C1 Y3159 [1,1,0,0,0,0|0,0,2]=4 95 B10R1.15 CC(CN)C1=CC=CC=C1 W4299 [1,1,0,0,0,0|0,0,2]=4 96 B10R1.15 CCC(C)C1=NC=CN=C1 R546 [1,1,0,0,0,0|2,0,0]=4 97 B10R1.15 CNC(C)C1=CC=CC=C1 V5180 [1,1,0,0,0,0|0,0,2]=4 98 B10R1.15 CNC(C)C1=CC=CN=C1 0995AD [1,1,0,0,0,0|1,0,1]=4 99 B10R1.15 CNC(C)C1=NC=CC=C1 9484AC [1,1,0,0,0,0|1,0,1]=4 100 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 V5313 [1,1,0,0,0,0|0,0,2]=4 101 B10R1.28 CC(C)(C)C1=NC=CN=C1 S575 [1,1,0,0,0,0|2,0,0]=4 102 B10R1.28 CC(C)(C)C1CC=CCC1 W4595 [1,1,0,0,0,0|0,0,2]=4 103 B10R1.28 CC(C)(N)C1=CC=CC=N1 5199AJ [1,1,0,0,0,0|1,0,1]=4 104 B10R1.28 CC(C)(O)C1=CC=CN=C1 Y7594 [1,1,0,0,0,0|1,0,1]=4 105 B10R1.28 CC(C)(O)C1=NC=CC=C1 4873AB [1,1,0,0,0,0|1,0,1]=4 106 B10R1.113 CC(C)C1=CC=CC(Br)=N1 Z6690 [1,1,0,0,0,0|1,0,1]=4 107 B10R1.31 CC(C)C1=NC(CCl)=CS1 V5796 [0,1,0,0,1,0|2,0,0]=4 108 B10R1.31 CC(C)C1=NC(CO)=CS1 Y5265 [0,1,0,0,1,0|2,0,0]=4 109 B10R1.31 CC(C)C1=NC=C(CN)S1 Z2044 [0,1,0,0,1,0|2,0,0]=4 110 B10R1.31 CC(C)N1C=C(CN)C=N1 3670AF [0,1,0,0,1,0|2,0,0]=4 111 B10R1.31 CC(C)N1C=C(CO)C=N1 7261AC [0,1,0,0,1,0|2,0,0]=4 112 B10R1.55 CC1=NC(C(C)(C)C)=CS1 4925AD [0,1,0,0,1,0|2,0,0]=4 113 B12R1.4 CC(C)OC1=CC=C(CN)C=C1 Y8233 [0,1,0,0,0,1|0,0,2]=4 114 B12R1.233 CC1=CN=C(OC(C)C)C(Br)=C1 V7642 [0,1,0,0,0,1|1,0,1]=4 115 B12R1.6 CC(C)(C)C1=CC=C(CS)C=C1 S759 [0,2,0,0,0,0|0,0,2]=4 116 B12R1.113 CC(C)C1=CC=C(CC=O)C=C1 3688AE [0,2,0,0,0,0|0,0,2]=4 117 B10R2.6 C1=CC=C(C2CC2)C=C1 V8423 [1,0,0,1,0,0|0,0,2]=4 118 B12R2.290 CC1=CC=C(C2(N)CC2)C=C1 9971AH [0,1,0,1,0,0|0,0,2]=4 119 B8R0.23 CC(=O)CC(=O)C(C)C 8868AE [0,0,1,0,1,0|2,0,0]=4 120 B8R1.1 CC1=CSC(CO)=C1 Y9977 [1,0,0,0,1,0|2,0,0]=4 121 B8R1.7 CC(C)=C1C=CC=C1 1050AB [1,0,0,0,1,0|0,0,2]=4 122 B8R1.7 CC(C)C1=CC=CO1 U090 [1,0,0,0,1,0|1,0,0]=3 123 B8R1.7 CC(N)C1=COC=C1 2007AB [1,0,0,0,1,0|2,0,0]=4 124 B10R1.18 CC(C)OC1=NC=CC=C1 Z0239 [1,0,0,0,0,1|1,0,1]=4 125 B12R1.21 CC1=CC=C(CNC(C)C)C=C1 8511AE [0,0,0,0,0,2|0,0,2]=4