0 B12R1.235 CC1=CC(CCl)=C(O)C(CCl)=C1 1032AQ [0,0,0,0,0,0|4,0,0]=4 1 B12R1.235 CCC1=CC(Br)=CC(CC)=C1N 8304AB [0,0,0,0,0,0|4,0,0]=4 2 B12R1.235 COC1=C(N)C(CO)=CC(Br)=C1 6399AC [0,0,0,0,0,0|4,0,0]=4 3 B11R1.8 CC1=CC(C)=C(Cl)C(C=O)=C1 Y3964 [1,0,0,0,0,0|3,0,0]=4 4 B11R1.8 COC1=C(N)C(Cl)=CC(Cl)=C1 6000AC [1,0,0,0,0,0|3,0,0]=4 5 B11R1.8 COC1=C(O)C(C)=CC(Br)=C1 0959AF [1,0,0,0,0,0|1,0,0]=2 6 B11R1.8 COC1=CC(Br)=CC(C)=C1N 4240AB [1,0,0,0,0,0|2,0,0]=3 7 B11R1.8 COC1=CC(Br)=CC(F)=C1I Z0172 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.9 COC1=CC(Br)=CC(CO)=C1 V4773 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.9 COC1=CC(C)=CC(C#N)=C1 6455AB [1,0,0,0,0,0|2,0,0]=3 10 B11R1.9 COC1=CC(CN)=CC(F)=C1 5883AJ [1,0,0,0,0,0|3,0,0]=4 11 B11R1.9 COC1=CC(CO)=CC(Cl)=C1 9885AL [1,0,0,0,0,0|3,0,0]=4 12 B11R1.9 COC1=CC(Cl)=CC(CCl)=C1 9785AH [1,0,0,0,0,0|3,0,0]=4 13 B11R1.9 COC1=CC(Cl)=NC(OC)=C1 X8872 [1,0,0,0,0,0|2,0,0]=3 14 B11R1.9 COC1=CC(N)=CC(OC)=N1 8938AA [1,0,0,0,0,0|2,0,0]=3 15 B11R1.9 COC1=CC(OC)=NC(S)=N1 D418 [1,0,0,0,0,0|3,0,0]=4 16 B11R1.9 COC1=NC(OC)=NC(C)=C1 2199AC [1,0,0,0,0,0|2,0,0]=3 17 B11R1.9 COC1=NC(SC)=NC(C)=C1 Z2888 [1,0,0,0,0,0|2,1,0]=4 18 B11R1.267 CCC1=CC=CC(CC)=C1O X8517 [1,0,0,0,0,0|2,0,0]=3 19 B11R1.267 COC1=CC=CC(CN)=C1O 4232AD [1,0,0,0,0,0|2,0,0]=3 20 B11R1.267 COC1=CC=CC(CO)=C1C 0657AE [1,0,0,0,0,0|3,0,0]=4 21 B11R1.267 COC1=CN=CC(OC)=C1Br Z3823 [1,0,0,0,0,0|2,0,0]=3 22 B11R1.267 COC1=NC=NC(OC)=C1N X5145 [1,0,0,0,0,0|3,0,0]=4 23 B13R1.299 COC1=C(O)C(C(=O)O)=CC(Br)=C1 4306AB [0,1,0,0,0,0|3,0,0]=4 24 B13R1.302 COC1=C(OC)C(C#N)=CC(Br)=C1 V3658 [0,1,0,0,0,0|3,0,0]=4 25 B13R1.424 CCC1=C(N)C(CC)=C(N)C(C)=C1 0718AB [0,1,0,0,0,0|3,0,0]=4 26 B13R1.433 CCC1=CC(C=O)=CC(CC)=C1O 0746AC [0,1,0,0,0,0|2,0,1]=4 27 B13R1.433 COC1=CC(C#N)=CC(OC)=C1O 8789AE [0,1,0,0,0,0|0,0,1]=2 28 B13R1.433 COC1=CC(OC)=C(N)C(OC)=C1 7638AC [0,1,0,0,0,0|1,0,0]=2 29 B13R1.433 COC1=CC(OC)=C(O)C(OC)=C1 0518AB [0,1,0,0,0,0|0,0,0]=1 30 B13R2.623 COC1=CC(C)=CC2=C1C=CN2 4382AC [0,0,0,1,0,0|2,0,1]=4 31 B10R1.2 CC1=C(O)C(CO)=CC=C1 9889AL [2,0,0,0,0,0|2,0,0]=4 32 B10R1.2 CCC1=CC=CC(C)=C1C Y4741 [2,0,0,0,0,0|2,0,0]=4 33 B10R1.2 COC1=C(Cl)C(Br)=CC=C1 V3807 [2,0,0,0,0,0|2,0,0]=4 34 B10R1.2 COC1=C(I)C(O)=CC=C1 4161AA [2,0,0,0,0,0|1,0,0]=3 35 B10R1.2 COC1=C(N)C(N)=CC=C1 5908AJ [2,0,0,0,0,0|2,0,0]=4 36 B10R1.2 COC1=C(N)C(O)=CC=C1 Z4717 [2,0,0,0,0,0|1,0,0]=3 37 B10R1.2 COC1=C(O)C(I)=CC=C1 2096AA [2,0,0,0,0,0|1,0,0]=3 38 B10R1.2 COC1=CC=CC(C)=C1F Z1163 [2,0,0,0,0,0|1,0,0]=3 39 B10R1.2 COC1=CC=CC(F)=C1Cl Z0599 [2,0,0,0,0,0|2,0,0]=4 40 B10R1.2 COC1=NC=CC(C)=C1N 9447AA [2,0,0,0,0,0|2,0,0]=4 41 B10R1.2 CSC1=C(F)C(O)=CC=C1 Y3946 [2,0,0,0,0,0|1,1,0]=4 42 B10R1.8 CC1=CC(C)=CC(CCl)=C1 2613AB [2,0,0,0,0,0|2,0,0]=4 43 B10R1.8 CC1=CC(O)=CC(CO)=C1 9062AB [2,0,0,0,0,0|2,0,0]=4 44 B10R1.8 CCC1=CC(C)=CC(C)=C1 6770AL [2,0,0,0,0,0|1,0,0]=3 45 B10R1.8 CCC1=CC(C)=CC(O)=C1 0816AC [2,0,0,0,0,0|1,0,0]=3 46 B10R1.8 CNC1=CC(C)=NC(C)=C1 0035AB [2,0,0,0,0,0|2,0,0]=4 47 B10R1.8 COC1=CC(I)=CC(O)=C1 3291AC [2,0,0,0,0,0|1,0,0]=3 48 B10R1.8 COC1=NC(C)=CC(Br)=C1 1674AA [2,0,0,0,0,0|2,0,0]=4 49 B10R1.8 CSC1=CC(C)=CC(C)=C1 Z0768 [2,0,0,0,0,0|0,1,0]=3 50 B10R1.22 CC1=C(C)C(O)=CC(O)=C1 7458AB [2,0,0,0,0,0|2,0,0]=4 51 B10R1.22 CC1=C(F)C(O)=CC(Br)=C1 Z1544 [2,0,0,0,0,0|2,0,0]=4 52 B10R1.22 CC1=C(O)C(N)=CC(F)=C1 6121AA [2,0,0,0,0,0|2,0,0]=4 53 B10R1.22 CC1=C(O)C=C(O)C=C1O 7879AF [2,0,0,0,0,0|2,0,0]=4 54 B10R1.22 CC1=CC(Br)=C(F)C(O)=C1 Z6550 [2,0,0,0,0,0|2,0,0]=4 55 B10R1.22 CC1=CC(C)=C(Br)C(C)=N1 W9924 [2,0,0,0,0,0|2,0,0]=4 56 B10R1.22 CC1=CC(C)=C(Cl)C(Br)=C1 Z1120 [2,0,0,0,0,0|2,0,0]=4 57 B10R1.22 CC1=CC(C)=C(F)C(C)=C1 2394AE [2,0,0,0,0,0|1,0,0]=3 58 B10R1.22 CC1=CC(Cl)=C(O)C(Cl)=C1 S771 [2,0,0,0,0,0|2,0,0]=4 59 B10R1.22 CC1=CC(F)=CC(C)=C1Cl 7485AA [2,0,0,0,0,0|2,0,0]=4 60 B10R1.22 CC1=CC(N)=CC(C)=C1C 5093AC [2,0,0,0,0,0|2,0,0]=4 61 B10R1.22 CC1=CC(O)=C(C)C(O)=C1 6651AB [2,0,0,0,0,0|1,0,0]=3 62 B10R1.22 OC1=C(O)C(F)=CC(Br)=C1 3932AC [2,0,0,0,0,0|2,0,0]=4 63 B10R1.22 OC1=CC(Cl)=CC(F)=C1O 9543AF [2,0,0,0,0,0|2,0,0]=4 64 B10R1.22 OC1=CC(O)=C(Br)C(O)=C1 3030AC [2,0,0,0,0,0|2,0,0]=4 65 B10R1.30 COC1=CC(=O)C=CC1=O 2859AB [2,0,0,0,0,0|1,0,1]=4 66 B10R1.30 COC1=CC(Br)=CN=C1O Z8058 [2,0,0,0,0,0|2,0,0]=4 67 B10R1.30 COC1=CC(C)=NC=C1Br 4514AC [2,0,0,0,0,0|2,0,0]=4 68 B10R1.30 COC1=CC(F)=CC=C1C Z1199 [2,0,0,0,0,0|2,0,0]=4 69 B10R1.30 COC1=CC(F)=CC=C1F F188 [2,0,0,0,0,0|2,0,0]=4 70 B10R1.30 COC1=CC(F)=CC=C1I Z0604 [2,0,0,0,0,0|2,0,0]=4 71 B10R1.30 COC1=CC(I)=CC=C1N V5279 [2,0,0,0,0,0|2,0,0]=4 72 B10R1.30 COC1=CC(N)=CC=C1F V4508 [2,0,0,0,0,0|2,0,0]=4 73 B10R1.30 CSC1=CC(C)=CC=C1Br Z0188 [2,0,0,0,0,0|1,1,0]=4 74 B10R1.172 CCC1=CC=CC(CC)=C1 9285AJ [2,0,0,0,0,0|2,0,0]=4 75 B10R1.172 CNC1=CC=CC(NC)=C1 4379AJ [2,0,0,0,0,0|2,0,0]=4 76 B10R1.172 CNC1=CC=CC(OC)=C1 V4822 [2,0,0,0,0,0|1,0,0]=3 77 B10R1.172 COC1=CCC=C(OC)C1 0616AQ [2,0,0,0,0,0|0,0,2]=4 78 B10R1.172 COC1=NC=CC(SC)=C1 Z0163 [2,0,0,0,0,0|1,1,0]=4 79 B12R1.234 COC1=C(C#N)C(C)=CC(C)=C1 3271AC [1,1,0,0,0,0|1,0,0]=3 80 B12R1.234 COC1=C(C)C=C(C)C=C1C=O 5235AD [1,1,0,0,0,0|2,0,0]=4 81 B12R1.300 COC1=CC(Cl)=C(N)C(OC)=C1 2753AC [1,1,0,0,0,0|2,0,0]=4 82 B12R1.300 COC1=CC(OC)=C(Br)C(C)=C1 0452AQ [1,1,0,0,0,0|1,0,0]=3 83 B12R1.11 COC1=CC(B(O)O)=CC(C)=C1 X0963 [1,1,0,0,0,0|2,0,0]=4 84 B12R1.11 COC1=CC(Br)=CC(C(C)=O)=C1 1554AA [1,1,0,0,0,0|2,0,0]=4 85 B12R1.11 COC1=CC(C(N)=O)=CC(C)=C1 5032AA [1,1,0,0,0,0|2,0,0]=4 86 B12R1.11 COC1=CC(C)=CC(C(C)=O)=C1 5959AB [1,1,0,0,0,0|1,0,0]=3 87 B12R1.440 COC1=C(O)C(C(C)=O)=CC=C1 0906AC [1,1,0,0,0,0|1,0,0]=3 88 B12R1.654 COC1=CC=C(N)C(OC)=C1F Z0328 [1,1,0,0,0,0|1,0,0]=3 89 B12R1.1879 COC1=CN=CC(OC)=C1C=O 9449AJ [1,1,0,0,0,0|1,0,1]=4 90 B14R1.351 COC1=C(OC)C(B(O)O)=CC(C)=C1 4202AH [0,2,0,0,0,0|2,0,0]=4 91 B14R1.347 COC1=CC(C)=CC(OC)=C1B(O)O 4203AH [0,2,0,0,0,0|0,0,0]=2 92 B14R1.347 COC1=CC(Cl)=CC(OC)=C1B(O)O 1456AA [0,2,0,0,0,0|1,0,0]=3 93 B12R2.315 BrCC1=C2OCOC2=CC=C1 Z3805 [1,0,0,1,0,0|2,0,0]=4 94 B12R2.315 COC1=C2OC=CC2=CC=C1 W8060 [1,0,0,1,0,0|1,0,1]=4 95 B12R2.315 COC1=CC=CC2=C1NCC2 3908AB [1,0,0,1,0,0|2,0,0]=4 96 B12R2.315 NCC1=C2OCOC2=CC=C1 W3966 [1,0,0,1,0,0|2,0,0]=4 97 B14R2.1101 COC1=C2OCOC2=CC(CN)=C1 0236AD [0,1,0,1,0,0|0,0,0]=2 98 B12R1.450 COC1=CC(Br)=C(OC)C=C1C X9851 [0,0,0,0,1,1|1,0,0]=3 99 B12R1.450 COC1=CC(Cl)=C(OC)C=C1Cl 7377AL [0,0,0,0,1,1|2,0,0]=4