0 B11R1.166 CC(=O)C1=CN=C(C)C=C1N 5382AA [0,0,0,0,0,0|3,0,1]=4 1 B11R1.166 CC(=O)C1=NC=C(Br)C=C1O 6767AA [0,0,0,0,0,0|3,0,1]=4 2 B11R1.166 CC1=C(N(C)N)C=CC(Cl)=C1 4291AA [0,0,0,0,0,0|4,0,0]=4 3 B11R1.166 CC1=CC=C(C(=N)N)C(C)=C1 1390AJ [0,0,0,0,0,0|3,0,1]=4 4 B11R1.166 CC1=CN=C([N+](=O)[O-])C(O)=C1 4688AD [0,0,0,0,0,0|4,0,0]=4 5 B11R1.166 CC1=NC(Cl)=C(C(C)C)C=N1 7391AC [0,0,0,0,0,0|3,0,0]=3 6 B11R1.166 CS(=O)C1=C(F)C=C(O)C=C1 3401AC [0,0,0,0,0,0|4,0,0]=4 7 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=C1 6092AA [0,0,0,0,0,0|3,0,0]=3 8 B11R1.166 NC(=O)C1=C(O)C=C(Cl)C=C1 4852AB [0,0,0,0,0,0|3,0,1]=4 9 B11R1.166 NC(=O)C1=CC=C(N)C=C1O 8918AB [0,0,0,0,0,0|3,0,1]=4 10 B10R1.13 CC(C)C1=CC=C(Br)N=N1 2209AJ [1,0,0,0,0,0|3,0,0]=4 11 B10R1.13 CC(C)C1=CC=C(N)N=N1 8370AB [1,0,0,0,0,0|3,0,0]=4 12 B10R1.13 CC(C)C1=CN=C(N)N=C1 6893AC [1,0,0,0,0,0|3,0,0]=4 13 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 7866AF [1,0,0,0,0,0|3,0,0]=4 14 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 O022 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.13 CC1=CN=C(C(C)C)C=C1 1750AJ [1,0,0,0,0,0|1,0,0]=2 16 B10R1.13 CC1=NC=C(C(C)N)C=N1 1500AA [1,0,0,0,0,0|3,0,0]=4 17 B10R1.13 CN(C)C1=NC=C(N)C=C1 W5002 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.13 C[C@@H](N)C1=CC=C(I)C=C1 W7028 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 W7688 [1,0,0,0,0,0|2,0,0]=3 20 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y6478 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.25 CC1=CC(C)=C(CBr)N=C1 8736AA [1,0,0,0,0,0|3,0,0]=4 22 B10R1.25 CC1=CC(N)=C(C=O)C=C1 1510AJ [1,0,0,0,0,0|2,0,1]=4 23 B10R1.25 CC1=CC=C(CO)C(Cl)=N1 0639AC [1,0,0,0,0,0|3,0,0]=4 24 B10R1.25 COC1=CC=C(C)C=C1F Z0570 [1,0,0,0,0,0|2,0,0]=3 25 B10R1.25 COC1=NC=C(C)C=C1C W9915 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.25 CSC1=CC=C(F)C=C1O Y3948 [1,0,0,0,0,0|2,0,0]=3 27 B10R1.61 CC1=CC=CC=C1[C@@H](C)N X8767 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.61 N=C(N)C1=CC=CC=C1O Y9154 [1,0,0,0,0,0|2,0,1]=4 29 B10R1.61 NC1=CC=CC=C1C(F)F 0350AC [1,0,0,0,0,0|3,0,0]=4 30 B12R1.57 CC(C)C1=C(C=O)C=C(Cl)C=N1 3700AA [0,1,0,0,0,0|2,0,1]=4 31 B12R1.57 COC1=CC(C)=CC=C1B(O)O Z0335 [0,1,0,0,0,0|3,0,0]=4 32 B12R1.232 CC(=O)C1=CC(Br)=C(C)C=C1N 3997AJ [0,1,0,0,0,0|2,0,1]=4 33 B12R1.452 COC1=CC=C(C(C)C)C(F)=C1 X5912 [0,1,0,0,0,0|1,0,0]=2 34 B12R1.1000 CC(=O)C1=C(O)C=C(C)NC1=O 8002AB [0,1,0,0,0,0|2,0,1]=4 35 B12R1.1703 CC[C@@H](N)C1=CC=C(F)C=C1F 4783AA [0,1,0,0,0,0|3,0,0]=4 36 B12R2.612 CC1=CC2=C(C=C1)C(Cl)=NO2 8279AA [0,0,0,1,0,0|2,0,1]=4 37 B12R2.612 CC1=NOC2=C1C=CC(N)=C2 7905AA [0,0,0,1,0,0|2,0,1]=4 38 B12R2.612 CC1NCC2=C1C=CC(Br)=C2 3927AB [0,0,0,1,0,0|3,0,0]=4 39 B12R2.612 NC1CCC2=C1C=CC(F)=C2 7424AA [0,0,0,1,0,0|3,0,0]=4 40 B12R2.612 NC1CCC2=CC(Cl)=CC=C21 3177AJ [0,0,0,1,0,0|3,0,0]=4 41 B12R2.612 NC1COC2=C1C=CC(Br)=C2 6155AC [0,0,0,1,0,0|2,0,0]=3 42 B12R2.612 NC1COC2=CC(Cl)=CC=C21 3496AJ [0,0,0,1,0,0|2,0,0]=3 43 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 X8974 [0,0,0,1,0,0|3,0,0]=4 44 B12R2.612 N[C@H]1COC2=CC(Cl)=CC=C21 8672AH [0,0,0,1,0,0|2,0,0]=3 45 B12R2.612 OC1=CC2=C(C=C1)C(O)CC2 4876AB [0,0,0,1,0,0|3,0,0]=4 46 B12R1.233 CC(C)OC1=C(Cl)C=C(Br)C=N1 3711AA [0,0,0,0,0,1|3,0,0]=4 47 B12R1.233 CC(C)OC1=CC=C(Cl)C=C1Cl Z0779 [0,0,0,0,0,1|2,0,0]=3 48 B9R1.1 CCC1=CN=C(Cl)C=C1 1065AA [2,0,0,0,0,0|2,0,0]=4 49 B9R1.1 CCC1=NC=C(C)C=C1 9500AA [2,0,0,0,0,0|1,0,0]=3 50 B9R1.6 CC(Cl)C1=NC=CC=C1 Z2355 [2,0,0,0,0,0|2,0,0]=4 51 B9R1.6 CC(O)C1=CC=NC=C1 W4712 [2,0,0,0,0,0|2,0,0]=4 52 B9R1.15 CCC1=CN=CN=C1O 3208AJ [2,0,0,0,0,0|2,0,0]=4 53 B9R1.15 OCC1=C(O)C=NC=C1 X7917 [2,0,0,0,0,0|2,0,0]=4 54 B9R1.69 CC1=CC=C(C)C(Br)=N1 5008AH [2,0,0,0,0,0|2,0,0]=4 55 B9R1.69 CC1=CN=C(C)C=C1O 1272AB [2,0,0,0,0,0|1,0,0]=3 56 B9R1.69 CC1=CN=C(F)C(O)=C1 Y3761 [2,0,0,0,0,0|2,0,0]=4 57 B9R1.69 NC1=C(O)C=C(Br)C=C1 3353AC [2,0,0,0,0,0|2,0,0]=4 58 B9R1.69 OC1=CC(F)=CC=C1I 3213AJ [2,0,0,0,0,0|2,0,0]=4 59 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 3772AC [1,1,0,0,0,0|1,0,1]=4 60 B11R1.3 CC(C)C1=NC=C(CN)C=C1 Y1981 [1,1,0,0,0,0|1,0,0]=3 61 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 W7084 [1,1,0,0,0,0|1,0,0]=3 62 B11R1.19 CC(C)(C)C1=CC=C(Br)C=N1 X6374 [1,1,0,0,0,0|2,0,0]=4 63 B11R1.19 CC(C)(C)C1=CC=C(O)N=C1 2587AA [1,1,0,0,0,0|2,0,0]=4 64 B11R1.19 CC(C)(N)C1=CC=C(Cl)N=C1 7912AA [1,1,0,0,0,0|2,0,0]=4 65 B11R1.19 CC(C)(N)C1=CC=C(N)C=C1 2445AJ [1,1,0,0,0,0|1,0,0]=3 66 B11R1.19 CC(C)(O)C1=CC=C(N)C=C1 1130AJ [1,1,0,0,0,0|1,0,0]=3 67 B11R1.19 CC(F)(F)C1=CC=C(Cl)C=C1 5612AE [1,1,0,0,0,0|2,0,0]=4 68 B11R1.19 CC1=CC=C(C(C)(C)N)C=C1 X5539 [1,1,0,0,0,0|0,0,0]=2 69 B11R1.21 CC1=C(F)C=CC([C@@H](C)N)=C1 3792AA [1,1,0,0,0,0|2,0,0]=4 70 B11R1.21 CC1=CC([C@H](C)N)=CC=C1Cl W9678 [1,1,0,0,0,0|2,0,0]=4 71 B11R1.21 CC1=CC=C(C(C)C)C=C1N B800 [1,1,0,0,0,0|0,0,0]=2 72 B11R1.21 CC1=NC=C(C(C)C)N=C1C 5550AB [1,1,0,0,0,0|2,0,0]=4 73 B11R1.21 C[C@@H](N)C1=CC(Cl)=C(F)C=C1 0358AA [1,1,0,0,0,0|2,0,0]=4 74 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 X3908 [1,1,0,0,0,0|2,0,0]=4 75 B11R1.21 C[C@H](N)C1=CC=C(Cl)C(F)=C1 X9597 [1,1,0,0,0,0|2,0,0]=4 76 B11R1.21 C[C@H](N)C1=CC=C(F)C(F)=C1 W5395 [1,1,0,0,0,0|2,0,0]=4 77 B11R1.22 CC(CN)C1=CC=C(Cl)C=C1 1725AC [1,1,0,0,0,0|1,0,0]=3 78 B11R1.22 CCC(O)C1=CC=C(Br)C=C1 1423AL [1,1,0,0,0,0|2,0,0]=4 79 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 X3150 [1,1,0,0,0,0|2,0,0]=4 80 B11R1.37 CCC1=CN=C(C)C=C1C#N 6931AC [1,1,0,0,0,0|2,0,0]=4 81 B11R1.37 COC1=CC(F)=CC=C1CBr W9149 [1,1,0,0,0,0|2,0,0]=4 82 B11R1.37 OCC1=C(CO)C=C(Cl)C=C1 8755AH [1,1,0,0,0,0|2,0,0]=4 83 B11R1.81 CCOC1=CC=C(Cl)C=C1Br Y3880 [1,1,0,0,0,0|2,0,0]=4 84 B11R1.81 CCOC1=CC=C(F)C=C1O Z0556 [1,1,0,0,0,0|1,0,0]=3 85 B11R1.277 CC1=C(F)C=C(CO)C(F)=C1 1995AB [1,1,0,0,0,0|2,0,0]=4 86 B11R1.277 CCC1=CC(N)=C(C)C=C1C Y1727 [1,1,0,0,0,0|1,0,0]=3 87 B11R1.277 CCC1=CC(N)=C(C)C=C1C Y1728 [1,1,0,0,0,0|1,0,0]=3 88 B11R1.279 CCC1=CC=C(OC)C=C1O 2074AL [1,1,0,0,0,0|0,0,0]=2 89 B11R1.279 COC1=C(N)C=C(CN)C=C1 2974AJ [1,1,0,0,0,0|2,0,0]=4 90 B11R1.279 COC1=CC=C(CCl)C=C1C 9079AB [1,1,0,0,0,0|2,0,0]=4 91 B11R1.279 COC1=CC=C(CN)C(F)=C1 5987AC [1,1,0,0,0,0|2,0,0]=4 92 B11R1.279 COC1=CC=C(CN)C=C1N 2973AJ [1,1,0,0,0,0|2,0,0]=4 93 B11R1.279 CSC1=CC=C(CCl)C=C1Cl X6696 [1,1,0,0,0,0|2,0,0]=4 94 B11R1.464 CC1=CC(C)=C(C=O)C(O)=C1 2088AL [1,1,0,0,0,0|1,0,1]=4 95 B11R1.464 CC1=CC(F)=C(CO)C(F)=C1 1993AB [1,1,0,0,0,0|2,0,0]=4 96 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 6065AA [1,1,0,0,0,0|1,0,0]=3 97 B11R1.87 CC(C)(O)C1=C(Cl)C=NC=C1 2090AC [1,1,0,0,0,0|2,0,0]=4 98 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F 3968AA [1,1,0,0,0,0|2,0,0]=4 99 B11R1.167 CC(C)C1=C(Cl)C=CC(N)=C1 5467AC [1,1,0,0,0,0|1,0,0]=3 100 B11R1.167 CC(C)C1=CC(Br)=CC=C1Br X6582 [1,1,0,0,0,0|1,0,0]=3 101 B11R1.167 CC(C)C1=CC(O)=CC=C1Br 8443AA [1,1,0,0,0,0|1,0,0]=3 102 B11R1.167 CC1=CC=C(N)C=C1C(C)C 7448AB [1,1,0,0,0,0|1,0,0]=3 103 B11R1.167 CC1=CC=C(O)C(C(C)C)=C1 Z3589 [1,1,0,0,0,0|0,0,0]=2 104 B11R1.167 C[C@@H](N)C1=C(Cl)C=CC(Cl)=C1 8344AH [1,1,0,0,0,0|2,0,0]=4 105 B11R1.167 C[C@@H](N)C1=C(F)C=CC(Cl)=C1 3967AA [1,1,0,0,0,0|2,0,0]=4 106 B11R1.222 CC[C@@H](N)C1=CC=CC=C1Cl 3808AA [1,1,0,0,0,0|2,0,0]=4 107 B11R1.222 NCC(O)C1=C(Cl)C=CC=C1 1575AB [1,1,0,0,0,0|2,0,0]=4 108 B11R1.222 NCC(O)C1=C(Cl)C=CC=C1 5504AB [1,1,0,0,0,0|2,0,0]=4 109 B11R1.222 NCC(O)C1=CC=CC=C1I 0299AA [1,1,0,0,0,0|2,0,0]=4 110 B13R1.51 CC(C)CC1=C(C#N)C=C(Br)C=C1 3309AC [0,1,0,0,0,1|2,0,0]=4 111 B13R1.163 CC1=CC(O)=CC=C1C(=O)C(C)C 1844AC [0,1,0,0,0,1|2,0,0]=4 112 B13R1.653 COC1=CC=C(NC(C)=O)C(O)=C1 W1144 [0,1,0,0,0,1|1,0,1]=4 113 B13R1.2398 COC1=C(C(C)C)C=C(N)C(C)=C1 4085AE [0,2,0,0,0,0|0,0,0]=2 114 B13R1.2812 CC1=C(O)C(Br)=C(C(C)C)C(Br)=C1 8449AE [0,2,0,0,0,0|1,0,0]=3 115 B13R1.120 CC(=O)C1=CC(Br)=C(N(C)C)C=C1 6970AA [0,2,0,0,0,0|2,0,0]=4 116 B13R1.120 CC(C)C1=C(Cl)C=C([N+](=O)[O-])C=C1 7459AB [0,2,0,0,0,0|2,0,0]=4 117 B13R1.120 CC(C)C1=C(F)C=C([N+](=O)[O-])C=C1 6537AA [0,2,0,0,0,0|2,0,0]=4 118 B13R1.120 CC(C)C1=C(I)C=C([N+](=O)[O-])C=C1 1913AA [0,2,0,0,0,0|2,0,0]=4 119 B11R2.34 ClC1=CC=C(C2CO2)C=C1 0625AQ [1,0,0,1,0,0|2,0,0]=4 120 B11R2.36 CC1=CC2=C(C=C1)C=NO2 1217AA [1,0,0,1,0,0|1,0,1]=4 121 B11R2.36 CC1=CC2=C(CCC2)N=C1 2832AB [1,0,0,1,0,0|2,0,0]=4 122 B11R2.36 ClC1=CC=C2CCOC2=C1 3499AJ [1,0,0,1,0,0|1,0,0]=3 123 B11R2.36 NC1=CC2=C(C=C1)CCC2 2198AC [1,0,0,1,0,0|2,0,0]=4 124 B11R2.1 ClC1CCC2=C1C=CC=C2 X6210 [1,0,0,1,0,0|2,0,0]=4 125 B11R2.1 OC1COC2=CN=CC=C21 2285AJ [1,0,0,1,0,0|2,0,0]=4 126 B11R2.55 CC1=C(C2CC2)C=NC=C1 Y3951 [1,0,0,1,0,0|2,0,0]=4 127 B11R2.55 ClC1=CC=CN=C1C2CC2 Z0133 [1,0,0,1,0,0|2,0,0]=4 128 B13R2.3108 CC1(C)CNC2=C1C=CC(N)=C2 9435AA [0,1,0,1,0,0|2,0,0]=4 129 B13R2.5179 CC1=CC2=C(C=C1)C(=O)CCO2 Y8062 [0,1,0,1,0,0|1,0,1]=4 130 B13R2.5179 NC1CCOC2=C1C=CC(F)=C2 2124AC [0,1,0,1,0,0|2,0,0]=4 131 B13R2.5179 N[C@@H]1CCOC2=CC(F)=CC=C21 5224AC [0,1,0,1,0,0|2,0,0]=4 132 B13R2.3125 NC1(C2=C(Cl)C=C(Cl)C=C2)CC1 9382AH [0,1,0,1,0,0|2,0,0]=4 133 B13R2.2130 COC1=CC2=C(C=C1)C(N)CC2 7382AB [0,1,0,1,0,0|2,0,0]=4 134 B13R2.11642 CC1=CC2=C(C(=O)O1)C(O)CO2 5831AE [0,1,0,1,0,0|2,0,0]=4 135 B13R2.662 CNC1CCC2=C1C=CC(Cl)=C2 3198AJ [0,1,0,1,0,0|2,0,0]=4 136 B11R1.20 CC(N)CC1=CC=C(O)C=C1 2498AL [1,0,0,0,0,1|2,0,0]=4 137 B11R1.20 CC1=CC=C(NC(C)C)C=C1 7984AC [1,0,0,0,0,1|0,0,0]=2 138 B11R1.86 CC(=O)CC1=CC=CC=C1O 5670AA [1,0,0,0,0,1|1,0,1]=4 139 B11R1.86 CC(C)CC1=CC=CC=C1O 5740AB [1,0,0,0,0,1|0,0,0]=2 140 B11R1.86 CC(C)OC1=NC=CC=C1Cl Z0472 [1,0,0,0,0,1|2,0,0]=4 141 B11R1.74 CC(C)C1=CC(Cl)=CC(Cl)=C1 Z0755 [0,0,0,0,1,1|2,0,0]=4 142 B11R1.74 CC(C)C1=NC(O)=CC(=O)N1 0751AD [0,0,0,0,1,1|2,0,0]=4