0 B11R2.20 C1=CC2=C(C=N1)N=CCN2 D87594 [0,0,0,0,0,0|4,0,0]=4 1 B11R2.20 C1=CC2=CC=NC=C2C=N1 69947 [0,0,0,0,0,0|1,0,2]=3 2 B11R2.20 C1=CN=C2CNCCC2=C1 P10652 [0,0,0,0,0,0|1,0,2]=3 3 B11R2.20 C1=NC=C2CCNCC2=N1 P19161 [0,0,0,0,0,0|2,0,2]=4 4 B12R2.24 BrC1=CC2=C(C=C1)CCN=C2 AT22654 [0,1,0,0,0,0|2,0,0]=3 5 B12R2.24 BrC1=NC2=C(C=C1)CNCC2 C13599 [0,1,0,0,0,0|1,0,2]=4 6 B12R2.24 Br[C@H]1CCC2=C(C=CC=C2)C1 F13406 [0,1,0,0,0,0|1,0,2]=4 7 B12R2.24 CC1=CC2=C(C=C1)CNCC2 C15799 [0,1,0,0,0,0|0,0,2]=3 8 B12R2.24 CC1=CC2=C(C=CC=C2)CN1 F12577 [0,1,0,0,0,0|0,0,0]=1 9 B12R2.24 C[C@@H]1CNC2=C(C=CC=C2)C1 F50994 [0,1,0,0,0,0|2,0,1]=4 10 B12R2.24 C[C@H]1CC2=C(C=CC=C2)CN1 12711 [0,1,0,0,0,0|0,0,2]=3 11 B12R2.24 C[C@H]1CC2=C(C=CC=C2)CN1 C74526 [0,1,0,0,0,0|0,0,2]=3 12 B12R2.24 ClC1=CC2=C(C=C1)CCCC2 Y10725 [0,1,0,0,0,0|1,0,2]=4 13 B12R2.24 ClC1=CC2=C(C=C1)COCC2 N14606 [0,1,0,0,0,0|1,0,2]=4 14 B12R2.24 ClC1=CN=C2CCNCC2=C1 D87527 [0,1,0,0,0,0|1,0,2]=4 15 B12R2.24 ClC1=NC2=CC=CC=C2N=N1 D78678 [0,1,0,0,0,0|2,0,1]=4 16 B12R2.24 FC1=CC2=C(C=C1)CCNC2 76409 [0,1,0,0,0,0|0,0,2]=3 17 B12R2.24 FC1=CC2=C(C=C1)COCC2 N14605 [0,1,0,0,0,0|1,0,2]=4 18 B12R2.24 FC1=CC2=NC=NC=C2C=C1 D75735 [0,1,0,0,0,0|1,0,2]=4 19 B12R2.24 NC1=CC2=CC=CC=C2N=N1 W16974 [0,1,0,0,0,0|1,0,1]=3 20 B12R2.24 NC1=CC2=CC=CN=C2N=C1 N10431 [0,1,0,0,0,0|3,0,0]=4 21 B12R2.24 NC1=CC=C2N=CC=CC2=C1 F19169 [0,1,0,0,0,0|2,0,0]=3 22 B12R2.24 N[C@@H]1COC2=C(C=CC=C2)C1 F20762 [0,1,0,0,0,0|2,0,1]=4 23 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 F13193 [0,1,0,0,0,0|1,0,2]=4 24 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 F18883 [0,1,0,0,0,0|1,0,2]=4 25 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 F18889 [0,1,0,0,0,0|1,0,2]=4 26 B12R2.24 O=C1C=CC2=C(C=CC=N2)N1 97799 [0,1,0,0,0,0|3,0,0]=4 27 B12R2.24 O=C1CC2=C(C=NC=C2)CN1 86461 [0,1,0,0,0,0|1,0,1]=3 28 B12R2.24 O=C1COC2=C(C=CC=C2)C1 F53084 [0,1,0,0,0,0|2,0,1]=4 29 B12R2.24 O=C1N=CC2=C(C=CC=C2)N1 F15801 [0,1,0,0,0,0|1,0,2]=4 30 B12R2.24 O=C1NC2=C(C=CC=C2)CO1 AC3815 [0,1,0,0,0,0|2,0,0]=3 31 B12R2.24 O=C1NC2=C(C=CC=N2)CO1 AC7037 [0,1,0,0,0,0|3,0,0]=4 32 B12R2.24 O=C1NC2=C(C=CN=C2)CO1 AC5095 [0,1,0,0,0,0|3,0,0]=4 33 B12R2.1081 C=C1CCCC2=C1C=CC=C2 D87874 [0,1,0,0,0,0|1,0,1]=3 34 B12R2.1081 CC1=C2C=NC=CC2=CC=C1 D87678 [0,1,0,0,0,0|0,0,2]=3 35 B12R2.1081 CC1=CC=CC2=C1CCOC2 N14603 [0,1,0,0,0,0|1,0,2]=4 36 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 71815 [0,1,0,0,0,0|0,0,2]=3 37 B12R2.1081 ClC1=C2CCCNC2=CC=C1 N14207 [0,1,0,0,0,0|2,0,1]=4 38 B12R2.1081 ClC1=C2CCNCC2=CC=C1 24212 [0,1,0,0,0,0|0,0,2]=3 39 B12R2.1081 ClC1=C2CCOCC2=CC=C1 N14602 [0,1,0,0,0,0|1,0,2]=4 40 B12R2.1081 ClC1=NC=CC2=C1CCNC2 F53692 [0,1,0,0,0,0|1,0,2]=4 41 B12R2.1081 ClC1=NN=NC2=CC=CC=C21 AT14199 [0,1,0,0,0,0|2,0,1]=4 42 B12R2.1081 Cl[C@H]1CCCC2=C1C=CC=C2 A11734 [0,1,0,0,0,0|1,0,2]=4 43 B12R2.1081 FC1=C2CCOCC2=CC=C1 N14601 [0,1,0,0,0,0|1,0,2]=4 44 B12R2.1081 FC1=CC=NC2=CC=CC=C12 P19300 [0,1,0,0,0,0|2,0,0]=3 45 B12R2.1081 NC1=C2CNCCC2=CC=C1 C10171 [0,1,0,0,0,0|0,0,2]=3 46 B12R2.1081 N[C@H]1CSCC2=C1C=CC=C2 SC2891 [0,1,0,0,0,0|1,0,2]=4 47 B12R2.1081 O=C1C=CNC2=CC=CN=C12 N16989 [0,1,0,0,0,0|3,0,0]=4 48 B12R2.1081 O=C1CNCC2=C1C=CC=C2 F12400 [0,1,0,0,0,0|0,0,1]=2 49 B12R2.1081 O=C1NC=CC2=C1C=CN=C2 80790 [0,1,0,0,0,0|1,0,1]=3 50 B12R2.1081 O=C1NC=CC2=C1C=NC=C2 37304 [0,1,0,0,0,0|1,0,1]=3 51 B12R2.1081 O=C1NC=CC2=C1C=NC=N2 AT17233 [0,1,0,0,0,0|2,0,1]=4 52 B12R2.1081 O=C1NC=NC2=CC=CN=C12 P10231 [0,1,0,0,0,0|2,0,1]=4 53 B12R2.1081 O=C1NCCC2=C1C=CN=C2 D84896 [0,1,0,0,0,0|3,0,0]=4 54 B12R2.1081 O=C1NN=CC2=C1C=NC=C2 84846 [0,1,0,0,0,0|2,0,1]=4 55 B12R2.1081 O=C1NN=CC2=CC=CN=C12 84844 [0,1,0,0,0,0|2,0,1]=4 56 B12R2.1081 O=C1OC=NC2=C1C=CC=C2 D72797 [0,1,0,0,0,0|2,0,1]=4 57 B12R2.1081 OC1=C2CCNCC2=CC=C1 20736 [0,1,0,0,0,0|0,0,2]=3 58 B12R2.1081 OC1=C2CNCCC2=CC=C1 AT24057 [0,1,0,0,0,0|0,0,2]=3 59 B12R2.1081 OC1=C2CNCCC2=CC=C1 C15586 [0,1,0,0,0,0|0,0,2]=3 60 B12R2.1081 OC1=C2OCCCC2=CC=C1 76490 [0,1,0,0,0,0|2,0,1]=4 61 B12R2.1081 OC1=CC=NC2=NC=CC=C12 F20689 [0,1,0,0,0,0|3,0,0]=4 62 B12R2.1081 OC1=NC=CC2=C1CNCC2 F53632 [0,1,0,0,0,0|1,0,2]=4 63 B12R2.1081 OC1=NC=CC2=CC=CN=C21 54218 [0,1,0,0,0,0|1,0,2]=4 64 B12R2.1081 O[C@H]1CNCC2=C1C=CC=C2 95583 [0,1,0,0,0,0|0,0,2]=3 65 B12R2.1081 O[C@H]1CNCC2=C1C=CC=C2 F13197 [0,1,0,0,0,0|0,0,2]=3 66 B12R2.1081 [2H]C1=CC=CC2=CC=CC=C12 D98917 [0,1,0,0,0,0|1,0,1]=3 67 B12R2.1081 [O-][N+]1=CC=CC2=NC=CC=C21 F15616 [0,1,0,0,0,0|3,0,0]=4 68 B10R1.4 CC1=C(CC=O)C=CC=C1 W16821 [0,0,1,0,0,0|1,0,1]=3 69 B10R1.4 CC1=C(CON)C=CC=C1 D77271 [0,0,1,0,0,0|1,0,1]=3 70 B10R1.4 CCCC1=C(C)C=CC=C1 T71577 [0,0,1,0,0,0|1,0,2]=4 71 B10R1.4 CNCC1=C(F)C=CC=N1 P10655 [0,0,1,0,0,0|2,0,1]=4 72 B10R1.4 CNCC1=C(F)C=CC=N1 P20450 [0,0,1,0,0,0|2,0,1]=4 73 B10R1.4 CNCC1=C(N)C=CC=C1 F13330 [0,0,1,0,0,0|1,0,1]=3 74 B10R1.4 NNCC1=C(Cl)C=CC=C1 W12211 [0,0,1,0,0,0|2,0,0]=3 75 B10R1.4 O=CCC1=C(Cl)C=CC=C1 W16822 [0,0,1,0,0,0|2,0,1]=4 76 B10R1.17 CNCCC1=CC=CN=C1 C73747 [0,0,1,0,0,0|1,0,2]=4 77 B10R1.17 CNCCC1=CC=NC=C1 AR1715 [0,0,1,0,0,0|1,0,2]=4 78 B10R1.17 CNNCC1=NC=CC=C1 30190 [0,0,1,0,0,0|2,0,1]=4 79 B10R1.17 NC\C=C\C1=CC=CC=C1 A12523 [0,0,1,0,0,0|2,0,0]=3 80 B10R1.17 NNCCC1=CC=CC=C1 AC4670 [0,0,1,0,0,0|1,0,2]=4 81 B10R1.17 NOCCC1=CC=CC=C1 C10179 [0,0,1,0,0,0|3,0,0]=4 82 B10R1.17 O=CCCC1=NC=CC=C1 P20552 [0,0,1,0,0,0|3,0,0]=4 83 B10R1.17 O=CCOC1=CC=CC=C1 C15303 [0,0,1,0,0,0|3,0,0]=4 84 B10R1.17 O=CNCC1=NC=CC=C1 AC6369 [0,0,1,0,0,0|2,0,0]=3 85 B10R1.17 O=C\C=C\C1=CC=NC=C1 T72403 [0,0,1,0,0,0|1,0,2]=4 86 B10R1.17 OC\C=C\C1=CC=NC=C1 AC1120 [0,0,1,0,0,0|3,0,0]=4 87 B10R1.20 CNC1=C(CO)C=CC=C1 C74490 [0,0,1,0,0,0|2,0,1]=4 88 B10R1.20 COC1=C(CN)C=CN=C1 P16442 [0,0,1,0,0,0|2,0,1]=4 89 B10R1.20 COC1=C(CN)N=CC=C1 O10088 [0,0,1,0,0,0|2,0,1]=4 90 B10R1.20 COC1=C(NN)C=CC=C1 71208 [0,0,1,0,0,0|2,0,1]=4 91 B10R1.20 COC1=NC=CC=C1CN 36590 [0,0,1,0,0,0|2,0,1]=4 92 B10R1.20 N#CC1=NC=CC=C1CN 92898 [0,0,1,0,0,0|2,0,1]=4 93 B12R3.12 C1=CC2=C(C=C1)C3OC3C2 F51253 [0,0,0,1,0,0|1,0,2]=4 94 B10R2.7 C1=CC2=C(C=C1)SCO2 76474 [0,0,0,0,1,0|2,0,1]=4 95 B10R2.7 C1=CC2=C(C=C1)SCS2 D71935 [0,0,0,0,1,0|2,0,1]=4 96 B10R2.7 C1=CC2=C(C=CO2)C=N1 D74565 [0,0,0,0,1,0|2,0,0]=3 97 B10R2.7 C1=CC2=C(C=N1)NN=C2 W10136 [0,0,0,0,1,0|2,0,0]=3 98 B10R2.7 C1=CC2=C(CNCC2)S1 P10653 [0,0,0,0,1,0|1,0,2]=4 99 B10R2.7 C1=CC2=CC=NN2N=C1 L10191 [0,0,0,0,1,0|2,0,1]=4 100 B10R2.7 C1=CC2=CN=NN2C=C1 31900 [0,0,0,0,1,0|2,0,1]=4 101 B10R2.7 C1=CC2=NNC=C2N=C1 F18246 [0,0,0,0,1,0|2,0,0]=3 102 B10R2.7 C1=CN=C2CNCC2=N1 F12463 [0,0,0,0,1,0|2,0,1]=4 103 B10R2.7 C1=CN=C2NCCC2=C1 C13729 [0,0,0,0,1,0|1,0,2]=4 104 B12R2.41 C1=CC2=C(C=C1)NCCC=C2 74521 [0,0,0,0,0,1|1,0,0]=2 105 B12R2.41 C1=CC2=C(C=C1)NCCNC2 66604 [0,0,0,0,0,1|0,0,2]=3 106 B12R2.41 C1=CC2=C(C=C1)NCCOC2 98337 [0,0,0,0,0,1|1,0,2]=4 107 B12R2.41 C1=CC2=C(C=C1)OCCCN2 VT1384 [0,0,0,0,0,1|2,0,1]=4 108 B12R2.41 C1=CC2=C(C=C1)OCCNC2 C80018 [0,0,0,0,0,1|0,0,2]=3 109 B12R2.41 C1=CN=C2NCCNCC2=C1 AT20009 [0,0,0,0,0,1|1,0,2]=4 110 B9R1.8 CNNC1=CC=CC=C1 C77159 [1,0,1,0,0,0|1,0,0]=3 111 B9R1.8 FCCC1=CC=CC=C1 75534 [1,0,1,0,0,0|1,0,1]=4 112 B9R1.8 NCCC1=CC=CC=C1 T71816 [1,0,1,0,0,0|0,0,2]=4 113 B9R1.8 NCCC1=CC=CC=C1 T72591 [1,0,1,0,0,0|0,0,2]=4 114 B9R1.8 NNCC1=NC=CC=C1 P10521 [1,0,1,0,0,0|2,0,0]=4 115 B9R1.15 C=CC1=C(C)C=CC=C1 T72704 [1,0,1,0,0,0|0,0,0]=2 116 B9R1.15 C=CC1=C(C)C=CN=C1 P11580 [1,0,1,0,0,0|1,0,0]=3 117 B9R1.15 C=CC1=CC=CN=C1F P13082 [1,0,1,0,0,0|2,0,0]=4 118 B9R1.15 NC1=C(C=O)C=NC=C1 W12249 [1,0,1,0,0,0|2,0,0]=4 119 B9R1.15 NCC1=C(Br)C=NC=C1 98160 [1,0,1,0,0,0|2,0,0]=4 120 B9R1.15 NCC1=C(Cl)C=CN=C1 C11073 [1,0,1,0,0,0|2,0,0]=4 121 B9R1.15 NCC1=C(F)C=CN=C1 C90218 [1,0,1,0,0,0|2,0,0]=4 122 B9R1.15 NCC1=C(I)C=CC=C1 AT26620 [1,0,1,0,0,0|1,0,0]=3 123 B9R1.15 NCC1=C(O)C=CC=N1 C73700 [1,0,1,0,0,0|2,0,0]=4 124 B9R1.15 NCC1=C(O)C=CN=C1 AT18117 [1,0,1,0,0,0|2,0,0]=4 125 B9R1.15 NCC1=CC=CN=C1Cl 37571 [1,0,1,0,0,0|2,0,0]=4 126 B9R1.15 NCC1=CC=CN=C1N CL0345 [1,0,1,0,0,0|2,0,0]=4 127 B9R1.15 NCC1=[N+]([O-])C=CC=C1 D86206 [1,0,1,0,0,0|2,0,0]=4 128 B9R1.15 [2H]CC1=C(F)C=CC=C1 D99779 [1,0,1,0,0,0|2,0,0]=4 129 B11R1.13 C=CCC1=C(O)C(C)=CC=C1 AC5932 [0,1,1,0,0,0|2,0,0]=4 130 B11R1.17 CCNCC1=C(Cl)C=CC=C1 C16114 [0,1,1,0,0,0|1,0,1]=4 131 B11R1.17 CNCCC1=C(C)C=CC=C1 C78447 [0,1,1,0,0,0|0,0,2]=4 132 B11R1.17 CNCCC1=C(Cl)C=CC=C1 C78279 [0,1,1,0,0,0|1,0,1]=4 133 B11R1.17 O=C\C=C\C1=C(Br)C=CC=C1 W16727 [0,1,1,0,0,0|2,0,0]=4 134 B11R1.17 O=C\C=C\C1=C(O)C=CC=C1 D90980 [0,1,1,0,0,0|2,0,0]=4 135 B11R1.41 COC1=C(CNN)C=CC=C1 P10476 [0,1,1,0,0,0|1,0,1]=4 136 B11R1.81 CNCC1=C(Cl)C=C(F)C=C1 76695 [0,1,1,0,0,0|1,0,1]=4 137 B11R1.81 CNCC1=C(F)C=C(F)C=C1 36787 [0,1,1,0,0,0|1,0,1]=4 138 B11R1.81 NNCC1=C(Br)C=C(F)C=C1 AC5368 [0,1,1,0,0,0|2,0,0]=4 139 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 AC4339 [0,1,1,0,0,0|2,0,0]=4 140 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 P10432 [0,1,1,0,0,0|2,0,0]=4 141 B11R1.81 NNCC1=C(Cl)C=C(F)C=C1 A12240 [0,1,1,0,0,0|2,0,0]=4 142 B11R1.81 NNCC1=C(Cl)C=C(F)C=C1 P10526 [0,1,1,0,0,0|2,0,0]=4 143 B11R1.81 NNCC1=C(F)C=C(Br)C=C1 AC5349 [0,1,1,0,0,0|2,0,0]=4 144 B11R1.81 NNCC1=C(F)C=C(F)C=C1 AC5364 [0,1,1,0,0,0|2,0,0]=4 145 B11R1.81 N\N=C/C1=C(F)C=C(Br)C=C1 A50963 [0,1,1,0,0,0|2,0,0]=4 146 B11R1.86 CC1=C(C[C@H](C)N)C=CC=C1 N10867 [0,1,1,0,0,0|0,0,2]=4 147 B11R1.182 CC1=C(CCN)C=C(Cl)C=C1 AT13431 [0,1,1,0,0,0|0,0,2]=4 148 B11R1.182 CNCC1=C(Cl)C=CC(Cl)=C1 76693 [0,1,1,0,0,0|1,0,1]=4 149 B11R1.182 CNCC1=C(F)C=CC(Br)=C1 36267 [0,1,1,0,0,0|1,0,1]=4 150 B11R1.182 NNCC1=C(Br)C=CC(Cl)=C1 AC5350 [0,1,1,0,0,0|2,0,0]=4 151 B11R1.182 NNCC1=C(Cl)C=CC(F)=C1 AC5377 [0,1,1,0,0,0|2,0,0]=4 152 B11R1.182 NNCC1=C(F)C=CC(Br)=C1 AC5379 [0,1,1,0,0,0|2,0,0]=4 153 B11R1.182 N\N=C\C1=C(F)C=CC(Br)=C1 36791 [0,1,1,0,0,0|2,0,0]=4 154 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15249 [0,1,1,0,0,0|2,0,0]=4 155 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15250 [0,1,1,0,0,0|2,0,0]=4 156 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15251 [0,1,1,0,0,0|2,0,0]=4 157 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15259 [0,1,1,0,0,0|1,0,1]=4 158 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15260 [0,1,1,0,0,0|1,0,1]=4 159 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15261 [0,1,1,0,0,0|1,0,1]=4 160 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15239 [0,1,1,0,0,0|2,0,0]=4 161 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15240 [0,1,1,0,0,0|2,0,0]=4 162 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15241 [0,1,1,0,0,0|2,0,0]=4 163 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15232 [0,1,1,0,0,0|2,0,0]=4 164 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15233 [0,1,1,0,0,0|2,0,0]=4 165 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15234 [0,1,1,0,0,0|2,0,0]=4 166 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15292 [0,1,1,0,0,0|2,0,0]=4 167 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15293 [0,1,1,0,0,0|2,0,0]=4 168 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15294 [0,1,1,0,0,0|2,0,0]=4 169 B11R1.222 CC1=C(C(=O)CO)C=CC=C1 AC4310 [0,1,1,0,0,0|1,0,1]=4 170 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13426 [0,1,1,0,0,0|0,0,2]=4 171 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13427 [0,1,1,0,0,0|0,0,2]=4 172 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13428 [0,1,1,0,0,0|0,0,2]=4 173 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13449 [0,1,1,0,0,0|0,0,2]=4 174 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13450 [0,1,1,0,0,0|0,0,2]=4 175 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13451 [0,1,1,0,0,0|0,0,2]=4 176 B11R1.222 CN[C@@H](C)C1=C(Br)C=CC=C1 N12718 [0,1,1,0,0,0|1,0,1]=4 177 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N12531 [0,1,1,0,0,0|0,0,2]=4 178 B11R1.222 CN[C@@H](C)C1=C(O)C=CC=C1 N12719 [0,1,1,0,0,0|1,0,1]=4 179 B11R1.222 NCC(=O)C1=C(Br)C=CC=C1 W17616 [0,1,1,0,0,0|1,0,1]=4 180 B11R1.605 CNCC1=C(F)C=CC=C1F 36785 [0,1,1,0,0,0|1,0,1]=4 181 B11R1.1 C=CCOC1=CC=C(Br)C=C1 71195 [0,1,1,0,0,0|2,0,0]=4 182 B11R1.1 C=C\C=C\C1=CC=C(F)C=C1 59824 [0,1,1,0,0,0|1,0,1]=4 183 B11R1.1 CNCCC1=CC=C(Br)C=C1 C78422 [0,1,1,0,0,0|0,0,2]=4 184 B11R1.1 CNCCC1=CC=C(C)C=C1 C78074 [0,1,1,0,0,0|0,0,2]=4 185 B11R1.1 CONCC1=CC=C(Br)C=C1 N11596 [0,1,1,0,0,0|1,0,1]=4 186 B11R1.1 ClC1=CC=C(\C=C\CBr)C=C1 72674 [0,1,1,0,0,0|2,0,0]=4 187 B11R1.1 O=CNCC1=CC=C(Cl)C=C1 AB6809 [0,1,1,0,0,0|1,0,0]=3 188 B11R1.1 OC\C=C\C1=CC=C(Br)C=C1 AT26502 [0,1,1,0,0,0|2,0,0]=4 189 B11R1.16 CNC[C@H](C)C1=CC=CC=C1 C11240 [0,1,1,0,0,0|0,0,2]=4 190 B11R1.16 CNC[C@H](O)C1=CC=CC=C1 C11214 [0,1,1,0,0,0|0,0,2]=4 191 B11R1.16 [N-]=[N+]=CC(=O)C1=CC=CC=C1 AT25592 [0,1,1,0,0,0|1,0,1]=4 192 B11R1.24 CC1=CC=CC(CCC=O)=C1 C10532 [0,1,1,0,0,0|2,0,0]=4 193 B11R1.24 CNCCC1=CC=CC(Br)=C1 C78466 [0,1,1,0,0,0|0,0,2]=4 194 B11R1.24 O=CCCC1=CC(O)=CC=C1 F19734 [0,1,1,0,0,0|2,0,0]=4 195 B11R1.24 O=CNCC1=CC=CC(F)=C1 Y10034 [0,1,1,0,0,0|1,0,0]=3 196 B11R1.24 O=C\C=C\C1=CC=CC(F)=C1 FD10704 [0,1,1,0,0,0|2,0,0]=4 197 B11R1.28 CCNCCC1=CC=CC=C1 AC5622 [0,1,1,0,0,0|0,0,2]=4 198 B11R1.28 NCC\C=C\C1=CC=CC=C1 F15194 [0,1,1,0,0,0|1,0,0]=3 199 B11R1.40 CNC(=S)NC1=CC=CC=C1 T72207 [0,1,1,0,0,0|1,0,0]=3 200 B11R1.40 C[C@H](C=O)CC1=CC=CC=C1 F16111 [0,1,1,0,0,0|2,0,0]=4 201 B11R1.91 N=C(N)NCC1=CC=CC=C1 S12114 [0,1,1,0,0,0|1,0,0]=3 202 B11R1.91 NC(N)=NCC1=CC=CC=C1 H10078 [0,1,1,0,0,0|1,0,1]=4 203 B11R1.37 C=CC1=C(OC)C=C(Br)C=C1 88322 [0,1,1,0,0,0|2,0,0]=4 204 B11R1.37 COC1=C(CN)C=C(F)C=C1 N12248 [0,1,1,0,0,0|1,0,1]=4 205 B11R1.37 N#CC1=C(CN)C=C(F)C=C1 43931 [0,1,1,0,0,0|1,0,1]=4 206 B11R1.37 O=CC1=C(CBr)C=C(Br)C=C1 F20272 [0,1,1,0,0,0|2,0,0]=4 207 B11R1.53 C=C(Br)C1=C(OC)C=CC=C1 F18312 [0,1,1,0,0,0|2,0,0]=4 208 B11R1.53 C=CC1=C(C(=O)O)C=CC=C1 O10854 [0,1,1,0,0,0|1,0,1]=4 209 B11R1.53 CCC1=C(C(N)=S)C=CC=C1 F13433 [0,1,1,0,0,0|2,0,0]=4 210 B11R1.53 C[C@H](N)C1=C(C#N)C=CC=C1 Y12983 [0,1,1,0,0,0|1,0,1]=4 211 B11R1.53 C[C@H](N)C1=C(CO)C=CC=C1 Y13010 [0,1,1,0,0,0|1,0,1]=4 212 B11R1.53 O=CC1=C(C(F)F)C=CC=C1 O10520 [0,1,1,0,0,0|2,0,0]=4 213 B11R1.265 COC1=C(CN)C=CC=C1C N12978 [0,1,1,0,0,0|1,0,1]=4 214 B11R1.265 COC1=C(F)C=CC=C1CN N14224 [0,1,1,0,0,0|1,0,1]=4 215 B11R2.1 BrC1=CCC2=C1C=CC=C2 D78625 [0,1,0,0,1,0|0,0,0]=2 216 B11R2.1 CC1=C2C=CC=CC2=NO1 AC6101 [0,1,0,0,1,0|1,0,1]=4 217 B11R2.1 CC1=CNC2=NC=NC=C12 P14369 [0,1,0,0,1,0|2,0,0]=4 218 B11R2.1 CN1C=CC2=C1C=CN=C2 D70942 [0,1,0,0,1,0|1,0,0]=3 219 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 W18948 [0,1,0,0,1,0|0,0,2]=4 220 B11R2.1 ClC1=CN=C2C=CC=CN12 F18114 [0,1,0,0,1,0|1,0,1]=4 221 B11R2.1 ClC1=CNC2=C1C=NC=C2 I11117 [0,1,0,0,1,0|1,0,0]=3 222 B11R2.1 NC1=CNC2=NC=CC=C12 C15185 [0,1,0,0,1,0|1,0,0]=3 223 B11R2.1 NC1=COC2=NC=CC=C12 N13337 [0,1,0,0,1,0|2,0,0]=4 224 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 41003 [0,1,0,0,1,0|0,0,2]=4 225 B11R2.1 N[C@H]1COC2=C1C=CC=C2 I11926 [0,1,0,0,1,0|1,0,1]=4 226 B11R2.1 O=C1NCC2=CN=CN=C12 F52126 [0,1,0,0,1,0|2,0,0]=4 227 B11R2.1 OC1=C2C=CC=NC2=CN1 F18499 [0,1,0,0,1,0|1,0,1]=4 228 B11R2.1 OC1=CN=C2C=CC=CN12 F18394 [0,1,0,0,1,0|1,0,1]=4 229 B11R2.1 OC1=CNC2=C1C=CC=C2 F18139 [0,1,0,0,1,0|0,0,0]=2 230 B11R2.1 OC1=CSC2=C1C=CC=C2 C15915 [0,1,0,0,1,0|1,0,0]=3 231 B11R2.1 ON1N=CC2=C1C=CC=C2 E70293 [0,1,0,0,1,0|1,0,0]=3 232 B11R2.1 O[C@H]1COC2=C1C=CC=C2 AT19563 [0,1,0,0,1,0|1,0,1]=4 233 B11R2.10 CC1=NC2=CC=CN=C2N1 F19908 [0,1,0,0,1,0|2,0,0]=4 234 B11R2.10 ClC1=CC2=C(C=CC=C2)O1 AC6512 [0,1,0,0,1,0|1,0,0]=3 235 B11R2.10 FC1=NC2=C(C=CC=C2)S1 T71604 [0,1,0,0,1,0|1,0,1]=4 236 B11R2.10 N=C1CC2=C(C=CC=C2)N1 30671 [0,1,0,0,1,0|0,0,1]=3 237 B11R2.10 NC1=CC2=C(C=CC=C2)N1 79767 [0,1,0,0,1,0|0,0,0]=2 238 B11R2.10 NC1=CC2=C(C=CC=C2)N1 F13373 [0,1,0,0,1,0|0,0,0]=2 239 B11R2.10 NC1=CC2=CC=CN=C2S1 82785 [0,1,0,0,1,0|2,0,0]=4 240 B11R2.10 NC1=CN2C=CC=CC2=N1 F52309 [0,1,0,0,1,0|1,0,1]=4 241 B11R2.10 NC1=NC2=C(C=CN=C2)N1 AC6593 [0,1,0,0,1,0|2,0,0]=4 242 B11R2.10 NC1=NC2=NC=CC=C2N1 AC8085 [0,1,0,0,1,0|2,0,0]=4 243 B11R2.10 O=C1C=C2C=CC=CN2N1 W16687 [0,1,0,0,1,0|1,0,0]=3 244 B11R2.10 O=C1CC2=C(C=CC=C2)S1 A51238 [0,1,0,0,1,0|1,0,0]=3 245 B11R2.10 O=C1CC2=C(C=NC=C2)N1 61718 [0,1,0,0,1,0|1,0,1]=4 246 B11R2.10 O=C1NC2=C(C=CC=N2)S1 C72885 [0,1,0,0,1,0|2,0,0]=4 247 B11R2.10 O=C1NC2=CC=CN=C2S1 F13119 [0,1,0,0,1,0|2,0,0]=4 248 B11R2.36 BrC1=NC2=C(C=CO2)C=C1 AC2137 [0,1,0,0,1,0|2,0,0]=4 249 B11R2.36 CC1=CC2=C(C=C1)CNC2 71833 [0,1,0,0,1,0|0,0,1]=3 250 B11R2.36 CC1=CC2=C(C=C1)CNC2 W10108 [0,1,0,0,1,0|0,0,1]=3 251 B11R2.36 CC1=CC2=CC=NN2C=C1 51003 [0,1,0,0,1,0|1,0,1]=4 252 B11R2.36 CC1=CN2N=CC=C2C=C1 56903 [0,1,0,0,1,0|1,0,1]=4 253 B11R2.36 CC1=NC=C2CNCC2=C1 F17653 [0,1,0,0,1,0|1,0,1]=4 254 B11R2.36 CC1=NC=C2CNCC2=C1 S11542 [0,1,0,0,1,0|1,0,1]=4 255 B11R2.36 ClC1=CC2=C(C=C1)OC=C2 A51024 [0,1,0,0,1,0|1,0,0]=3 256 B11R2.36 ClC1=CC2=NC=CN2C=C1 F13942 [0,1,0,0,1,0|1,0,1]=4 257 B11R2.36 ClC1=CN2C=CC=C2C=C1 SC1109 [0,1,0,0,1,0|1,0,1]=4 258 B11R2.36 ClC1=CN=C2CNCC2=C1 F19783 [0,1,0,0,1,0|1,0,1]=4 259 B11R2.36 FC1=CC2=C(C=C1)CC=C2 N14223 [0,1,0,0,1,0|0,0,0]=2 260 B11R2.36 FC1=CC2=C(C=C1)CCC2 36515 [0,1,0,0,1,0|0,0,2]=4 261 B11R2.36 FC1=CC2=C(C=C1)N=CO2 AC5634 [0,1,0,0,1,0|1,0,1]=4 262 B11R2.36 FC1=CC2=C(C=C1)SC=C2 P15215 [0,1,0,0,1,0|1,0,0]=3 263 B11R2.36 IC1=CC2=C(C=C1)CCC2 C12643 [0,1,0,0,1,0|0,0,2]=4 264 B11R2.36 IC1=CC2=C(C=C1)CNC2 32000 [0,1,0,0,1,0|0,0,1]=3 265 B11R2.36 IC1=CC2=C(C=C1)SC=N2 D78574 [0,1,0,0,1,0|1,0,1]=4 266 B11R2.36 IC1=CC2=NC=CN2C=C1 O11657 [0,1,0,0,1,0|1,0,1]=4 267 B11R2.36 IC1=CN=C2C=NNC2=C1 91805 [0,1,0,0,1,0|2,0,0]=4 268 B11R2.36 IC1=CN=C2NN=CC2=C1 AT18494 [0,1,0,0,1,0|2,0,0]=4 269 B11R2.36 IC1=NC2=C(C=CN2)C=C1 68997 [0,1,0,0,1,0|1,0,0]=3 270 B11R2.36 NC1=CC2=C(C=C1)CNC2 SC4171 [0,1,0,0,1,0|0,0,1]=3 271 B11R2.36 NC1=CC2=C(C=C1)OCC2 88994 [0,1,0,0,1,0|1,0,1]=4 272 B11R2.36 NC1=CN=C2N=CNC2=C1 C74684 [0,1,0,0,1,0|2,0,0]=4 273 B11R2.36 NC1=NC2=C(C=CN2)C=C1 30500 [0,1,0,0,1,0|1,0,0]=3 274 B11R2.36 NC1=NC2=C(N=C1)NC=C2 C14879 [0,1,0,0,1,0|2,0,0]=4 275 B11R2.36 O=C1N=CC2=C(NC=C2)N1 D73411 [0,1,0,0,1,0|2,0,0]=4 276 B11R2.36 OC1=CC2=C(C=CS2)C=C1 A11012 [0,1,0,0,1,0|1,0,0]=3 277 B11R2.36 OC1=CC2=C(C=CS2)N=C1 36039 [0,1,0,0,1,0|2,0,0]=4 278 B11R2.36 OC1=CN=C2NC=NC2=C1 F18727 [0,1,0,0,1,0|2,0,0]=4 279 B11R2.36 SC1=CC2=C(C=C1)NN=C2 F18088 [0,1,0,0,1,0|1,0,0]=3 280 B11R2.36 [O-][N+]1=CC2=C(C=C1)N=CN2 F17476 [0,1,0,0,1,0|2,0,0]=4 281 B11R2.36 [O-][N+]1=CC2=C(C=C1)NC=N2 CS2013 [0,1,0,0,1,0|2,0,0]=4 282 B11R2.106 BrC1=C2CCOC2=CC=C1 F12556 [0,1,0,0,1,0|1,0,1]=4 283 B11R2.106 BrC1=NC=CC2=C1C=CS2 D74403 [0,1,0,0,1,0|2,0,0]=4 284 B11R2.106 BrC1=NC=CC2=C1CNC2 D97047 [0,1,0,0,1,0|1,0,1]=4 285 B11R2.106 BrC1=NC=NC2=C1NC=C2 FD7079 [0,1,0,0,1,0|2,0,0]=4 286 B11R2.106 CC1=C2C=CNC2=CN=C1 P11545 [0,1,0,0,1,0|1,0,0]=3 287 B11R2.106 CC1=C2N=CNC2=CC=C1 31265 [0,1,0,0,1,0|1,0,0]=3 288 B11R2.106 CC1=CC=CC2=C1CNC2 W10109 [0,1,0,0,1,0|0,0,1]=3 289 B11R2.106 CC1=CC=CC2=C1N=CO2 F18678 [0,1,0,0,1,0|1,0,1]=4 290 B11R2.106 CC1=CC=CC2=C1N=NN2 C80091 [0,1,0,0,1,0|2,0,0]=4 291 B11R2.106 ClC1=C2C=COC2=NC=C1 P12454 [0,1,0,0,1,0|2,0,0]=4 292 B11R2.106 ClC1=C2CCCC2=CC=C1 N13077 [0,1,0,0,1,0|0,0,2]=4 293 B11R2.106 ClC1=C2CNCC2=CC=C1 FD13081 [0,1,0,0,1,0|0,0,1]=3 294 B11R2.106 ClC1=C2CNCC2=NC=C1 S11449 [0,1,0,0,1,0|1,0,1]=4 295 B11R2.106 ClC1=C2N=CNC2=CN=C1 P13175 [0,1,0,0,1,0|2,0,0]=4 296 B11R2.106 ClC1=C2OC=NC2=CC=C1 AC3340 [0,1,0,0,1,0|1,0,1]=4 297 B11R2.106 ClC1=C2OCCC2=CC=C1 F53809 [0,1,0,0,1,0|1,0,1]=4 298 B11R2.106 FC1=C2NCCC2=CC=C1 C73504 [0,1,0,0,1,0|0,0,2]=4 299 B11R2.106 FC1=C2OC=NC2=CC=C1 AC3567 [0,1,0,0,1,0|1,0,1]=4 300 B11R2.106 IC1=C2CCOC2=CC=C1 E72245 [0,1,0,0,1,0|1,0,1]=4 301 B11R2.106 IC1=C2N=NNC2=CC=C1 O11246 [0,1,0,0,1,0|2,0,0]=4 302 B11R2.106 NC1=C2N=CNC2=CC=C1 P10197 [0,1,0,0,1,0|1,0,0]=3 303 B11R2.106 NC1=C2SC=CC2=CC=N1 P10786 [0,1,0,0,1,0|2,0,0]=4 304 B11R2.106 NC1=CC=CC2=C1C=NO2 D82709 [0,1,0,0,1,0|1,0,1]=4 305 B11R2.106 NC1=CC=CN2N=CC=C12 AT25993 [0,1,0,0,1,0|1,0,1]=4 306 B11R2.106 NC1=NC=CC2=C1NN=C2 F13264 [0,1,0,0,1,0|2,0,0]=4 307 B11R2.106 NC1=NC=CC2=CNN=C21 F17777 [0,1,0,0,1,0|2,0,0]=4 308 B11R2.106 O=C1NC=CC2=CC=CN12 AC2535 [0,1,0,0,1,0|1,0,1]=4 309 B11R2.106 OC1=C2C=NNC2=NC=C1 P10699 [0,1,0,0,1,0|2,0,0]=4 310 B11R2.106 OC1=NC=CC2=C1C=CN2 F30254 [0,1,0,0,1,0|1,0,0]=3 311 B13R2.163 CN1CCNC2=C(C=CC=C2)C1 F53503 [0,1,0,0,0,1|0,0,2]=4 312 B13R2.163 O=C1CCOC2=C(C=CC=C2)N1 W18693 [0,1,0,0,0,1|2,0,0]=4 313 B13R2.163 O=C1CNCC2=C(C=CC=C2)N1 D73440 [0,1,0,0,0,1|0,0,1]=3 314 B13R2.3729 BrC1=CC2=C(C=C1)CCCNC2 D85465 [0,1,0,0,0,1|0,0,2]=4 315 B13R2.3729 BrC1=CC2=C(C=C1)CNCCO2 AT22674 [0,1,0,0,0,1|0,0,2]=4 316 B13R2.3729 BrC1=CC2=C(C=C1)NCCNC2 56018 [0,1,0,0,0,1|0,0,2]=4 317 B13R2.3729 BrC1=CC2=C(C=C1)OCCNC2 54017 [0,1,0,0,0,1|0,0,2]=4 318 B13R2.3729 BrC1=CC2=C(C=C1)SCCNC2 90757 [0,1,0,0,0,1|0,0,2]=4 319 B13R2.3729 ClC1=CC2=C(C=C1)OCCNC2 AT15335 [0,1,0,0,0,1|0,0,2]=4 320 B13R2.3729 ClC1=CC2=C(C=C1)OCCNC2 AT15373 [0,1,0,0,0,1|0,0,2]=4 321 B13R2.3729 FC1=CC2=C(C=C1)CCCNC2 51232 [0,1,0,0,0,1|0,0,2]=4 322 B13R2.3729 FC1=CC2=C(C=C1)OCCNC2 AT16102 [0,1,0,0,0,1|0,0,2]=4 323 B13R2.3729 OC1=CC2=C(C=C1)CCCNC2 C90439 [0,1,0,0,0,1|0,0,2]=4 324 B13R2.3729 OC1=CC2=C(C=C1)CCNCC2 85919 [0,1,0,0,0,1|0,0,2]=4 325 B13R2.3729 OC1=CC2=C(C=C1)CCNCC2 P20370 [0,1,0,0,0,1|0,0,2]=4 326 B13R2.4820 BrC1=C2OCCNCC2=CC=C1 AT22675 [0,1,0,0,0,1|0,0,2]=4 327 B13R2.5252 C=C1CCCCC2=C1C=CC=C2 O11475 [0,1,0,0,0,1|1,0,1]=4 328 B13R2.5252 O=C1CCC=CC2=C1C=CC=C2 92612 [0,1,0,0,0,1|1,0,0]=3 329 B13R2.32 BrC1=C(Br)C2=CC=CC=C2C=N1 36192 [0,2,0,0,0,0|0,0,2]=4 330 B13R2.32 CC1=C(O)C2=NC=CC=C2C=C1 71141 [0,2,0,0,0,0|2,0,0]=4 331 B13R2.32 CN1C=CC2=CC=CN=C2C1=O D73821 [0,2,0,0,0,0|1,0,1]=4 332 B13R2.32 CN1N=CC2=C(C=CC=C2)C1=O N16864 [0,2,0,0,0,0|1,0,1]=4 333 B13R2.32 ClC1=C(Br)C2=CC=CC=C2N=C1 93348 [0,2,0,0,0,0|2,0,0]=4 334 B13R2.32 ClC1=C(Cl)C2=CC=CC=C2N=N1 AC3683 [0,2,0,0,0,0|1,0,1]=4 335 B13R2.32 FC1=C(Br)C2=CC=CN=C2C=C1 AC2843 [0,2,0,0,0,0|2,0,0]=4 336 B13R2.32 FC1=C(Cl)C=CC2=C1CCNC2 84514 [0,2,0,0,0,0|0,0,2]=4 337 B13R2.32 FC1=C(F)C2=C(C=C1)CNCC2 AT19623 [0,2,0,0,0,0|0,0,2]=4 338 B13R2.32 FC1=C(F)C2=C(C=C1)CNCC2 AT19624 [0,2,0,0,0,0|0,0,2]=4 339 B13R2.32 NC1=C(Br)N=CC2=CC=CC=C21 27185 [0,2,0,0,0,0|0,0,2]=4 340 B13R2.32 NC1=C(Cl)C2=CC=CC=C2C=N1 91248 [0,2,0,0,0,0|0,0,2]=4 341 B13R2.32 NC1=C(Cl)C=NC2=CC=CC=C21 O10994 [0,2,0,0,0,0|2,0,0]=4 342 B13R2.32 NC1=CC=C2N=CC=CC2=C1N 98386 [0,2,0,0,0,0|2,0,0]=4 343 B13R2.32 NC1=CC=C2N=CC=CC2=C1N CS1203 [0,2,0,0,0,0|2,0,0]=4 344 B13R2.32 N[C@@H]1C(=O)NCC2=C1C=CC=C2 C14948 [0,2,0,0,0,0|0,0,1]=3 345 B13R2.32 O=C1C(Cl)=NNC2=C1C=CC=C2 AC6867 [0,2,0,0,0,0|1,0,1]=4 346 B13R2.32 O=C1C2=C(C=CC=C2)CC[C@@H]1Cl 51879 [0,2,0,0,0,0|1,0,1]=4 347 B13R2.32 OC1=C(Cl)C2=CC=CC=C2N=C1 C15579 [0,2,0,0,0,0|2,0,0]=4 348 B13R2.32 OC1=C(Cl)C2=NC=CC=C2C=C1 C14483 [0,2,0,0,0,0|2,0,0]=4 349 B13R2.32 OC1=C(Cl)C=NC2=CC=CC=C21 93347 [0,2,0,0,0,0|2,0,0]=4 350 B13R2.32 OC1=C(Cl)N=CC2=CC=CC=C21 CL1036 [0,2,0,0,0,0|0,0,2]=4 351 B13R2.57 BrCC1=CC2=CC=CC=C2N=C1 D88103 [0,2,0,0,0,0|2,0,0]=4 352 B13R2.57 BrCC1=CC2=CC=CN=C2C=C1 73463 [0,2,0,0,0,0|2,0,0]=4 353 B13R2.57 BrCC1=CC2=CN=CC=C2C=C1 AT24114 [0,2,0,0,0,0|0,0,2]=4 354 B13R2.57 BrCC1=CC2=NC=CC=C2C=C1 AT24126 [0,2,0,0,0,0|2,0,0]=4 355 B13R2.57 BrCC1=NC2=CC=CC=C2C=C1 C11064 [0,2,0,0,0,0|2,0,0]=4 356 B13R2.57 CSC1=NC2=CC=CC=C2C=C1 H11532 [0,2,0,0,0,0|2,0,0]=4 357 B13R2.57 ClCC1=CC2=NC=CC=C2C=C1 AT24125 [0,2,0,0,0,0|2,0,0]=4 358 B13R2.57 NCC1=CC2=CC=CC=C2N=C1 56109 [0,2,0,0,0,0|2,0,0]=4 359 B13R2.57 NCC1=CC=C2C=NC=CC2=C1 N10568 [0,2,0,0,0,0|0,0,2]=4 360 B13R2.57 NC[C@H]1CC2=C(C=CC=C2)CN1 F13533 [0,2,0,0,0,0|0,0,2]=4 361 B13R2.57 NNC1=CC2=CC=CC=C2C=C1 F21338 [0,2,0,0,0,0|1,0,1]=4 362 B13R2.57 NNC1=CC2=CC=CC=C2N=C1 78667 [0,2,0,0,0,0|2,0,0]=4 363 B13R2.57 OCC1=CC2=C(C=C1)CNCC2 W14964 [0,2,0,0,0,0|0,0,2]=4 364 B13R2.57 OCC1=CC2=NC=CC=C2C=C1 AT24124 [0,2,0,0,0,0|2,0,0]=4 365 B13R2.155 CC1=CC=C2C=CC(Br)=CC2=C1 O10697 [0,2,0,0,0,0|1,0,1]=4 366 B13R2.155 CC1=CC=C2N=CC(Br)=CC2=C1 84135 [0,2,0,0,0,0|2,0,0]=4 367 B13R2.155 CC1=CC=C2N=CC(O)=CC2=C1 A10636 [0,2,0,0,0,0|2,0,0]=4 368 B13R2.155 C[C@H]1CC2=C(C=CC(F)=C2)CN1 AT19622 [0,2,0,0,0,0|0,0,2]=4 369 B13R2.155 C[C@H]1CC2=C(C=CC(N)=C2)CN1 F13589 [0,2,0,0,0,0|0,0,2]=4 370 B13R2.155 ClC1=CC=C2C=CC(Cl)=NC2=C1 80787 [0,2,0,0,0,0|2,0,0]=4 371 B13R2.155 NC1=CC2=C(C=C1)COC(=O)N2 AC2800 [0,2,0,0,0,0|2,0,0]=4 372 B13R2.155 NC1=CC=C2N=CC(I)=CC2=C1 D74425 [0,2,0,0,0,0|2,0,0]=4 373 B13R2.155 NC1=CC=C2N=CC(O)=CC2=C1 33324 [0,2,0,0,0,0|2,0,0]=4 374 B13R2.155 NC1=NC=C2C=CC(O)=CC2=C1 68526 [0,2,0,0,0,0|0,0,2]=4 375 B13R2.155 O=C1C=CC2=C(C=C(F)C=C2)O1 D83247 [0,2,0,0,0,0|2,0,0]=4 376 B13R2.155 O=C1CCC2=C(C=C(Br)C=C2)O1 94712 [0,2,0,0,0,0|2,0,0]=4 377 B13R2.155 O=C1NC2=C(C=CC(F)=C2)CO1 AC4752 [0,2,0,0,0,0|2,0,0]=4 378 B13R2.155 O=C1NCC2=C(C=C(Br)C=C2)N1 I10948 [0,2,0,0,0,0|1,0,0]=3 379 B13R2.155 OC1=CC=C2N=CC(Cl)=CC2=C1 80398 [0,2,0,0,0,0|2,0,0]=4 380 B13R2.162 BrC1=CC2=C(Br)C=CC=C2C=N1 D80057 [0,2,0,0,0,0|0,0,2]=4 381 B13R2.162 CC1=C2N=C(Br)C=CC2=CC=C1 94408 [0,2,0,0,0,0|2,0,0]=4 382 B13R2.162 CC1=C2N=C(N)C=CC2=CC=C1 72104 [0,2,0,0,0,0|2,0,0]=4 383 B13R2.162 CC1=CC2=C(C=C1)CCNC2=O 55442 [0,2,0,0,0,0|2,0,0]=4 384 B13R2.162 CC1=CC=C2C=CC=C(Br)C2=C1 97676 [0,2,0,0,0,0|1,0,1]=4 385 B13R2.162 CC1=CC=C2C=CC=C(N)C2=C1 C16241 [0,2,0,0,0,0|1,0,1]=4 386 B13R2.162 CC1=CC=C2C=CN=C(Cl)C2=C1 F30684 [0,2,0,0,0,0|0,0,2]=4 387 B13R2.162 CC1=CC=C2C=CNC(=O)C2=N1 54220 [0,2,0,0,0,0|1,0,1]=4 388 B13R2.162 ClC1=CC=C2C=CC=C(Br)C2=C1 W18103 [0,2,0,0,0,0|1,0,1]=4 389 B13R2.162 ClC1=CC=C2N=CC=C(I)C2=C1 AT14806 [0,2,0,0,0,0|2,0,0]=4 390 B13R2.162 ClC1=CN=C2C=CC=C(Br)C2=C1 80410 [0,2,0,0,0,0|2,0,0]=4 391 B13R2.162 FC1=C2C=C(Br)C=CC2=CC=N1 55505 [0,2,0,0,0,0|0,0,2]=4 392 B13R2.162 FC1=CC=C2C=CC=C(Br)C2=N1 91504 [0,2,0,0,0,0|2,0,0]=4 393 B13R2.162 NC1=C2N=C(Br)C=CC2=CC=C1 E72018 [0,2,0,0,0,0|2,0,0]=4 394 B13R2.162 NC1=C2NC(=O)CCC2=CC=C1 O11667 [0,2,0,0,0,0|2,0,0]=4 395 B13R2.162 NC1=CC2=C(C=C1)C=NNC2=O 94681 [0,2,0,0,0,0|1,0,1]=4 396 B13R2.162 NC1=CC=C2C=CC=C(Br)C2=C1 AT10622 [0,2,0,0,0,0|1,0,1]=4 397 B13R2.162 NC1=CC=CC2=C1NC(=O)OC2 AC4366 [0,2,0,0,0,0|2,0,0]=4 398 B13R2.162 O=C1CCC2=CC=CC(F)=C2C1 Y10670 [0,2,0,0,0,0|1,0,1]=4 399 B13R2.162 O=C1NC2=C(Br)C=CC=C2CO1 AC4475 [0,2,0,0,0,0|2,0,0]=4 400 B13R2.162 O=C1NC2=C(Cl)C=CC=C2CO1 AC4791 [0,2,0,0,0,0|2,0,0]=4 401 B13R2.162 O=C1NC2=C(F)C=CC=C2CO1 AC4757 [0,2,0,0,0,0|2,0,0]=4 402 B13R2.162 O=C1NCCC2=C1C=C(I)C=C2 F52967 [0,2,0,0,0,0|2,0,0]=4 403 B13R2.162 OC1=C2C=C(Cl)C=NC2=CC=C1 80400 [0,2,0,0,0,0|2,0,0]=4 404 B13R2.162 OC1=C2C=C(F)C=CC2=NN=C1 AC7050 [0,2,0,0,0,0|1,0,1]=4 405 B13R2.162 OC1=CC2=C(C=C1)CNC[C@@H]2O C16747 [0,2,0,0,0,0|0,0,2]=4 406 B13R2.162 OC1=CC=C2C=CN=C(Cl)C2=C1 C73233 [0,2,0,0,0,0|0,0,2]=4 407 B13R2.162 OC1=CN=C2C=CC=C(Cl)C2=C1 33283 [0,2,0,0,0,0|2,0,0]=4 408 B13R2.162 S=C1NCCC2=C1C=C(Cl)C=C2 F12588 [0,2,0,0,0,0|2,0,0]=4 409 B13R2.162 SC1=C2C=C(Br)C=CC2=NC=C1 AT15189 [0,2,0,0,0,0|2,0,0]=4 410 B13R2.222 CC1(C)C=CC2=C(C=CC=C2)N1 AT10869 [0,2,0,0,0,0|2,0,0]=4 411 B13R2.328 BrC1=CC2=CC=CC=C2C(I)=C1 AC3548 [0,2,0,0,0,0|1,0,1]=4 412 B13R2.328 CC1=CC(F)=CC2=C1CNCC2 AT19621 [0,2,0,0,0,0|0,0,2]=4 413 B13R2.328 CC1=CC(N)=C2C=CC=NC2=C1 K10310 [0,2,0,0,0,0|2,0,0]=4 414 B13R2.328 CC1=CC(O)=CC2=C1CNCC2 E71293 [0,2,0,0,0,0|0,0,2]=4 415 B13R2.328 CC1=CC2=CC=CC=C2C(C)=C1 T71081 [0,2,0,0,0,0|1,0,1]=4 416 B13R2.328 CN1CC(=O)C2=C(C=CC=C2)C1 F12572 [0,2,0,0,0,0|0,0,1]=3 417 B13R2.328 CN1CC(=O)C2=C(C=CC=C2)C1 F12579 [0,2,0,0,0,0|0,0,1]=3 418 B13R2.328 C[C@H]1CC(=O)NC2=C1C=CC=C2 F18223 [0,2,0,0,0,0|2,0,0]=4 419 B13R2.328 ClC1=CC2=CN=CC=C2C(Cl)=C1 C16294 [0,2,0,0,0,0|0,0,2]=4 420 B13R2.328 FC1=C2CNCCC2=CC(Br)=C1 90660 [0,2,0,0,0,0|0,0,2]=4 421 B13R2.328 FC1=CC(Br)=CC2=CC=CC=C12 F11290 [0,2,0,0,0,0|1,0,1]=4 422 B13R2.328 FC1=CC(F)=C2CNCCC2=C1 AT19600 [0,2,0,0,0,0|0,0,2]=4 423 B13R2.328 FC1=CC2=CC=CC=C2C(Br)=C1 E72054 [0,2,0,0,0,0|1,0,1]=4 424 B13R2.328 FC1=CC2=CC=NC=C2C(Cl)=C1 97671 [0,2,0,0,0,0|0,0,2]=4 425 B13R2.328 NC1=C2C=CC=CC2=NC(=O)N1 25868 [0,2,0,0,0,0|1,0,1]=4 426 B13R2.328 NC1=CC(Br)=CC2=CC=NC=C12 D87185 [0,2,0,0,0,0|0,0,2]=4 427 B13R2.328 NC1=CC(Cl)=CC2=CN=CC=C12 C16071 [0,2,0,0,0,0|0,0,2]=4 428 B13R2.328 NC1=CC2=CC=CC=C2C(O)=C1 F50945 [0,2,0,0,0,0|1,0,1]=4 429 B13R2.328 NC1=CC2=CC=CN=C2C(Br)=C1 84593 [0,2,0,0,0,0|2,0,0]=4 430 B13R2.328 NC1=CC2=CC=NC=C2C(F)=C1 D87186 [0,2,0,0,0,0|0,0,2]=4 431 B13R2.328 NC1=CC2=CN=CC=C2C(O)=C1 D87200 [0,2,0,0,0,0|0,0,2]=4 432 B13R2.328 NC1=CC2=NC=CC=C2C(Br)=C1 K10003 [0,2,0,0,0,0|2,0,0]=4 433 B13R2.328 NC1=NC2=CC=CC=C2C(Cl)=C1 AT23422 [0,2,0,0,0,0|2,0,0]=4 434 B13R2.328 O=C1C=C(Cl)C2=C(C=CC=C2)O1 D76212 [0,2,0,0,0,0|2,0,0]=4 435 B13R2.328 O=C1C=C(I)OC2=C1C=CC=C2 C91932 [0,2,0,0,0,0|2,0,0]=4 436 B13R2.328 O=C1NC(=O)C2=C(C=CC=C2)S1 D73547 [0,2,0,0,0,0|1,0,1]=4 437 B13R2.328 O=C1NC(=S)SC2=C1C=CC=C2 D73549 [0,2,0,0,0,0|1,0,1]=4 438 B13R2.328 O=C1NC(Cl)=CC2=C1C=CC=C2 32072 [0,2,0,0,0,0|0,0,1]=3 439 B13R2.328 OC1=CC(Br)=CC2=CN=CC=C12 E70451 [0,2,0,0,0,0|0,0,2]=4 440 B13R2.328 OC1=CC(Cl)=CC2=CN=CC=C12 D87205 [0,2,0,0,0,0|0,0,2]=4 441 B13R2.328 OC1=CC(F)=CC2=CN=CC=C12 D87208 [0,2,0,0,0,0|0,0,2]=4 442 B13R2.369 BrC1=CC2=CC=CC=C2N=C1I F30333 [0,2,0,0,0,0|2,0,0]=4 443 B13R2.369 CC1=C(C)C=C2N=CC=CC2=C1 N13369 [0,2,0,0,0,0|2,0,0]=4 444 B13R2.369 CC1=CC2=C(C=CC=C2)NC1=O 58045 [0,2,0,0,0,0|2,0,0]=4 445 B13R2.369 CC1=CC2=CC=CC=C2N=C1Br 94406 [0,2,0,0,0,0|2,0,0]=4 446 B13R2.369 CC1=CC2=CN=CC=C2C=C1F 81070 [0,2,0,0,0,0|0,0,2]=4 447 B13R2.369 ClC1=CC2=CC=CC=C2N=C1Br D84301 [0,2,0,0,0,0|2,0,0]=4 448 B13R2.369 ClC1=CC2=CC=CC=C2N=C1Cl 26652 [0,2,0,0,0,0|2,0,0]=4 449 B13R2.369 FC1=CC2=CC=NC=C2C=C1Cl 97669 [0,2,0,0,0,0|0,0,2]=4 450 B13R2.369 NC1=CC2=CC=CN=C2C=C1Cl 91345 [0,2,0,0,0,0|2,0,0]=4 451 B13R2.369 N[C@H]1CC2=C(C=CC=C2)NC1=O 81089 [0,2,0,0,0,0|2,0,0]=4 452 B13R2.369 OC1=CC2=NC=CC=C2C=C1Br K10294 [0,2,0,0,0,0|2,0,0]=4 453 B13R2.3683 BrC1=CC=C2C=C(I)N=NC2=C1 F51337 [0,2,0,0,0,0|1,0,1]=4 454 B13R2.3683 CC1=CC2=CC=C(N)C=C2N=C1 K10051 [0,2,0,0,0,0|2,0,0]=4 455 B13R2.3683 CC1=CC=C2C=C(Br)C=CC2=C1 D78656 [0,2,0,0,0,0|1,0,1]=4 456 B13R2.3683 CC1=CC=C2C=C(Cl)N=CC2=C1 W16225 [0,2,0,0,0,0|0,0,2]=4 457 B13R2.3683 CN1CCC2=C(C=CC(Br)=C2)C1 98419 [0,2,0,0,0,0|0,0,2]=4 458 B13R2.3683 C[C@H]1CC2=C(C=C(Br)C=C2)CN1 AT22658 [0,2,0,0,0,0|0,0,2]=4 459 B13R2.3683 C[C@H]1CC2=C(C=C(O)C=C2)CN1 96725 [0,2,0,0,0,0|0,0,2]=4 460 B13R2.3683 N=C1C=C2C=CC(Br)=CC2=CN1 O11642 [0,2,0,0,0,0|0,0,1]=3 461 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)C=C2 P10166 [0,2,0,0,0,0|2,0,0]=4 462 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)OC2 AC7323 [0,2,0,0,0,0|2,0,0]=4 463 B13R2.3683 NC1=CC=C2C=C(Br)C=CC2=N1 S11534 [0,2,0,0,0,0|2,0,0]=4 464 B13R2.3683 NC1=CC=C2C=C(F)C=CC2=C1 C72558 [0,2,0,0,0,0|1,0,1]=4 465 B13R2.3683 NC1=CC=C2C=C(O)C=CC2=C1 AT25693 [0,2,0,0,0,0|1,0,1]=4 466 B13R2.3683 O=C1NC2=C(C=C(F)C=C2)CO1 AC4756 [0,2,0,0,0,0|2,0,0]=4 467 B13R2.3683 O=C1NC2=C(C=C(I)C=C2)CO1 AC5099 [0,2,0,0,0,0|2,0,0]=4 468 B13R2.3683 O=C1NCC2=CC(Br)=CN=C2N1 S10295 [0,2,0,0,0,0|2,0,0]=4 469 B13R2.3683 OC1=CC=C2C=C(I)C=CC2=N1 F18811 [0,2,0,0,0,0|2,0,0]=4 470 B13R2.3683 OC1=CN=C2C=C(Cl)C=CC2=C1 33310 [0,2,0,0,0,0|2,0,0]=4 471 B13R2.5179 BrC1=CC=C2C(=C1)C=CN=C2Br D80052 [0,2,0,0,0,0|0,0,2]=4 472 B13R2.5179 CC1=CC2=C(C=C1)C(=O)C=CO2 C91052 [0,2,0,0,0,0|2,0,0]=4 473 B13R2.5179 CC1=CC=C2C(Br)=CC=NC2=C1 F53837 [0,2,0,0,0,0|2,0,0]=4 474 B13R2.5179 CC1=CC=C2C(Cl)=CC=NC2=C1 84263 [0,2,0,0,0,0|2,0,0]=4 475 B13R2.5179 CC1=CC=C2C(O)=CC=CC2=N1 69653 [0,2,0,0,0,0|2,0,0]=4 476 B13R2.5179 CC1=NC2=CC=CC(C)=C2C=C1 AT13138 [0,2,0,0,0,0|2,0,0]=4 477 B13R2.5179 C[C@@H]1NCCC2=C1C=CC(F)=C2 AT19619 [0,2,0,0,0,0|0,0,2]=4 478 B13R2.5179 C[C@@H]1NCCC2=C1C=CC(F)=C2 AT19620 [0,2,0,0,0,0|0,0,2]=4 479 B13R2.5179 ClC1=C2C=CC(Br)=CC2=CC=C1 D86133 [0,2,0,0,0,0|1,0,1]=4 480 B13R2.5179 ClC1=CC=C2C(Cl)=CC=[15N]C2=C1 D98227 [0,2,0,0,0,0|2,0,0]=4 481 B13R2.5179 FC1=C2C=CC(Br)=CC2=NC=C1 80388 [0,2,0,0,0,0|2,0,0]=4 482 B13R2.5179 FC1=CC=C2C(Br)=CC=CC2=N1 91506 [0,2,0,0,0,0|2,0,0]=4 483 B13R2.5179 NC1=C2C=CC(Cl)=NC2=CC=C1 O10759 [0,2,0,0,0,0|2,0,0]=4 484 B13R2.5179 NC1=CC2=C(C=C1)C(=O)NC=N2 D74583 [0,2,0,0,0,0|1,0,1]=4 485 B13R2.5179 NC1=CC2=C(C=C1)C(=O)NCC2 CS1458 [0,2,0,0,0,0|2,0,0]=4 486 B13R2.5179 NC1=CC=CC2=C1COC(=O)N2 AC2657 [0,2,0,0,0,0|2,0,0]=4 487 B13R2.5179 NC1=CN=C2C(O)=CC=CC2=C1 80441 [0,2,0,0,0,0|2,0,0]=4 488 B13R2.5179 O=C1C=C2C=CC=C(Br)C2=CN1 P16671 [0,2,0,0,0,0|0,0,1]=3 489 B13R2.5179 O=C1C=C2C=CC=C(Cl)C2=CN1 D76504 [0,2,0,0,0,0|0,0,1]=3 490 B13R2.5179 O=C1C=CC2=C(Br)C=CC=C2O1 E70217 [0,2,0,0,0,0|2,0,0]=4 491 B13R2.5179 O=C1C=NNC2=C1C=CC(Br)=C2 C91005 [0,2,0,0,0,0|1,0,1]=4 492 B13R2.5179 O=C1CCC2=C(C=CC=C2O)C1 88359 [0,2,0,0,0,0|1,0,1]=4 493 B13R2.5179 O=C1CCC2=C(F)C=CC=C2N1 69694 [0,2,0,0,0,0|2,0,0]=4 494 B13R2.5179 O=C1NC2=CC=CC(Cl)=C2CO1 AC4761 [0,2,0,0,0,0|2,0,0]=4 495 B13R2.5179 O=C1NC=CC2=C1C=CC(I)=C2 F19085 [0,2,0,0,0,0|0,0,1]=3 496 B13R2.5179 O=C1NCC2=C(Cl)C=CN=C2N1 82219 [0,2,0,0,0,0|2,0,0]=4 497 B13R2.5179 OC1=C2C=CC(F)=CC2=CC=N1 81072 [0,2,0,0,0,0|0,0,2]=4 498 B13R2.5179 OC1=NC=C2C(Br)=CC=CC2=C1 24374 [0,2,0,0,0,0|0,0,2]=4 499 B13R2.5179 [O-][N+]1=C2C=CC(Br)=CC2=CC=C1 D85320 [0,2,0,0,0,0|2,0,0]=4 500 B13R2.5179 [O-][N+]1=C2C=CC(O)=CC2=CC=C1 AC9845 [0,2,0,0,0,0|2,0,0]=4 501 B13R2.342 BrC1=NC=CC2=C(Br)C=CC=C12 94409 [0,2,0,0,0,0|0,0,2]=4 502 B13R2.342 CC1=C2C=CC=C(Br)C2=CC=N1 96527 [0,2,0,0,0,0|0,0,2]=4 503 B13R2.342 CC1=C2C=CC=C(Br)C2=CN=C1 79348 [0,2,0,0,0,0|0,0,2]=4 504 B13R2.342 CC1=C2C=CC=C(O)C2=NC=C1 W10559 [0,2,0,0,0,0|2,0,0]=4 505 B13R2.342 FC1=C2C=CC=C(Br)C2=NC=C1 F30310 [0,2,0,0,0,0|2,0,0]=4 506 B13R2.342 FC1=C2C=CN=C(Br)C2=CC=C1 83745 [0,2,0,0,0,0|0,0,2]=4 507 B13R2.342 NC1=C2N=CC=C(O)C2=CC=C1 80336 [0,2,0,0,0,0|2,0,0]=4 508 B13R2.342 NC1=CC=CC2=C1N=CNC2=O D74582 [0,2,0,0,0,0|1,0,1]=4 509 B13R2.342 O=C1C=CNC2=C(I)C=CC=C12 D87289 [0,2,0,0,0,0|2,0,0]=4 510 B13R2.342 O=C1NC=CC2=C(Br)C=NC=C12 D85414 [0,2,0,0,0,0|1,0,1]=4 511 B13R2.342 O=C1NC=CC2=C(F)C=CC=C12 F18879 [0,2,0,0,0,0|0,0,1]=3 512 B13R2.342 O=C1NC=CC2=C(I)C=CC=C12 F18906 [0,2,0,0,0,0|0,0,1]=3 513 B13R2.342 OC1=C2N=CC=C(Cl)C2=CC=C1 N10420 [0,2,0,0,0,0|2,0,0]=4 514 B13R2.342 SC1=CC=CC2=C(S)C=CC=C12 T71015 [0,2,0,0,0,0|1,0,1]=4 515 B13R2.371 BrC1=CN=C(I)C2=CC=CC=C12 W17800 [0,2,0,0,0,0|0,0,2]=4 516 B13R2.371 CC1=CC=[N+]([O-])C2=CC=CC=C12 AC8129 [0,2,0,0,0,0|2,0,0]=4 517 B13R2.371 CN1C=CC(=O)C2=C1C=CC=C2 D86440 [0,2,0,0,0,0|2,0,0]=4 518 B13R2.371 ClC1=C2CNCCC2=C(Br)C=C1 33428 [0,2,0,0,0,0|0,0,2]=4 519 B13R2.371 FC1=C2C=CCOC2=C(F)C=C1 C11533 [0,2,0,0,0,0|2,0,0]=4 520 B13R2.371 FC1=CC=C(I)C2=CC=CC=C12 A51050 [0,2,0,0,0,0|1,0,1]=4 521 B13R2.371 NC1=C2C=CN=CC2=C(N)C=C1 A11327 [0,2,0,0,0,0|0,0,2]=4 522 B13R2.371 NC1=CC=C(Cl)C2=CC=CN=C12 90848 [0,2,0,0,0,0|2,0,0]=4 523 B13R2.371 NC1=CC=C(F)C2=CC=CN=C12 34262 [0,2,0,0,0,0|2,0,0]=4 524 B13R2.371 NC1=CC=C(O)C2=CC=CC=C12 C16048 [0,2,0,0,0,0|1,0,1]=4 525 B13R2.371 NC1=NNC(=O)C2=C1C=CC=C2 AT26552 [0,2,0,0,0,0|1,0,1]=4 526 B13R2.371 N[C@H]1CCC(=O)C2=C1C=CC=C2 73528 [0,2,0,0,0,0|1,0,1]=4 527 B13R2.371 O=C1CC[C@H](Br)C2=C1C=CC=C2 AT21616 [0,2,0,0,0,0|1,0,1]=4 528 B13R2.371 O=C1NC=C(Br)C2=C1N=CC=C2 80856 [0,2,0,0,0,0|1,0,1]=4 529 B13R2.371 OC1=CC=C(Br)C2=NC=CC=C12 94248 [0,2,0,0,0,0|2,0,0]=4 530 B13R2.371 OC1=CC=C(I)C2=CC=CC=C12 O11251 [0,2,0,0,0,0|1,0,1]=4 531 B13R2.371 OC1=NC=C(F)C2=CC=CC=C21 73660 [0,2,0,0,0,0|0,0,2]=4 532 B13R2.1613 BrCC1=CC=CC2=CC=NC=C21 78434 [0,2,0,0,0,0|0,0,2]=4 533 B13R2.1613 BrCC1=CC=CC2=CN=CC=C21 27043 [0,2,0,0,0,0|0,0,2]=4 534 B13R2.1613 BrCC1=CC=CC2=NC=CC=C12 O11300 [0,2,0,0,0,0|2,0,0]=4 535 B13R2.1613 BrCC1=CC=NC2=CC=CC=C12 AC1839 [0,2,0,0,0,0|2,0,0]=4 536 B13R2.1613 CC[C@@H]1NCCC2=C1C=CC=C2 AT22655 [0,2,0,0,0,0|0,0,2]=4 537 B13R2.1613 COC1=NC=CC2=CC=CC=C21 C15382 [0,2,0,0,0,0|0,0,2]=4 538 B13R2.1613 ClCC1=CC=NC2=CC=CC=C12 83041 [0,2,0,0,0,0|2,0,0]=4 539 B13R2.1613 ClCC1=CC=NC2=CC=CC=C12 C15997 [0,2,0,0,0,0|2,0,0]=4 540 B13R2.1613 N#CC1=C2CNCCC2=CC=C1 P11020 [0,2,0,0,0,0|0,0,2]=4 541 B13R2.1613 NCC1=C2C=CN=CC2=CC=C1 20474 [0,2,0,0,0,0|0,0,2]=4 542 B13R2.1613 NCC1=C2C=NC=CC2=CC=C1 F14024 [0,2,0,0,0,0|0,0,2]=4 543 B13R2.1613 NCC1=C2N=CC=CC2=CC=C1 C77643 [0,2,0,0,0,0|2,0,0]=4 544 B13R2.1613 NCC1=NC=CC2=CC=CC=C21 25855 [0,2,0,0,0,0|0,0,2]=4 545 B13R2.1613 NC[C@@H]1NCCC2=C1C=CC=C2 86157 [0,2,0,0,0,0|0,0,2]=4 546 B13R2.1613 NNC1=NC=CC2=CC=CC=C21 F16016 [0,2,0,0,0,0|0,0,2]=4 547 B13R2.1613 OCC1=CC=CC2=NC=CC=C12 W10519 [0,2,0,0,0,0|2,0,0]=4 548 B13R2.1613 OCC1=CN=CC2=CC=CC=C21 89023 [0,2,0,0,0,0|0,0,2]=4 549 B13R2.4818 CC1=CC=CC2=C1C(=O)CCC2 F17727 [0,2,0,0,0,0|1,0,1]=4 550 B13R2.4818 ClC1=C2C(Br)=CC=CC2=CN=C1 33303 [0,2,0,0,0,0|0,0,2]=4 551 B13R2.4818 O=C1C=CNC2=CC=CC(Br)=C12 W14715 [0,2,0,0,0,0|2,0,0]=4 552 B13R2.4818 O=C1NC=CC2=CC=CC(Cl)=C12 F18990 [0,2,0,0,0,0|0,0,1]=3 553 B13R2.4818 O=C1NC=CC2=CC=CC(I)=C12 F18971 [0,2,0,0,0,0|0,0,1]=3 554 B13R2.4818 O=C1NC=NC2=CC=CC(I)=C12 FD13093 [0,2,0,0,0,0|1,0,1]=4 555 B13R2.4818 OC1=C2C(=CC=C1)C=CN=C2Cl F53713 [0,2,0,0,0,0|0,0,2]=4 556 B13R2.4818 OC1=C2C(Br)=CC=CC2=CC=N1 P18193 [0,2,0,0,0,0|0,0,2]=4 557 B13R2.4818 OC1=C2C(Br)=CN=CC2=CC=C1 K10067 [0,2,0,0,0,0|0,0,2]=4 558 B11R2.988 NC[C@H]1CC2=C1C=CC=C2 AT20374 [0,0,1,1,0,0|0,0,2]=4 559 B11R2.239 C1=CC=C([C@@H]2CCN2)C=C1 A50749 [0,0,1,1,0,0|0,0,2]=4 560 B9R2.3 C1=CC2=C(CNC2)O1 91178 [0,0,0,0,2,0|1,0,1]=4