0 B11R1.605 NC1=C(CCO)C(F)=CC=C1 6001AA [0,0,0,0,0,0|2,0,0]=2 1 B10R1.4 C=CCC1=C(Cl)C=CC=C1 7969AA [1,0,0,0,0,0|1,0,1]=3 2 B10R1.4 C=CCC1=C(F)C=CC=C1 5696AE [1,0,0,0,0,0|1,0,1]=3 3 B10R1.4 CC1=CC=CC=C1CC=O 7409AC [1,0,0,0,0,0|2,0,1]=4 4 B10R1.4 CCOC1=C(Cl)C=CN=C1 0184AA [1,0,0,0,0,0|3,0,0]=4 5 B10R1.4 CCOC1=CC=CN=C1F Z0876 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.4 ClCOC1=C(Cl)C=CC=C1 8609AB [1,0,0,0,0,0|2,0,0]=3 7 B10R1.4 NC1=NC=CC=C1CCO 6447AC [1,0,0,0,0,0|3,0,0]=4 8 B10R1.4 NCCC1=C(F)C=CC=N1 1108AJ [1,0,0,0,0,0|1,0,0]=2 9 B10R1.4 NCCN1C=CC=CC1=O Y8846 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.4 NOCC1=CC=CC=C1Br 7199AB [1,0,0,0,0,0|1,1,0]=3 11 B10R1.4 O=C1C=CC=CN1CCCl 7140AB [1,0,0,0,0,0|3,0,0]=4 12 B10R1.4 O=CCC1=CC=CC=C1Br X2126 [1,0,0,0,0,0|1,1,1]=4 13 B10R1.4 O=CCC1=CC=CC=C1Cl 5867AB [1,0,0,0,0,0|1,0,1]=3 14 B10R1.245 CCC1=C(Br)C=NC=C1F Z4131 [1,0,0,0,0,0|1,1,0]=3 15 B10R1.245 CN1CC=CC(F)=C1CN Y4483 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.245 CNC1=C(C)C=CC=C1C 9464AE [1,0,0,0,0,0|3,0,0]=4 17 B10R1.245 CNC1=C(F)C=CC=C1F 8158AB [1,0,0,0,0,0|1,1,0]=3 18 B10R1.245 COC1=C(Br)C=NC=C1Cl 3864AA [1,0,0,0,0,0|2,1,0]=4 19 B10R1.245 COC1=C(O)C=CN=C1F Y3759 [1,0,0,0,0,0|3,0,0]=4 20 B12R1.497 NC1=C(CCO)C(F)=C(F)C=C1 2982AL [0,1,0,0,0,0|2,0,0]=3 21 B12R1.1095 CC1=CC(C)=C(CCN)C(C)=C1 1024AQ [0,1,0,0,0,0|2,0,0]=3 22 B12R1.1095 CC1=CC(C)=C(CNN)C(C)=C1 4315AD [0,1,0,0,0,0|3,0,0]=4 23 B12R1.1095 CCOC1=C(Cl)C=C(O)C=C1Cl Z1040 [0,1,0,0,0,0|2,1,0]=4 24 B12R1.1631 ClCCOC1=C(Br)C=CC=C1Br 1512AL [0,1,0,0,0,0|1,2,0]=4 25 B12R2.202 NC1=NC2=C(C=CC=C2Cl)N1 0860AC [0,0,0,1,0,0|2,0,1]=4 26 B12R2.202 NC1=NC2=C(C=CC=C2Cl)O1 9811AB [0,0,0,1,0,0|2,0,1]=4 27 B12R2.202 NC1=NC2=C(S1)C(F)=CC=C2 0437AB [0,0,0,1,0,0|2,0,1]=4 28 B12R2.1081 ClC1=NC=NC2=C1CCNC2 X5476 [0,0,0,1,0,0|3,0,0]=4 29 B12R2.1081 FC1=C2CNCCC2=CC=C1 3784AJ [0,0,0,1,0,0|3,0,0]=4 30 B12R2.1081 FC1=CC=CC2=C1CCCN2 X9437 [0,0,0,1,0,0|2,0,0]=3 31 B12R2.1081 NC1=C2CCCOC2=CC=C1 3919AJ [0,0,0,1,0,0|3,0,0]=4 32 B12R2.1081 O=C1NC=CC2=C1CCNC2 Y6683 [0,0,0,1,0,0|3,0,0]=4 33 B12R2.1081 OC1=CC=CC2=C1CCCN2 9583AH [0,0,0,1,0,0|3,0,0]=4 34 B12R2.1081 OC1=CC=CC2=C1CCNC2 0688AA [0,0,0,1,0,0|2,0,0]=3 35 B9R1.8 ClCCC1=CC=NC=C1 2738AB [2,0,0,0,0,0|2,0,0]=4 36 B9R1.8 ClCCC1=CN=CC=C1 5261AB [2,0,0,0,0,0|2,0,0]=4 37 B9R1.8 Cl[Mg]CC1=CC=CC=C1 8408AJ [2,0,0,0,0,0|2,0,0]=4 38 B9R1.8 NCCC1=CN=CN=C1 3332AC [2,0,0,0,0,0|2,0,0]=4 39 B9R1.8 NCCC1=NC=CC=N1 4806AC [2,0,0,0,0,0|2,0,0]=4 40 B9R1.8 NCCC1=NC=NC=C1 1885AJ [2,0,0,0,0,0|2,0,0]=4 41 B9R1.8 NCCC1=NC=NC=C1 1886AJ [2,0,0,0,0,0|2,0,0]=4 42 B9R1.8 NNCC1=CC=CC=N1 4874AC [2,0,0,0,0,0|2,0,0]=4 43 B9R1.15 COC1=C(Cl)C=NC=C1 3447AC [2,0,0,0,0,0|2,0,0]=4 44 B9R1.15 CSC1=NC=CC=C1Cl Z1214 [2,0,0,0,0,0|2,0,0]=4 45 B9R1.15 NCC1=C(F)N=CC=C1 3392AC [2,0,0,0,0,0|1,0,0]=3 46 B9R1.15 NCC1=C(N)C=CC=N1 5249AJ [2,0,0,0,0,0|2,0,0]=4 47 B9R1.15 NCC1=C(N)C=NC=C1 7105AA [2,0,0,0,0,0|2,0,0]=4 48 B9R1.15 NCC1=CC=CN=C1N 4362AD [2,0,0,0,0,0|2,0,0]=4 49 B9R1.15 NCC1=CC=CNC1=O Y1980 [2,0,0,0,0,0|2,0,0]=4 50 B9R1.3 CC1=CN=CC(F)=C1N W3052 [2,0,0,0,0,0|2,0,0]=4 51 B9R1.3 CC1=NC=CC(Cl)=C1N 3692AA [2,0,0,0,0,0|2,0,0]=4 52 B9R1.3 NC1=CC=CC(Cl)=C1I 2232AJ [2,0,0,0,0,0|2,0,0]=4 53 B11R1.13 NOCC1=C(Cl)C(Cl)=CC=C1 0054AE [1,1,0,0,0,0|1,0,0]=3 54 B11R1.13 O=CCC1=C(Cl)C(Cl)=CC=C1 2420AA [1,1,0,0,0,0|1,0,1]=4 55 B11R1.13 O=CCC1=CC=CC(F)=C1F 3598AC [1,1,0,0,0,0|1,0,1]=4 56 B11R1.17 C=CCCC1=C(Br)C=CC=C1 8652AE [1,1,0,0,0,0|1,1,0]=4 57 B11R1.17 C=CCCC1=C(Cl)C=CC=C1 9630AD [1,1,0,0,0,0|1,0,0]=3 58 B11R1.17 C=CCCC1=CC=CC=C1F 8653AE [1,1,0,0,0,0|1,0,0]=3 59 B11R1.17 CC1=CC=CC=C1CCC=O 6596AD [1,1,0,0,0,0|2,0,0]=4 60 B11R1.17 CCNCC1=C(O)C=CC=C1 5372AJ [1,1,0,0,0,0|2,0,0]=4 61 B11R1.17 CNCCC1=C(Cl)C=CC=C1 4940AE [1,1,0,0,0,0|0,0,0]=2 62 B11R1.17 CNCCC1=CC=CC=C1C 9270AE [1,1,0,0,0,0|1,0,0]=3 63 B11R1.17 COCOC1=CC=CC=C1Cl Z0465 [1,1,0,0,0,0|2,0,0]=4 64 B11R1.17 N#CCCC1=CC=CC=C1Cl 1363AC [1,1,0,0,0,0|0,0,1]=3 65 B11R1.17 NCCCC1=C(Br)C=CC=C1 5612AJ [1,1,0,0,0,0|0,1,0]=3 66 B11R1.17 NCCCC1=CC=CC=C1Cl 6271AD [1,1,0,0,0,0|0,0,0]=2 67 B11R1.17 O=CCCC1=CC=CC=C1Cl 7894AA [1,1,0,0,0,0|1,0,0]=3 68 B11R1.41 COC1=C(CCN)C=CN=C1 1115AJ [1,1,0,0,0,0|2,0,0]=4 69 B11R1.41 N#CC1=CC=CC=C1CCO 5830AB [1,1,0,0,0,0|2,0,0]=4 70 B11R1.81 O=CCC1=CC=C(Br)C=C1F 3153AF [1,1,0,0,0,0|1,0,1]=4 71 B11R1.86 CC(C)CC1=CC=CC=C1O 5740AB [1,1,0,0,0,0|2,0,0]=4 72 B11R1.222 CC[C@@H](N)C1=CC=CC=C1Cl 3808AA [1,1,0,0,0,0|1,0,0]=3 73 B11R1.222 NCC(=O)C1=CC=CC=C1F L160 [1,1,0,0,0,0|0,0,1]=3 74 B11R1.222 NCC(O)C1=C(Cl)C=CC=C1 1575AB [1,1,0,0,0,0|0,0,0]=2 75 B11R1.222 NCC(O)C1=C(Cl)C=CC=C1 5504AB [1,1,0,0,0,0|0,0,0]=2 76 B11R1.222 NCC(O)C1=CC=CC=C1I 0299AA [1,1,0,0,0,0|0,1,0]=3 77 B11R1.222 O=C(CO)C1=C(Cl)C=CC=C1 4897AJ [1,1,0,0,0,0|1,0,1]=4 78 B11R1.72 CC1=C(Cl)C(C#N)=C(F)C=C1 1667AJ [1,1,0,0,0,0|0,0,2]=4 79 B11R1.72 COC1=C(F)C(Br)=CC=C1F Z0398 [1,1,0,0,0,0|1,1,0]=4 80 B11R1.72 OCC1=C(Cl)C(F)=CC=C1F 8633AD [1,1,0,0,0,0|1,0,0]=3 81 B11R1.72 OCC1=C(Cl)C=CC(Br)=C1F Z1019 [1,1,0,0,0,0|1,0,0]=3 82 B11R1.156 CC1=C(C(=N)N)C(Cl)=CC=C1 1669AJ [1,1,0,0,0,0|1,0,1]=4 83 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F 3968AA [1,1,0,0,0,0|0,1,0]=3 84 B11R1.156 N=C(N)C1=C(F)C=CC=C1Cl 5026AH [1,1,0,0,0,0|0,0,1]=3 85 B11R1.265 CSC1=C(Cl)C=CC=C1C=O Y3563 [1,1,0,0,0,0|2,0,0]=4 86 B11R1.265 FC1=CC=CC(CBr)=C1CBr 9444AB [1,1,0,0,0,0|1,1,0]=4 87 B11R1.464 CC1=CC(F)=C(CO)C(F)=C1 1993AB [1,1,0,0,0,0|1,1,0]=4 88 B11R1.464 CC1=CC(F)=CC(C)=C1CN 9521AE [1,1,0,0,0,0|2,0,0]=4 89 B11R1.464 N#CC1=C(Cl)C=C(Br)C=C1F X3480 [1,1,0,0,0,0|0,0,2]=4 90 B11R1.464 OCC1=C(F)C=C(Cl)C=C1Br Z1221 [1,1,0,0,0,0|1,1,0]=4 91 B13R1.1601 CCCOC1=C(Cl)C=C(Br)C=C1Cl Y3937 [0,2,0,0,0,0|1,1,0]=4 92 B13R1.4012 O=[N+]([O-])C1=C(CCO)C(Cl)=CC=C1 0617AA [0,2,0,0,0,0|2,0,0]=4 93 B13R1.8256 CC(C)(CN)C1=C(F)C=CC=C1F 1227AD [0,2,0,0,0,0|0,1,0]=3 94 B11R2.20 C1=CC2=C(C=C1)CNCC2 1479AL [1,0,0,1,0,0|1,0,0]=3 95 B11R2.20 C1=CC2=C(C=N1)CNCC2 1745AA [1,0,0,1,0,0|2,0,0]=4 96 B11R2.55 ClC1=CC=CN=C1C2CC2 Z0133 [1,0,0,1,0,0|2,0,0]=4 97 B11R2.106 ClC1=C2C=NNC2=CC=C1 X7155 [1,0,0,1,0,0|1,0,1]=4 98 B13R2.342 NC1CCCC2=C(Cl)C=CC=C21 3169AJ [0,1,0,1,0,0|2,0,0]=4 99 B13R2.342 NC1CCCC2=C(F)C=CC=C21 5120AC [0,1,0,1,0,0|2,0,0]=4 100 B13R2.342 N[C@@H]1CCCC2=C(Cl)C=CC=C21 8359AH [0,1,0,1,0,0|2,0,0]=4 101 B13R2.342 O=C1NCCC2=C1C=CC=C2Cl 5827AH [0,1,0,1,0,0|1,0,0]=3 102 B13R2.54 CCC1=CC2=C(C1)C(Cl)=CC=C2 6403AB [0,1,0,1,0,0|2,0,0]=4 103 B13R2.5179 O=C1CCC2=C(C=CC=C2Cl)C1 3335AH [0,1,0,1,0,0|2,0,0]=4 104 B13R2.5179 O=C1CCC2=C(C=CC=C2F)C1 3215AJ [0,1,0,1,0,0|2,0,0]=4 105 B9R1.33 NCCC1=C(Br)SC=C1 4754AC [1,0,0,0,1,0|1,1,0]=4