0 B12R2.612 BrC1=CC2=C(C=C1)C(I)=NN2 B7597 [0,0,0,0,0,0|1,1,0]=2 1 B12R2.612 BrC1=CN=C2C(I)=CNC2=C1 B44319 [0,0,0,0,0,0|3,1,0]=4 2 B12R2.612 BrC1=CNC2=CC(Br)=NC=C12 D44293 [0,0,0,0,0,0|3,1,0]=4 3 B12R2.612 BrC1=NC2=C(C=C1)C(I)=NN2 B9869 [0,0,0,0,0,0|2,1,0]=3 4 B12R2.612 CC1=C2C=CC(Br)=CC2=NN1 B48309 [0,0,0,0,0,0|1,1,2]=4 5 B12R2.612 CC1=CC2=C(C=C1)C(=O)CC2 M52405 [0,0,0,0,0,0|3,0,1]=4 6 B12R2.612 CC1=CC2=C(C=C1)C(=O)NO2 M48466 [0,0,0,0,0,0|2,0,2]=4 7 B12R2.612 CC1=CC2=C(C=C1)C(=O)OC2 M51553 [0,0,0,0,0,0|3,0,1]=4 8 B12R2.612 CC1=CC2=C(C=C1)C(I)=NN2 I26115 [0,0,0,0,0,0|2,0,0]=2 9 B12R2.612 CC1=CNC2=C1C=CC(Cl)=N2 C11077 [0,0,0,0,0,0|3,1,0]=4 10 B12R2.612 CC1=CNC2=C1C=CC(N)=C2 M25577 [0,0,0,0,0,0|3,0,0]=3 11 B12R2.612 CC1=NC2=C(C=C1)C(Br)=CN2 B15845 [0,0,0,0,0,0|4,0,0]=4 12 B12R2.612 CC1=NC2=C(C=C1)C(I)=CN2 K15846 [0,0,0,0,0,0|4,0,0]=4 13 B12R2.612 CC1=NC2=C(C=C1)C(N)=NN2 M25414 [0,0,0,0,0,0|3,0,0]=3 14 B12R2.612 CC1=NC2=C(C=N1)C(I)=NN2 K64368 [0,0,0,0,0,0|4,0,0]=4 15 B12R2.612 CC1=NC=C2C(N)=CNC2=C1 M49212 [0,0,0,0,0,0|4,0,0]=4 16 B12R2.612 CC1=NNC2=C1C=CC(Br)=C2 B7596 [0,0,0,0,0,0|1,1,0]=2 17 B12R2.612 CC1=NNC2=C1C=CC(Cl)=N2 C11357 [0,0,0,0,0,0|2,1,0]=3 18 B12R2.612 CC1=NNC2=C1C=CC(F)=N2 F14260 [0,0,0,0,0,0|2,0,0]=2 19 B12R2.612 CC1=NNC2=C1C=CC(I)=C2 I8095 [0,0,0,0,0,0|1,1,0]=2 20 B12R2.612 CC1=NNC2=C1C=CC(N)=C2 A7594 [0,0,0,0,0,0|2,0,0]=2 21 B12R2.612 CC1=NNC2=C1C=CC(O)=C2 H38130 [0,0,0,0,0,0|2,0,0]=2 22 B12R2.612 CC1=NNC2=CC(Br)=CN=C21 B11215 [0,0,0,0,0,0|2,1,0]=3 23 B12R2.612 CC1=NNC2=CC(Cl)=NC=C21 C9871 [0,0,0,0,0,0|2,1,0]=3 24 B12R2.612 CC1=NOC2=C1C=CC(Br)=C2 B48075 [0,0,0,0,0,0|2,1,0]=3 25 B12R2.612 CC1=NOC2=C1C=CC(O)=C2 M39002 [0,0,0,0,0,0|3,0,0]=3 26 B12R2.612 CN1N=CC2=C1C=CC(Br)=C2 B2917 [0,0,0,0,0,0|3,1,0]=4 27 B12R2.612 CN1N=CC2=C1C=CC(I)=C2 K9720 [0,0,0,0,0,0|3,1,0]=4 28 B12R2.612 CN1N=CC2=C1C=CC(N)=C2 A2912 [0,0,0,0,0,0|4,0,0]=4 29 B12R2.612 CN1N=CC2=C1C=CC(O)=C2 M25239 [0,0,0,0,0,0|4,0,0]=4 30 B12R2.612 CN1N=NC2=C1C=CC(Br)=C2 B45283 [0,0,0,0,0,0|2,1,1]=4 31 B12R2.612 ClC1=CC2=C(C=C1)C(Cl)=NO2 D44183 [0,0,0,0,0,0|2,1,0]=3 32 B12R2.612 ClC1=CC2=C(C=N1)C(Br)=CN2 B14619 [0,0,0,0,0,0|3,1,0]=4 33 B12R2.612 ClC1=CC2=C(C=N1)C(I)=CN2 C44336 [0,0,0,0,0,0|3,1,0]=4 34 B12R2.612 ClC1=CN=C2C(Br)=NNC2=N1 B63357 [0,0,0,0,0,0|3,1,0]=4 35 B12R2.612 ClC1=CNC2=CC(Br)=CN=C12 B44304 [0,0,0,0,0,0|3,1,0]=4 36 B12R2.612 ClC1=NC2=C(C=C1)C(Br)=CN2 B17210 [0,0,0,0,0,0|3,1,0]=4 37 B12R2.612 ClC1=NC2=C(C=N1)C(Br)=NN2 B26766 [0,0,0,0,0,0|3,1,0]=4 38 B12R2.612 ClC1=NC2=C(C=N1)C(I)=NN2 C40496 [0,0,0,0,0,0|3,1,0]=4 39 B12R2.612 ClC1=NNC2=C1C=CC(Br)=C2 B4884 [0,0,0,0,0,0|1,1,0]=2 40 B12R2.612 ClC1=NOC2=C1C=CC(Br)=C2 B37239 [0,0,0,0,0,0|2,1,0]=3 41 B12R2.612 FC1=CC2=C(C=C1)C(Br)=NN2 B44305 [0,0,0,0,0,0|1,0,0]=1 42 B12R2.612 FC1=CC2=C(C=C1)C(Cl)=NN2 C17943 [0,0,0,0,0,0|1,0,0]=1 43 B12R2.612 FC1=CC2=C(C=C1)C(Cl)=NO2 C44186 [0,0,0,0,0,0|2,0,0]=2 44 B12R2.612 FC1=CN2N=CC(Br)=C2C=C1 B44313 [0,0,0,0,0,0|3,0,1]=4 45 B12R2.612 FC1=NC2=C(C=C1)C(I)=CN2 F17196 [0,0,0,0,0,0|3,0,0]=3 46 B12R2.612 IC1=CC2=C(C=C1)C(I)=NN2 D23026 [0,0,0,0,0,0|1,1,0]=2 47 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 A3834 [0,0,0,0,0,0|3,0,1]=4 48 B12R2.612 NC1=CC2=C(C=C1)C(=O)NC2 A0622 [0,0,0,0,0,0|2,0,2]=4 49 B12R2.612 NC1=CC2=C(C=C1)C(=O)OC2 A48453 [0,0,0,0,0,0|3,0,1]=4 50 B12R2.612 NC1=CC2=C(C=C1)C(Cl)=NN2 A12803 [0,0,0,0,0,0|2,0,0]=2 51 B12R2.612 NC1=CC2=C(C=C1)C(I)=NN2 I0594 [0,0,0,0,0,0|2,0,0]=2 52 B12R2.612 NC1=CC2=C(C=C1)C(O)=NN2 A45732 [0,0,0,0,0,0|1,0,0]=1 53 B12R2.612 NC1=NNC2=C1C=CC(Br)=C2 B4223 [0,0,0,0,0,0|1,1,0]=2 54 B12R2.612 NC1=NNC2=C1C=CC(F)=C2 F23542 [0,0,0,0,0,0|1,0,0]=1 55 B12R2.612 NC1=NNC2=CC(Br)=CN=C21 A12028 [0,0,0,0,0,0|2,1,0]=3 56 B12R2.612 NC1=NOC2=C1C=CC(Br)=C2 B38042 [0,0,0,0,0,0|2,1,0]=3 57 B12R2.612 NC1=NOC2=C1C=CC(F)=C2 F44845 [0,0,0,0,0,0|2,0,0]=2 58 B12R2.612 N[C@@H]1CCC2=C1C=CC(F)=C2 F52068 [0,0,0,0,0,0|3,0,1]=4 59 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 F52071 [0,0,0,0,0,0|3,0,1]=4 60 B12R2.612 N[C@H]1COC2=C1C=CC(F)=C2 F49618 [0,0,0,0,0,0|3,0,1]=4 61 B12R2.612 O=C1CCC2=C1C=CC(Br)=C2 B23186 [0,0,0,0,0,0|2,1,1]=4 62 B12R2.612 O=C1CCC2=C1C=CC(Cl)=C2 C39570 [0,0,0,0,0,0|2,1,1]=4 63 B12R2.612 O=C1CCC2=C1C=CC(F)=C2 F51326 [0,0,0,0,0,0|2,0,1]=3 64 B12R2.612 O=C1CCC2=C1C=CC(I)=C2 D9498 [0,0,0,0,0,0|2,1,1]=4 65 B12R2.612 O=C1CCC2=C1C=CC(O)=C2 H38546 [0,0,0,0,0,0|3,0,1]=4 66 B12R2.612 O=C1COC2=C1C=CC(Br)=C2 B47765 [0,0,0,0,0,0|2,1,1]=4 67 B12R2.612 O=C1COC2=C1C=CC(O)=C2 H48209 [0,0,0,0,0,0|3,0,1]=4 68 B12R2.612 O=C1NCC2=C1C=CC(Br)=C2 B14060 [0,0,0,0,0,0|1,1,2]=4 69 B12R2.612 O=C1NCC2=C1C=CC(Cl)=C2 C38770 [0,0,0,0,0,0|1,1,2]=4 70 B12R2.612 O=C1NCC2=C1C=CC(F)=C2 F48097 [0,0,0,0,0,0|1,0,2]=3 71 B12R2.612 O=C1NCC2=C1C=CC(O)=C2 H36793 [0,0,0,0,0,0|2,0,2]=4 72 B12R2.612 O=C1NNC2=C1C=CC(F)=C2 F44842 [0,0,0,0,0,0|0,0,2]=2 73 B12R2.612 O=C1NOC2=C1C=CC(Br)=C2 B38875 [0,0,0,0,0,0|1,1,2]=4 74 B12R2.612 O=C1NOC2=C1C=CC(Cl)=C2 C62237 [0,0,0,0,0,0|1,1,2]=4 75 B12R2.612 O=C1NOC2=C1C=CC(F)=C2 F44455 [0,0,0,0,0,0|1,0,2]=3 76 B12R2.612 O=C1NSC2=C1C=CC(F)=C2 F44556 [0,0,0,0,0,0|1,0,2]=3 77 B12R2.612 O=C1OCC2=C1C=CC(Br)=C2 B47768 [0,0,0,0,0,0|2,1,1]=4 78 B12R2.612 O=C1OCC2=C1C=CC(Cl)=C2 C47780 [0,0,0,0,0,0|2,1,1]=4 79 B12R2.612 O=C1OCC2=C1C=CC(F)=C2 F47783 [0,0,0,0,0,0|2,0,1]=3 80 B12R2.612 O=C1OCC2=C1C=CC(O)=C2 H60961 [0,0,0,0,0,0|3,0,1]=4 81 B12R2.612 OB1OCC2=C1C=CC(O)=C2 D29533 [0,0,0,0,0,0|4,0,0]=4 82 B12R2.612 OC1=NNC2=C1C=CC(Br)=C2 B38690 [0,0,0,0,0,0|0,1,0]=1 83 B12R2.612 O[C@H]1CCC2=C1C=CC(Br)=C2 B52029 [0,0,0,0,0,0|2,1,1]=4 84 B12R2.612 O[C@H]1CCC2=C1C=CC(Cl)=C2 C52041 [0,0,0,0,0,0|2,1,1]=4 85 B12R2.612 O[C@H]1CCC2=C1C=CC(F)=C2 F52046 [0,0,0,0,0,0|2,0,1]=3 86 B12R2.612 O[C@H]1COC2=C1C=CC(Br)=C2 B48578 [0,0,0,0,0,0|2,1,1]=4 87 B11R2.1 BrC1=C2C=CC=CN2C=N1 B44745 [1,0,0,0,0,0|3,0,0]=4 88 B11R2.1 BrC1=CNC2=C1C=CC=N2 B0249 [1,0,0,0,0,0|3,0,0]=4 89 B11R2.1 BrC1=CNC2=C1C=CN=C2 B1048 [1,0,0,0,0,0|3,0,0]=4 90 B11R2.1 BrC1=CNC2=C1C=NC=C2 B12650 [1,0,0,0,0,0|3,0,0]=4 91 B11R2.1 BrC1=CNC2=CC=CN=C12 B15504 [1,0,0,0,0,0|3,0,0]=4 92 B11R2.1 BrC1=COC2=C1C=CC=C2 B47829 [1,0,0,0,0,0|3,0,0]=4 93 B11R2.1 BrC1=CSC2=C1C=CC=C2 B47535 [1,0,0,0,0,0|3,0,0]=4 94 B11R2.1 BrC1=NN=C2C=CC=CN12 B42150 [1,0,0,0,0,0|2,0,1]=4 95 B11R2.1 BrC1=NNC2=C1C=CC=C2 B0436 [1,0,0,0,0,0|1,0,0]=2 96 B11R2.1 BrC1=NNC2=C1C=CC=N2 B0140 [1,0,0,0,0,0|2,0,0]=3 97 B11R2.1 BrC1=NNC2=C1C=CN=C2 B9736 [1,0,0,0,0,0|2,0,0]=3 98 B11R2.1 BrC1=NNC2=C1C=NC=C2 B4801 [1,0,0,0,0,0|2,0,0]=3 99 B11R2.1 BrC1=NNC2=C1C=NC=N2 B18019 [1,0,0,0,0,0|3,0,0]=4 100 B11R2.1 BrC1=NNC2=CC=CN=C21 B5437 [1,0,0,0,0,0|2,0,0]=3 101 B11R2.1 BrC1=NNC2=NC=CN=C12 B13662 [1,0,0,0,0,0|3,0,0]=4 102 B11R2.1 BrC1=NOC2=C1C=CC=N2 B41851 [1,0,0,0,0,0|3,0,0]=4 103 B11R2.1 CC1=CCC2=C1C=CC=C2 M52270 [1,0,0,0,0,0|3,0,0]=4 104 B11R2.1 CC1=CNC2=C1C=CC=C2 M13894 [1,0,0,0,0,0|2,0,0]=3 105 B11R2.1 CC1=CNC2=C1C=NC=C2 M22503 [1,0,0,0,0,0|3,0,0]=4 106 B11R2.1 CC1=CNC2=NC=CC=C12 M7858 [1,0,0,0,0,0|3,0,0]=4 107 B11R2.1 CC1=NNC2=C1C=CC=C2 M1829 [1,0,0,0,0,0|1,0,0]=2 108 B11R2.1 CC1=NNC2=C1C=CN=C2 M12615 [1,0,0,0,0,0|2,0,0]=3 109 B11R2.1 CC1=NNC2=C1C=NC=C2 M14280 [1,0,0,0,0,0|2,0,0]=3 110 B11R2.1 CC1=NNC2=CC=CN=C21 M0543 [1,0,0,0,0,0|2,0,0]=3 111 B11R2.1 CC1=NNC2=NC=CC=C12 M0532 [1,0,0,0,0,0|2,0,0]=3 112 B11R2.1 CC1=NNC2=NC=CN=C12 M1752 [1,0,0,0,0,0|3,0,0]=4 113 B11R2.1 CC1=NOC2=C1C=CC=C2 M68053 [1,0,0,0,0,0|2,0,0]=3 114 B11R2.1 CN1N=CC2=C1C=CC=C2 M14463 [1,0,0,0,0,0|3,0,0]=4 115 B11R2.1 ClC1=CNC2=C1C=CC=N2 C1529 [1,0,0,0,0,0|3,0,0]=4 116 B11R2.1 ClC1=NN=C2C=CC=CN12 C15304 [1,0,0,0,0,0|2,0,1]=4 117 B11R2.1 ClC1=NN=C2NC=CC=C12 C16936 [1,0,0,0,0,0|2,0,1]=4 118 B11R2.1 ClC1=NNC2=C1C=CC=C2 C44767 [1,0,0,0,0,0|1,0,0]=2 119 B11R2.1 ClC1=NOC2=C1C=CC=C2 C44531 [1,0,0,0,0,0|2,0,0]=3 120 B11R2.1 ClC1=NOC2=CC=CN=C21 C41855 [1,0,0,0,0,0|3,0,0]=4 121 B11R2.1 ClC1=NSC2=C1C=CC=C2 C25325 [1,0,0,0,0,0|2,0,0]=3 122 B11R2.1 ClN1N=NC2=C1C=CC=C2 C5012 [1,0,0,0,0,0|2,0,1]=4 123 B11R2.1 FC1=CNC2=C1C=CC=N2 F18191 [1,0,0,0,0,0|3,0,0]=4 124 B11R2.1 FC1=NNC2=C1C=CC=C2 F39022 [1,0,0,0,0,0|1,0,0]=2 125 B11R2.1 IC1=C2C=CC=CN2C=N1 I36787 [1,0,0,0,0,0|3,0,0]=4 126 B11R2.1 IC1=CNC2=C1C=CC=N2 K3799 [1,0,0,0,0,0|3,0,0]=4 127 B11R2.1 IC1=CNC2=C1C=CN=C2 I3239 [1,0,0,0,0,0|3,0,0]=4 128 B11R2.1 IC1=CNC2=C1C=NC=C2 I15557 [1,0,0,0,0,0|3,0,0]=4 129 B11R2.1 IC1=CNC2=CC=CN=C12 K44806 [1,0,0,0,0,0|3,0,0]=4 130 B11R2.1 IC1=NNC2=C1C=CC=C2 X9686 [1,0,0,0,0,0|1,0,0]=2 131 B11R2.1 IC1=NNC2=C1C=CC=N2 I5851 [1,0,0,0,0,0|2,0,0]=3 132 B11R2.1 IC1=NNC2=C1C=CN=C2 I14261 [1,0,0,0,0,0|2,0,0]=3 133 B11R2.1 IC1=NNC2=C1C=NC=C2 I14270 [1,0,0,0,0,0|2,0,0]=3 134 B11R2.1 IC1=NNC2=CC=CN=C21 I9819 [1,0,0,0,0,0|2,0,0]=3 135 B11R2.1 NC1=CNC2=NC=CC=C12 A3801 [1,0,0,0,0,0|3,0,0]=4 136 B11R2.1 NC1=NCC2=C1C=CC=C2 K49609 [1,0,0,0,0,0|2,0,0]=3 137 B11R2.1 NC1=NCC2=C1C=CC=C2 K64548 [1,0,0,0,0,0|2,0,0]=3 138 B11R2.1 NC1=NNC2=CC=CN=C21 A12619 [1,0,0,0,0,0|2,0,0]=3 139 B11R2.1 NC1=NNC2=NC=CC=C12 P0139 [1,0,0,0,0,0|2,0,0]=3 140 B11R2.1 NC1=NOC2=C1C=CC=C2 B45214 [1,0,0,0,0,0|2,0,0]=3 141 B11R2.1 NC1=NOC2=C1C=CN=C2 K42473 [1,0,0,0,0,0|3,0,0]=4 142 B11R2.1 NC1=NOC2=C1N=CC=C2 A11385 [1,0,0,0,0,0|3,0,0]=4 143 B11R2.1 NC1=NOC2=NC=CC=C12 K42472 [1,0,0,0,0,0|3,0,0]=4 144 B11R2.1 NC1=NSC2=C1C=CC=C2 B69175 [1,0,0,0,0,0|2,0,0]=3 145 B11R2.1 NC1=NSC2=NC=CC=C12 T42493 [1,0,0,0,0,0|3,0,0]=4 146 B11R2.1 NN1N=CC2=C1C=CC=C2 K45720 [1,0,0,0,0,0|3,0,0]=4 147 B11R2.1 O=C1NCC2=C1C=CC=C2 I12007 [1,0,0,0,0,0|1,0,2]=4 148 B11R2.1 O=C1NNC2=C1C=CC=N2 P42478 [1,0,0,0,0,0|1,0,2]=4 149 B11R2.1 O=C1NNC2=C1C=CN=C2 P42479 [1,0,0,0,0,0|1,0,2]=4 150 B11R2.1 OB1OCC2=C1C=CC=C2 H3680 [1,0,0,0,0,0|3,0,0]=4 151 B11R2.1 OC1=COC2=C1N=CC=C2 F32399 [1,0,0,0,0,0|3,0,0]=4 152 B11R2.1 ON1N=NC2=CC=CN=C21 H69245 [1,0,0,0,0,0|2,0,1]=4 153 B11R2.1 O[C@@H]1CCC2=C1C=CC=C2 D68576 [1,0,0,0,0,0|2,0,1]=4 154 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 D60804 [1,0,0,0,0,0|2,0,1]=4 155 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 D68574 [1,0,0,0,0,0|2,0,1]=4 156 B11R2.36 BrC1=CC2=C(C=C1)C=NN2 B3296 [1,0,0,0,0,0|0,1,0]=2 157 B11R2.36 BrC1=CC2=C(C=C1)C=NO2 B37017 [1,0,0,0,0,0|1,1,0]=3 158 B11R2.36 BrC1=CC2=C(C=C1)C=NS2 B44418 [1,0,0,0,0,0|1,1,0]=3 159 B11R2.36 BrC1=CC2=C(C=C1)CCN2 B48873 [1,0,0,0,0,0|1,1,1]=4 160 B11R2.36 BrC1=CC2=C(C=C1)CCN2 B48878 [1,0,0,0,0,0|1,1,1]=4 161 B11R2.36 BrC1=CC2=C(C=C1)NN=C2 B3352 [1,0,0,0,0,0|2,1,0]=4 162 B11R2.36 BrC1=CC2=C(C=C1)NN=N2 B42142 [1,0,0,0,0,0|1,1,1]=4 163 B11R2.36 BrC1=CC2=C(C=C1)ON=C2 B29949 [1,0,0,0,0,0|2,1,0]=4 164 B11R2.36 BrC1=CC2=C(C=CN2)C=C1 B2309 [1,0,0,0,0,0|1,1,0]=3 165 B11R2.36 BrC1=CC2=C(C=CO2)C=C1 B10580 [1,0,0,0,0,0|2,1,0]=4 166 B11R2.36 BrC1=CC2=C(C=CS2)C=C1 B10904 [1,0,0,0,0,0|2,1,0]=4 167 B11R2.36 BrC1=CC2=CN=CN2C=C1 B25849 [1,0,0,0,0,0|2,1,0]=4 168 B11R2.36 BrC1=CC2=CSC=C2C=C1 B28666 [1,0,0,0,0,0|2,1,0]=4 169 B11R2.36 BrC1=CC2=NN=CN2C=C1 B5158 [1,0,0,0,0,0|1,1,1]=4 170 B11R2.36 BrC1=CN=C2C=CNC2=C1 B0357 [1,0,0,0,0,0|2,1,0]=4 171 B11R2.36 BrC1=CN=C2C=NNC2=C1 B0105 [1,0,0,0,0,0|1,1,0]=3 172 B11R2.36 BrC1=CNC2=CN=NC2=C1 B69789 [1,0,0,0,0,0|1,1,1]=4 173 B11R2.36 BrC1=NC2=C(C=C1)C=NN2 B9868 [1,0,0,0,0,0|1,1,0]=3 174 B11R2.36 BrC1=NC2=C(C=CN2)C=C1 B9650 [1,0,0,0,0,0|2,1,0]=4 175 B11R2.36 BrC1=NC=C2C=CNC2=C1 B15503 [1,0,0,0,0,0|2,1,0]=4 176 B11R2.36 BrC1=NC=C2C=NNC2=C1 B9830 [1,0,0,0,0,0|1,1,0]=3 177 B11R2.36 CC1=CC2=C(C=C1)NN=C2 M9605 [1,0,0,0,0,0|3,0,0]=4 178 B11R2.36 CC1=CC2=C(C=CN2)C=C1 M2330 [1,0,0,0,0,0|2,0,0]=3 179 B11R2.36 CC1=CC2=C(C=CS2)C=C1 M51666 [1,0,0,0,0,0|3,0,0]=4 180 B11R2.36 CC1=NC2=C(C=C1)C=NN2 M9878 [1,0,0,0,0,0|2,0,0]=3 181 B11R2.36 CC1=NC2=C(C=NN2)C=N1 M64449 [1,0,0,0,0,0|3,0,0]=4 182 B11R2.36 CC1=NC=C2C=CNC2=C1 M15102 [1,0,0,0,0,0|3,0,0]=4 183 B11R2.36 ClC1=CC2=C(C=C1)C=NN2 C0137 [1,0,0,0,0,0|0,1,0]=2 184 B11R2.36 ClC1=CC2=C(C=C1)CCN2 C48881 [1,0,0,0,0,0|1,1,1]=4 185 B11R2.36 ClC1=CC2=C(C=C1)N=CN2 C44774 [1,0,0,0,0,0|2,1,0]=4 186 B11R2.36 ClC1=CC2=C(C=C1)NN=C2 C9580 [1,0,0,0,0,0|2,1,0]=4 187 B11R2.36 ClC1=CC2=C(C=C1)NN=N2 C39240 [1,0,0,0,0,0|1,1,1]=4 188 B11R2.36 ClC1=CC2=C(C=CN2)C=C1 C4679 [1,0,0,0,0,0|1,1,0]=3 189 B11R2.36 ClC1=CN=C2C=CNC2=C1 C7497 [1,0,0,0,0,0|2,1,0]=4 190 B11R2.36 ClC1=CN=C2C=NNC2=C1 C9864 [1,0,0,0,0,0|1,1,0]=3 191 B11R2.36 ClC1=NC2=C(C=C1)C=NN2 C0072 [1,0,0,0,0,0|1,1,0]=3 192 B11R2.36 ClC1=NC2=C(C=CN2)C=C1 C4994 [1,0,0,0,0,0|2,1,0]=4 193 B11R2.36 ClC1=NC2=C(C=NN2)C=N1 C0164 [1,0,0,0,0,0|2,1,0]=4 194 B11R2.36 ClC1=NC2=C(C=NN2)N=C1 C18229 [1,0,0,0,0,0|2,1,0]=4 195 B11R2.36 ClC1=NC=C2C=CNC2=C1 C0449 [1,0,0,0,0,0|2,1,0]=4 196 B11R2.36 ClC1=NC=C2C=NNC2=C1 C7273 [1,0,0,0,0,0|1,1,0]=3 197 B11R2.36 FC1=CC2=C(C=C1)C=NN2 F9571 [1,0,0,0,0,0|0,0,0]=1 198 B11R2.36 FC1=CC2=C(C=C1)CC=C2 F51044 [1,0,0,0,0,0|2,0,1]=4 199 B11R2.36 FC1=CC2=C(C=C1)CCC2 F51669 [1,0,0,0,0,0|2,0,1]=4 200 B11R2.36 FC1=CC2=C(C=C1)CNC2 F24902 [1,0,0,0,0,0|1,0,2]=4 201 B11R2.36 FC1=CC2=C(C=C1)N=CS2 F61570 [1,0,0,0,0,0|3,0,0]=4 202 B11R2.36 FC1=CC2=C(C=C1)N=NN2 F64515 [1,0,0,0,0,0|1,0,0]=2 203 B11R2.36 FC1=CC2=C(C=C1)NC=C2 F31500 [1,0,0,0,0,0|3,0,0]=4 204 B11R2.36 FC1=CC2=C(C=C1)NC=N2 F44797 [1,0,0,0,0,0|2,0,1]=4 205 B11R2.36 FC1=CC2=C(C=C1)NN=C2 F3439 [1,0,0,0,0,0|2,0,0]=3 206 B11R2.36 FC1=CC2=C(C=C1)OC=C2 F47842 [1,0,0,0,0,0|3,0,0]=4 207 B11R2.36 FC1=CC2=C(C=C1)OCC2 F62598 [1,0,0,0,0,0|3,0,0]=4 208 B11R2.36 FC1=CC2=C(C=C1)SC=N2 F44438 [1,0,0,0,0,0|2,0,1]=4 209 B11R2.36 FC1=CC2=C(C=CN2)C=C1 F2136 [1,0,0,0,0,0|1,0,0]=2 210 B11R2.36 FC1=CC2=C(C=CS2)C=C1 F38235 [1,0,0,0,0,0|2,0,0]=3 211 B11R2.36 FC1=CC2=CNN=C2C=C1 F44791 [1,0,0,0,0,0|2,0,1]=4 212 B11R2.36 FC1=CC2=NC=CN2C=C1 F18262 [1,0,0,0,0,0|2,0,1]=4 213 B11R2.36 FC1=CN=C2C=CNC2=C1 F15518 [1,0,0,0,0,0|2,0,0]=3 214 B11R2.36 FC1=CN=C2NN=CC2=C1 F12053 [1,0,0,0,0,0|3,0,0]=4 215 B11R2.36 FC1=NC2=C(C=CN2)C=C1 F11884 [1,0,0,0,0,0|2,0,0]=3 216 B11R2.36 IC1=CC2=C(C=C1)C=NN2 I0481 [1,0,0,0,0,0|0,1,0]=2 217 B11R2.36 IC1=CC2=C(C=C1)N=CN2 K44804 [1,0,0,0,0,0|2,1,0]=4 218 B11R2.36 IC1=CC2=C(C=C1)NN=C2 I0478 [1,0,0,0,0,0|2,1,0]=4 219 B11R2.36 IC1=CC2=C(C=C1)ON=C2 K44557 [1,0,0,0,0,0|2,1,0]=4 220 B11R2.36 IC1=CC2=C(C=CN2)C=C1 I29514 [1,0,0,0,0,0|1,1,0]=3 221 B11R2.36 IC1=CC2=C(C=CO2)C=C1 I37384 [1,0,0,0,0,0|2,1,0]=4 222 B11R2.36 IC1=CN=C2C=CNC2=C1 I12622 [1,0,0,0,0,0|2,1,0]=4 223 B11R2.36 NC1=CC2=C(C=C1)C=NN2 I0488 [1,0,0,0,0,0|1,0,0]=2 224 B11R2.36 NC1=CC2=C(C=C1)C=NO2 B38836 [1,0,0,0,0,0|2,0,0]=3 225 B11R2.36 NC1=CC2=C(C=C1)N=NS2 B42492 [1,0,0,0,0,0|3,0,0]=4 226 B11R2.36 NC1=CC2=C(C=C1)NN=C2 I9274 [1,0,0,0,0,0|3,0,0]=4 227 B11R2.36 NC1=CC2=C(C=C1)NN=N2 B15799 [1,0,0,0,0,0|2,0,1]=4 228 B11R2.36 NC1=CC2=C(C=C1)ON=C2 B38213 [1,0,0,0,0,0|3,0,0]=4 229 B11R2.36 NC1=CC2=C(C=C1)SN=C2 B45268 [1,0,0,0,0,0|3,0,0]=4 230 B11R2.36 NC1=CC2=C(C=CN2)C=C1 A24110 [1,0,0,0,0,0|2,0,0]=3 231 B11R2.36 NC1=CC2=C(C=CO2)C=C1 B63796 [1,0,0,0,0,0|3,0,0]=4 232 B11R2.36 NC1=CC2=NN=CN2C=C1 T42832 [1,0,0,0,0,0|2,0,1]=4 233 B11R2.36 NC1=CC2=NN=CN2C=C1 T43524 [1,0,0,0,0,0|2,0,1]=4 234 B11R2.36 NC1=CN=C2C=CNC2=C1 P13116 [1,0,0,0,0,0|3,0,0]=4 235 B11R2.36 NC1=CN=C2C=NNC2=C1 A13495 [1,0,0,0,0,0|2,0,0]=3 236 B11R2.36 NC1=NC2=C(C=CN2)C=C1 A13882 [1,0,0,0,0,0|3,0,0]=4 237 B11R2.36 NC1=NC2=C(C=NN2)C=N1 H22836 [1,0,0,0,0,0|3,0,0]=4 238 B11R2.36 NC1=NC=C2C=CNC2=C1 P45727 [1,0,0,0,0,0|3,0,0]=4 239 B11R2.36 OC1=CC2=C(C=C1)C=NN2 H3129 [1,0,0,0,0,0|1,0,0]=2 240 B11R2.36 OC1=CC2=C(C=C1)C=NO2 B44925 [1,0,0,0,0,0|2,0,0]=3 241 B11R2.36 OC1=CC2=C(C=C1)CCN2 K49255 [1,0,0,0,0,0|2,0,1]=4 242 B11R2.36 OC1=CC2=C(C=C1)NN=C2 H3304 [1,0,0,0,0,0|3,0,0]=4 243 B11R2.36 OC1=CC2=C(C=CN2)C=C1 H2141 [1,0,0,0,0,0|2,0,0]=3 244 B13R2.662 CC1=CC2=C(C=C1)C(C=O)=CN2 M67931 [0,1,0,0,0,0|2,0,1]=4 245 B13R2.662 COC1=NNC2=C1C=CC(Br)=C2 B15072 [0,1,0,0,0,0|0,1,0]=2 246 B13R2.662 COC1=NNC2=C1C=CC(N)=C2 M11782 [0,1,0,0,0,0|1,0,0]=2 247 B13R2.662 N#CC1=CNC2=C1C=CC(Br)=C2 B50667 [0,1,0,0,0,0|2,1,0]=4 248 B13R2.662 N#CC1=NNC2=C1C=CC(Br)=C2 B13849 [0,1,0,0,0,0|1,1,0]=3 249 B13R2.662 N#CC1=NNC2=C1C=CC(F)=C2 F47371 [0,1,0,0,0,0|1,0,0]=2 250 B13R2.662 NC1=CC2=C(C=C1)C(C=O)=NN2 A14663 [0,1,0,0,0,0|1,0,1]=3 251 B13R2.662 NCC1=CNC2=C1C=CC(F)=C2 F32274 [0,1,0,0,0,0|2,0,0]=3 252 B13R2.662 O=CC1=CNC2=C1C=CC(Cl)=C2 C9543 [0,1,0,0,0,0|1,1,1]=4 253 B13R2.662 O=CC1=CNC2=C1C=CC(F)=C2 F50950 [0,1,0,0,0,0|1,0,1]=3 254 B13R2.662 O=CC1=NNC2=C1C=CC(Br)=C2 B9685 [0,1,0,0,0,0|0,1,1]=3 255 B13R2.662 O=CC1=NNC2=C1C=CC(Cl)=C2 C38730 [0,1,0,0,0,0|0,1,1]=3 256 B13R2.2130 COC1=CC2=C(C=C1)C(=O)N=C2 M67788 [0,1,0,0,0,0|2,0,1]=4 257 B13R2.2130 COC1=CC2=C(C=C1)C(C)=NN2 M49722 [0,1,0,0,0,0|2,0,0]=3 258 B13R2.2130 COC1=CC2=C(C=C1)C(I)=NN2 K6150 [0,1,0,0,0,0|2,0,0]=3 259 B13R2.2130 N#CC1=CC2=C(C=C1)C(Br)=CN2 B29612 [0,1,0,0,0,0|3,0,0]=4 260 B13R2.2130 N#CC1=CC2=C(C=C1)C(N)=NN2 A13443 [0,1,0,0,0,0|2,0,0]=3 261 B13R2.2130 N#CC1=CC2=C(C=C1)C(N)=NO2 A47641 [0,1,0,0,0,0|3,0,0]=4 262 B13R2.2130 NCC1=CC2=C(C=C1)C(N)=NN2 A13442 [0,1,0,0,0,0|2,0,0]=3 263 B13R2.2130 O=CC1=CC2=C(C=C1)C(I)=NN2 I11781 [0,1,0,0,0,0|2,0,0]=3 264 B13R2.5180 NC1=NNC2=C1C=CC(F)=C2F D44863 [0,1,0,0,0,0|1,0,0]=2 265 B13R2.5180 O=C1CCC2=C1C=CC(F)=C2Br B63747 [0,1,0,0,0,0|2,0,1]=4 266 B13R2.5180 O=C1CCC2=C1C=CC(F)=C2F D36738 [0,1,0,0,0,0|2,0,1]=4 267 B13R2.5187 CC1=NN(C)C2=C1C=CC(Br)=C2 B10394 [0,1,0,0,0,0|1,1,0]=3 268 B13R2.5187 CC1=NN(C)C2=C1C=CC(Cl)=N2 C20182 [0,1,0,0,0,0|2,1,0]=4 269 B13R2.5187 CC1=NN(C)C2=C1C=CC(N)=C2 D8180 [0,1,0,0,0,0|2,0,0]=3 270 B13R2.5187 CN1N=C(Br)C2=C1C=C(N)C=C2 B9703 [0,1,0,0,0,0|2,0,0]=3 271 B13R2.5187 CN1N=C(Cl)C2=C1C=C(Br)C=C2 B29574 [0,1,0,0,0,0|1,1,0]=3 272 B13R2.5187 CN1N=C(N)C2=C1C=C(Br)C=C2 B48853 [0,1,0,0,0,0|1,1,0]=3 273 B13R2.5187 CN1N=C(N)C2=C1C=C(F)C=C2 A3543 [0,1,0,0,0,0|1,0,0]=2 274 B13R2.5187 CN1N=C(N)C2=C1C=C(O)C=C2 A49213 [0,1,0,0,0,0|2,0,0]=3 275 B13R2.5187 CN1N=C(N)C2=C1C=CC(F)=C2 A3541 [0,1,0,0,0,0|3,0,0]=4 276 B13R2.5187 CN1N=C(N)C2=C1N=C(Cl)C=C2 C45755 [0,1,0,0,0,0|2,1,0]=4 277 B13R2.5190 C[C@H]1CC2=C(C=CC(F)=C2)C1=O F54060 [0,1,0,0,0,0|2,0,1]=4 278 B13R2.5190 O=C1NC2=C(C=CC(Br)=C2)C1=O B9750 [0,1,0,0,0,0|1,1,1]=4 279 B13R2.5190 O=C1NC2=C(C=CC(Cl)=C2)C1=O C38431 [0,1,0,0,0,0|1,1,1]=4 280 B13R2.5190 O=C1NC2=C(C=CC(F)=C2)C1=O F47400 [0,1,0,0,0,0|1,0,1]=3 281 B13R2.5190 O=C1NC2=C(C=CC(I)=C2)C1=O K47409 [0,1,0,0,0,0|1,1,1]=4 282 B13R2.11634 CC1=C(Cl)C=C2C(=C1)NN=C2Cl D47857 [0,1,0,0,0,0|2,0,0]=3 283 B13R2.11634 CC1=CC2=C(C=C1Br)C(I)=NN2 B19017 [0,1,0,0,0,0|2,0,0]=3 284 B13R2.11634 CC1=CNC2=CC(Br)=C(Cl)C=C12 B27247 [0,1,0,0,0,0|2,1,0]=4 285 B13R2.11634 CC1=NNC2=CC(Br)=C(F)C=C21 B19374 [0,1,0,0,0,0|1,1,0]=3 286 B13R2.11634 CC1=NNC2=CC(F)=C(Br)C=C21 B7826 [0,1,0,0,0,0|1,0,0]=2 287 B13R2.11634 FC1=CC2=C(C=C1Br)C(I)=NN2 B44048 [0,1,0,0,0,0|1,0,0]=2 288 B13R2.11634 O=C1CCC2=CC(F)=C(Br)C=C12 B51015 [0,1,0,0,0,0|2,0,1]=4 289 B13R2.11634 O=C1CCC2=CC(F)=C(Cl)C=C12 C51029 [0,1,0,0,0,0|2,0,1]=4 290 B13R2.11634 O=C1CCC2=CC(F)=C(F)C=C12 D36690 [0,1,0,0,0,0|2,0,1]=4 291 B13R2.11634 O=C1NCC2=CC(F)=C(Br)C=C12 B69830 [0,1,0,0,0,0|1,0,2]=4 292 B13R2.11634 O=C1NCC2=CC(F)=C(F)C=C12 D69732 [0,1,0,0,0,0|1,0,2]=4 293 B13R2.11642 CC1=NNC2=C1C(Cl)=NC(Cl)=C2 D44862 [0,1,0,0,0,0|2,1,0]=4 294 B13R2.11642 CC1=NNC2=CC(N)=CC(F)=C21 A7789 [0,1,0,0,0,0|2,0,0]=3 295 B13R2.11642 ClC1=NC(Cl)=C2C(=C1)NN=C2I D41699 [0,1,0,0,0,0|2,1,0]=4 296 B13R2.11642 FC1=CC(F)=C2C(=C1)NN=C2I D44050 [0,1,0,0,0,0|1,0,0]=2 297 B13R2.11642 NC1=CC(F)=C2C(=C1)NN=C2Cl A13239 [0,1,0,0,0,0|2,0,0]=3 298 B13R2.11642 NC1=CC(F)=C2C(=O)NNC2=C1 A15080 [0,1,0,0,0,0|1,0,2]=4 299 B13R2.11642 NC1=NNC2=CC(Br)=CC(F)=C21 B44859 [0,1,0,0,0,0|1,1,0]=3 300 B13R2.11642 O=C1CCC2=CC(F)=CC(Br)=C12 B51016 [0,1,0,0,0,0|2,0,1]=4 301 B13R2.11642 O=C1CCC2=CC(F)=CC(F)=C12 D51031 [0,1,0,0,0,0|2,0,1]=4 302 B13R2.11642 O=C1NCC2=CC(F)=CC(F)=C12 D69823 [0,1,0,0,0,0|1,0,2]=4 303 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 A52107 [0,0,1,0,0,0|2,0,1]=4 304 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 T46647 [0,0,1,0,0,0|1,0,2]=4 305 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 F39582 [0,0,1,0,0,0|2,0,1]=4 306 B11R1.22 COC(=O)C1=CC=C(F)C=C1 M67923 [0,0,1,0,0,0|2,0,1]=4 307 B11R1.22 C\C(=N\O)C1=CC=C(Cl)C=C1 C67180 [0,0,1,0,0,0|2,1,0]=4 308 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 B49032 [0,0,1,0,0,0|1,1,1]=4 309 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 A49045 [0,0,1,0,0,0|1,1,1]=4 310 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 A49617 [0,0,1,0,0,0|1,0,1]=3 311 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 C45695 [0,0,1,0,0,0|0,1,2]=4 312 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 F45705 [0,0,1,0,0,0|0,0,2]=3 313 B11R1.22 NNC(=O)C1=NC=C(F)C=C1 F42828 [0,0,1,0,0,0|1,0,2]=4 314 B11R1.24 [N-]=[N+]=NCC1=CC=CC(F)=C1 A9128 [0,0,1,0,0,0|3,0,0]=4 315 B11R1.37 C#CC1=C(C=O)C=CC(F)=C1 E50787 [0,0,1,0,0,0|2,0,1]=4 316 B11R1.37 COC1=C(C=O)C=CC(F)=C1 F38615 [0,0,1,0,0,0|2,0,1]=4 317 B11R1.37 N#CC1=C(C=O)C=CC(F)=C1 C47446 [0,0,1,0,0,0|1,0,2]=4 318 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=C1 C48277 [0,0,1,0,0,0|2,0,1]=4 319 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 D69359 [0,0,1,0,0,0|2,0,1]=4 320 B11R1.166 CC(=O)C1=C(N)C=C(Br)C=C1 A49024 [0,0,1,0,0,0|1,1,1]=4 321 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 A50025 [0,0,1,0,0,0|2,0,1]=4 322 B11R1.166 CC(=O)C1=C(N)C=C(Cl)C=C1 A49037 [0,0,1,0,0,0|1,1,1]=4 323 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 F69072 [0,0,1,0,0,0|2,0,1]=4 324 B11R1.166 CC1=C(B(O)O)C=CC(F)=C1 F3300 [0,0,1,0,0,0|3,0,0]=4 325 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 B24914 [0,0,1,0,0,0|2,1,0]=4 326 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 C38469 [0,0,1,0,0,0|2,1,0]=4 327 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 F48615 [0,0,1,0,0,0|2,0,0]=3 328 B11R1.166 CC1=C(C(=O)O)C=CC(F)=N1 F45382 [0,0,1,0,0,0|3,0,0]=4 329 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 A49284 [0,0,1,0,0,0|3,0,0]=4 330 B11R1.166 CC1=C(C(=O)O)C=CC(O)=C1 H68873 [0,0,1,0,0,0|3,0,0]=4 331 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 B25317 [0,0,1,0,0,0|3,0,0]=4 332 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 C38447 [0,0,1,0,0,0|3,0,0]=4 333 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 F48610 [0,0,1,0,0,0|3,0,0]=4 334 B11R1.166 CC1=CC(F)=NC=C1C(=O)O F45383 [0,0,1,0,0,0|3,0,0]=4 335 B11R1.166 CC1=CC(I)=C(C(=O)O)C=C1 K61454 [0,0,1,0,0,0|3,0,0]=4 336 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 A49282 [0,0,1,0,0,0|2,0,0]=3 337 B11R1.166 CC1=CC(N)=C(C(=O)O)C=N1 A12850 [0,0,1,0,0,0|3,0,0]=4 338 B11R1.166 CC1=CC(N)=C(C(N)=O)C=C1 A46651 [0,0,1,0,0,0|1,0,2]=4 339 B11R1.166 CC1=CC(O)=C(C(=O)O)C=C1 M68144 [0,0,1,0,0,0|3,0,0]=4 340 B11R1.166 CC1=NC(N)=C(C(=O)O)C=C1 A10622 [0,0,1,0,0,0|3,0,0]=4 341 B11R1.166 N=C(N)C1=C(F)C=C(Br)C=C1 B66610 [0,0,1,0,0,0|2,1,0]=4 342 B11R1.166 NC(=O)C1=C(F)C=C(F)C=C1 D45062 [0,0,1,0,0,0|1,0,2]=4 343 B11R1.166 NC(=O)C1=C(N)C=C(Br)C=C1 A45686 [0,0,1,0,0,0|0,1,2]=4 344 B11R1.166 NC(=O)C1=C(N)C=C(Cl)C=C1 A67559 [0,0,1,0,0,0|0,1,2]=4 345 B11R1.166 NC(=O)C1=C(N)C=C(F)C=C1 A45706 [0,0,1,0,0,0|0,0,2]=3 346 B11R1.166 NC(=O)C1=C(N)C=C(O)C=C1 A45995 [0,0,1,0,0,0|1,0,2]=4 347 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 A22277 [0,0,1,0,0,0|1,1,0]=3 348 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=N1 A42389 [0,0,1,0,0,0|2,1,0]=4 349 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 A64964 [0,0,1,0,0,0|1,1,0]=3 350 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=N1 A0415 [0,0,1,0,0,0|2,1,0]=4 351 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 A39388 [0,0,1,0,0,0|1,0,0]=2 352 B11R1.166 NC1=C(C(=O)O)C=CC(I)=C1 A45394 [0,0,1,0,0,0|1,1,0]=3 353 B11R1.166 NC1=C(C(=O)O)C=CC(O)=C1 A45838 [0,0,1,0,0,0|2,0,0]=3 354 B11R1.166 NC1=C([N+](=O)[O-])C=CC(F)=C1 F42418 [0,0,1,0,0,0|2,0,1]=4 355 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O A0231 [0,0,1,0,0,0|2,1,0]=4 356 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O A20229 [0,0,1,0,0,0|2,1,0]=4 357 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 A69021 [0,0,1,0,0,0|3,0,0]=4 358 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O A7927 [0,0,1,0,0,0|2,1,0]=4 359 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O A8132 [0,0,1,0,0,0|2,1,0]=4 360 B11R1.166 NC1=CC(Cl)=NC=C1C(=O)O A10470 [0,0,1,0,0,0|2,1,0]=4 361 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 A45378 [0,0,1,0,0,0|3,0,0]=4 362 B11R1.166 NC1=CC(F)=NC=C1C(=O)O A10496 [0,0,1,0,0,0|2,0,0]=3 363 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 A69652 [0,0,1,0,0,0|3,0,0]=4 364 B11R1.166 O=C(Cl)C1=C(F)C=C(F)C=C1 D44260 [0,0,1,0,0,0|2,0,1]=4 365 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 D44562 [0,0,1,0,0,0|2,1,0]=4 366 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)C=C1 B26650 [0,0,1,0,0,0|2,1,0]=4 367 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 B27964 [0,0,1,0,0,0|2,0,0]=3 368 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=N1 B41919 [0,0,1,0,0,0|3,0,0]=4 369 B11R1.166 O=C(O)C1=C(Br)C=C(I)C=C1 B44582 [0,0,1,0,0,0|2,1,0]=4 370 B11R1.166 O=C(O)C1=C(Br)C=C(O)C=C1 B45109 [0,0,1,0,0,0|3,0,0]=4 371 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 B44570 [0,0,1,0,0,0|2,1,0]=4 372 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 D68555 [0,0,1,0,0,0|2,1,0]=4 373 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=N1 C41937 [0,0,1,0,0,0|3,0,0]=4 374 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 C45116 [0,0,1,0,0,0|3,0,0]=4 375 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 C45121 [0,0,1,0,0,0|3,0,0]=4 376 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 B36989 [0,0,1,0,0,0|2,1,0]=4 377 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 C23721 [0,0,1,0,0,0|2,1,0]=4 378 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 D39341 [0,0,1,0,0,0|2,0,0]=3 379 B11R1.166 O=C(O)C1=C(F)C=C(F)C=N1 D25175 [0,0,1,0,0,0|3,0,0]=4 380 B11R1.166 O=C(O)C1=C(F)C=C(I)C=C1 F44613 [0,0,1,0,0,0|2,1,0]=4 381 B11R1.166 O=C(O)C1=C(F)C=C(O)C=C1 F38868 [0,0,1,0,0,0|3,0,0]=4 382 B11R1.166 O=C(O)C1=C(I)C=C(Br)C=C1 B37202 [0,0,1,0,0,0|2,1,0]=4 383 B11R1.166 O=C(O)C1=C(I)C=C(Cl)C=C1 C44601 [0,0,1,0,0,0|2,1,0]=4 384 B11R1.166 O=C(O)C1=C(I)C=C(F)C=C1 F44616 [0,0,1,0,0,0|2,0,0]=3 385 B11R1.166 O=C(O)C1=C(O)C=C(Br)C=C1 B45112 [0,0,1,0,0,0|2,1,0]=4 386 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 F45124 [0,0,1,0,0,0|2,0,0]=3 387 B11R1.166 O=C(O)C1=CC=C(F)N=C1Cl C41936 [0,0,1,0,0,0|3,0,0]=4 388 B11R1.166 O=C(O)C1=CC=C(F)N=C1F D41950 [0,0,1,0,0,0|3,0,0]=4 389 B11R1.166 OB(O)C1=C(Cl)C=C(F)C=C1 C42688 [0,0,1,0,0,0|3,0,0]=4 390 B11R1.166 OB(O)C1=C(F)C=C(F)C=C1 D2620 [0,0,1,0,0,0|3,0,0]=4 391 B11R1.166 OB(O)C1=C(O)C=C(F)C=C1 F3214 [0,0,1,0,0,0|3,0,0]=4 392 B13R2.3683 CC1=CC=C2C=C(Cl)N=CC2=C1 C37650 [0,0,0,0,0,1|3,0,0]=4 393 B13R2.3683 CC1=CC=C2C=C(F)C=CC2=N1 F53735 [0,0,0,0,0,1|3,0,0]=4 394 B13R2.3683 CC1=CC=C2N=C(Cl)N=CC2=C1 C51084 [0,0,0,0,0,1|3,0,0]=4 395 B13R2.3683 CC1=NC=C2C=C(Br)C=CC2=C1 B36715 [0,0,0,0,0,1|2,1,0]=4 396 B13R2.3683 ClC1=CC=C2N=C(Cl)N=CC2=C1 D24825 [0,0,0,0,0,1|2,1,0]=4 397 B13R2.3683 ClC1=NC=C2C=C(Br)C=CC2=C1 B1552 [0,0,0,0,0,1|2,1,0]=4 398 B13R2.3683 ClC1=NC=C2C=C(Br)C=CC2=N1 B1696 [0,0,0,0,0,1|2,1,0]=4 399 B13R2.3683 FC1=CC=C2C=C(Br)C=CC2=C1 B53420 [0,0,0,0,0,1|3,0,0]=4 400 B13R2.3683 FC1=CC=C2N=C(Br)C=CC2=C1 B50720 [0,0,0,0,0,1|3,0,0]=4 401 B13R2.3683 FC1=CC=C2N=C(Cl)C=NC2=C1 C47342 [0,0,0,0,0,1|2,0,1]=4 402 B13R2.3683 NC1=CC=C2C=C(F)C=CC2=C1 F53736 [0,0,0,0,0,1|3,0,0]=4 403 B13R2.3683 NC1=CC=C2C=C(F)C=CC2=N1 F51093 [0,0,0,0,0,1|3,0,0]=4 404 B13R2.3683 NC1=CC=C2C=C(O)C=NC2=C1 A51342 [0,0,0,0,0,1|2,0,1]=4 405 B13R2.3683 NC1=NC=C2C=C(Br)C=CC2=C1 A14303 [0,0,0,0,0,1|2,1,0]=4 406 B13R2.3683 NC1=NC=C2C=C(Br)C=CC2=N1 B60520 [0,0,0,0,0,1|2,1,0]=4 407 B13R2.3683 O=C1CCC2=C(C=CC(F)=C2)C1 F54058 [0,0,0,0,0,1|2,0,1]=4 408 B13R2.3683 O=C1CNC2=C(C=CC(Br)=C2)N1 B61857 [0,0,0,0,0,1|1,1,1]=4 409 B13R2.3683 O=C1N=CC2=C(C=CC(Br)=C2)N1 B10857 [0,0,0,0,0,1|1,1,1]=4 410 B13R2.3683 OC1=CC=C2C=C(Br)C=CC2=C1 B67431 [0,0,0,0,0,1|2,1,0]=4 411 B13R2.3683 OC1=CC=C2C=C(Cl)C=CC2=C1 C63906 [0,0,0,0,0,1|2,1,0]=4 412 B13R2.3683 OC1=CC=C2C=C(F)C=CC2=C1 F53620 [0,0,0,0,0,1|2,0,0]=3 413 B13R2.3683 OC1=CC=C2C=C(I)C=CC2=N1 K50959 [0,0,0,0,0,1|2,1,0]=4 414 B13R2.3683 OC1=CC=C2N=C(Cl)N=CC2=C1 C37306 [0,0,0,0,0,1|3,0,0]=4 415 B13R2.3683 OC1=CN=C2C=C(Br)C=CC2=N1 B47608 [0,0,0,0,0,1|1,1,1]=4 416 B13R2.5179 CC1=CC=C2C(=C1)N=CN=C2Cl C51088 [0,0,0,0,0,1|2,0,1]=4 417 B13R2.5179 ClC1=C2C=CC(Br)=CC2=CC=N1 B5662 [0,0,0,0,0,1|2,1,0]=4 418 B13R2.5179 ClC1=C2C=CC(Br)=CC2=CN=N1 B7678 [0,0,0,0,0,1|1,1,1]=4 419 B13R2.5179 ClC1=C2C=CC(Br)=CC2=NC=N1 B7483 [0,0,0,0,0,1|1,1,1]=4 420 B13R2.5179 ClC1=C2C=CC(I)=CC2=NC=N1 C12212 [0,0,0,0,0,1|1,1,1]=4 421 B13R2.5179 ClC1=CC=C2C(=C1)C=CN=C2Cl D50735 [0,0,0,0,0,1|2,1,0]=4 422 B13R2.5179 ClC1=CC=C2C(=C1)C=NN=C2Cl D12700 [0,0,0,0,0,1|1,1,1]=4 423 B13R2.5179 ClC1=CC=C2C(=C1)N=CN=C2Cl D47336 [0,0,0,0,0,1|1,1,1]=4 424 B13R2.5179 FC1=CC=C2C(=C1)C=CN=C2Cl C9908 [0,0,0,0,0,1|2,0,0]=3 425 B13R2.5179 FC1=CC=C2C(=C1)C=NN=C2Cl C47340 [0,0,0,0,0,1|1,0,1]=3 426 B13R2.5179 FC1=CC=C2C(=C1)N=CN=C2Cl C21674 [0,0,0,0,0,1|1,0,1]=3 427 B13R2.5179 FC1=CC=C2C(Br)=CC=NC2=C1 B37551 [0,0,0,0,0,1|2,0,1]=4 428 B13R2.5179 FC1=CC=C2C(Cl)=CC=NC2=C1 C50737 [0,0,0,0,0,1|2,0,1]=4 429 B13R2.5179 NC1=C2C=CC(Br)=CC2=CC=N1 B9893 [0,0,0,0,0,1|2,1,0]=4 430 B13R2.5179 NC1=C2C=CC(Br)=CC2=NC=N1 B47914 [0,0,0,0,0,1|1,1,1]=4 431 B13R2.5179 O=C1C=CNC2=C1C=CC(O)=C2 H62038 [0,0,0,0,0,1|2,0,1]=4 432 B13R2.5179 O=C1CCCC2=C1C=CC(F)=C2 F54057 [0,0,0,0,0,1|2,0,1]=4 433 B13R2.5179 O=C1CCOC2=C1C=CC(F)=C2 F51257 [0,0,0,0,0,1|2,0,1]=4 434 B13R2.5179 O=C1N=CNC2=C1C=CC(Br)=C2 B1649 [0,0,0,0,0,1|0,1,1]=3 435 B13R2.5179 O=C1NC=NC2=C1C=CC(F)=C2 F3168 [0,0,0,0,0,1|0,0,3]=4 436 B13R2.5179 O=C1NCCC2=C1C=CC(F)=C2 F51539 [0,0,0,0,0,1|1,0,2]=4 437 B13R2.5179 O=C1NN=CC2=C1C=CC(Br)=C2 B1563 [0,0,0,0,0,1|1,1,1]=4 438 B13R2.5179 O=C1NN=CC2=C1C=CC(Cl)=C2 C1564 [0,0,0,0,0,1|1,1,1]=4 439 B13R2.5179 O=C1NN=CC2=C1C=CC(F)=C2 F63894 [0,0,0,0,0,1|1,0,1]=3 440 B13R2.5179 OC1=C2C=CC(Br)=CC2=CC=C1 B36899 [0,0,0,0,0,1|2,1,0]=4 441 B13R2.5179 OC1=C2C=CC(Br)=CC2=CC=N1 B9202 [0,0,0,0,0,1|1,1,0]=3 442 B13R2.5179 OC1=C2C=CC(Br)=CC2=NC=C1 B38608 [0,0,0,0,0,1|1,1,1]=4 443 B13R2.5179 OC1=C2C=CC(Cl)=CC2=NC=C1 C68977 [0,0,0,0,0,1|1,1,1]=4 444 B13R2.5179 OC1=C2C=CC(Cl)=CC2=NC=N1 C47613 [0,0,0,0,0,1|0,1,1]=3 445 B13R2.5179 OC1=C2C=CC(F)=CC2=CC=C1 F53619 [0,0,0,0,0,1|2,0,0]=3 446 B13R2.5179 OC1=CC=C2C(=C1)C=CN=C2Cl C50929 [0,0,0,0,0,1|3,0,0]=4 447 B13R2.5179 OC1=CC=C2C(O)=CC=CC2=C1 D69657 [0,0,0,0,0,1|3,0,0]=4 448 B13R2.5179 O[C@H]1CCCC2=C1C=CC(F)=C2 F63760 [0,0,0,0,0,1|2,0,1]=4 449 B10R1.1 NCCC1=CC=C(F)C=C1 F69101 [1,0,1,0,0,0|1,0,1]=4 450 B10R1.1 NNCC1=CC=C(F)C=C1 F0090 [1,0,1,0,0,0|0,0,2]=4 451 B10R1.1 NOCC1=CC=C(F)C=C1 F46562 [1,0,1,0,0,0|1,0,1]=4 452 B10R1.1 ON=CC1=CC=C(O)C=C1 H45817 [1,0,1,0,0,0|2,0,0]=4 453 B10R1.1 O\N=C\C1=CC=C(F)C=C1 F64667 [1,0,1,0,0,0|1,0,0]=3 454 B10R1.13 C=C(C)C1=CC=C(F)C=C1 F51670 [1,0,1,0,0,0|2,0,0]=4 455 B10R1.13 CC(=O)C1=CC=C(F)C=C1 F38426 [1,0,1,0,0,0|1,0,1]=4 456 B10R1.13 CC1=CC=C(C(=N)N)C=C1 M38078 [1,0,1,0,0,0|2,0,0]=4 457 B10R1.13 CC1=CC=C(C(=O)O)C=C1 M64877 [1,0,1,0,0,0|2,0,0]=4 458 B10R1.13 CC1=CC=C(C(N)=O)C=C1 M39514 [1,0,1,0,0,0|1,0,1]=4 459 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 F46766 [1,0,1,0,0,0|1,0,1]=4 460 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 F49509 [1,0,1,0,0,0|1,0,1]=4 461 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 F49461 [1,0,1,0,0,0|1,0,1]=4 462 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 F36974 [1,0,1,0,0,0|1,0,1]=4 463 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 F64415 [1,0,1,0,0,0|1,0,1]=4 464 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 F49463 [1,0,1,0,0,0|1,0,1]=4 465 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 B45615 [1,0,1,0,0,0|1,1,0]=4 466 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 B45619 [1,0,1,0,0,0|1,1,0]=4 467 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 C45622 [1,0,1,0,0,0|1,1,0]=4 468 B10R1.13 N=C(N)C1=CC=C(F)C=C1 F46534 [1,0,1,0,0,0|1,0,0]=3 469 B10R1.13 N=C(N)C1=CC=C(F)C=C1 F9396 [1,0,1,0,0,0|1,0,0]=3 470 B10R1.13 N=C(N)C1=CC=C(N)C=C1 A4675 [1,0,1,0,0,0|2,0,0]=4 471 B10R1.13 N=C(N)C1=CC=C(O)C=C1 H46554 [1,0,1,0,0,0|2,0,0]=4 472 B10R1.13 N=C(N)C1=CN=C(F)C=C1 F10578 [1,0,1,0,0,0|2,0,0]=4 473 B10R1.13 N=C(N)C1=NC=C(F)C=C1 F1754 [1,0,1,0,0,0|2,0,0]=4 474 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 B45467 [1,0,1,0,0,0|0,1,1]=4 475 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 C45478 [1,0,1,0,0,0|0,1,1]=4 476 B10R1.13 NC(=O)C1=CC=C(N)C=C1 A37818 [1,0,1,0,0,0|1,0,1]=4 477 B10R1.13 NC(=O)C1=NC=C(F)C=C1 F42460 [1,0,1,0,0,0|1,0,1]=4 478 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 C64929 [1,0,1,0,0,0|0,2,0]=4 479 B10R1.13 NC(=S)C1=CC=C(O)C=C1 H39401 [1,0,1,0,0,0|1,1,0]=4 480 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 C67273 [1,0,1,0,0,0|1,1,0]=4 481 B10R1.13 O=C(O)C1=CC=C(I)C=C1 K39365 [1,0,1,0,0,0|1,1,0]=4 482 B10R1.13 O=C(O)C1=CC=C(S)C=C1 M69070 [1,0,1,0,0,0|2,0,0]=4 483 B10R1.13 O=C(O)C1=CN=C(F)C=C1 F2849 [1,0,1,0,0,0|2,0,0]=4 484 B10R1.13 O=C(O)C1=NC=C(F)C=C1 F13767 [1,0,1,0,0,0|2,0,0]=4 485 B10R1.13 OB(O)C1=CC=C(F)C=C1 F3380 [1,0,1,0,0,0|2,0,0]=4 486 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 A67914 [1,0,1,0,0,0|1,0,1]=4 487 B10R1.15 NN=C(N)C1=NC=CC=C1 P37720 [1,0,1,0,0,0|2,0,0]=4 488 B10R1.15 NNC(=O)C1=CC=CC=C1 B69029 [1,0,1,0,0,0|0,0,2]=4 489 B10R1.10 OCCC1=CC=CC(F)=C1 F49458 [1,0,1,0,0,0|1,0,1]=4 490 B10R1.20 CNC1=C(C=O)C=CC=C1 M49260 [1,0,1,0,0,0|1,0,1]=4 491 B10R1.20 CNC1=C(CO)C=CC=C1 M38311 [1,0,1,0,0,0|1,0,1]=4 492 B10R1.25 CC1=C(C=O)C=CC(F)=C1 F48741 [1,0,1,0,0,0|1,0,1]=4 493 B10R1.25 CC1=CC(N)=C(CO)C=C1 A46913 [1,0,1,0,0,0|1,0,1]=4 494 B10R1.25 COC1=C(N)C=C(F)C=C1 F46211 [1,0,1,0,0,0|2,0,0]=4 495 B10R1.25 N#CC1=C(N)C=C(F)C=C1 A44792 [1,0,1,0,0,0|0,0,2]=4 496 B10R1.25 NC1=C(C=O)C=CC(Br)=C1 A45469 [1,0,1,0,0,0|0,1,1]=4 497 B10R1.25 NC1=C(C=O)C=CC(Cl)=C1 A45480 [1,0,1,0,0,0|0,1,1]=4 498 B10R1.25 NC1=C(C=O)C=CC(F)=C1 A61199 [1,0,1,0,0,0|0,0,1]=3 499 B10R1.25 NC1=C(CO)C=CC(Br)=C1 A46164 [1,0,1,0,0,0|0,1,1]=4 500 B10R1.25 NC1=C(CO)C=CC(Cl)=C1 A46195 [1,0,1,0,0,0|0,1,1]=4 501 B10R1.25 NC1=CC(N)=C(C=O)C=C1 D45975 [1,0,1,0,0,0|1,0,1]=4 502 B10R1.25 O=CC1=C(Br)C=C(F)C=C1 B39342 [1,0,1,0,0,0|1,0,1]=4 503 B10R1.25 O=CC1=C(Cl)C=C(F)C=C1 C39345 [1,0,1,0,0,0|1,0,1]=4 504 B10R1.25 O=CC1=C(F)C=C(F)C=C1 D44675 [1,0,1,0,0,0|1,0,1]=4 505 B10R1.25 O=CC1=C(O)C=C(F)C=C1 F23204 [1,0,1,0,0,0|1,0,1]=4 506 B10R1.25 OCC1=C(Br)C=C(F)C=C1 B45567 [1,0,1,0,0,0|1,0,1]=4 507 B10R1.25 OCC1=C(Cl)C=C(F)C=C1 C45594 [1,0,1,0,0,0|1,0,1]=4 508 B10R1.25 OCC1=C(F)C=C(F)C=C1 D45607 [1,0,1,0,0,0|1,0,1]=4 509 B10R1.30 COC1=C(O)C=CC(F)=C1 F23730 [1,0,1,0,0,0|2,0,0]=4 510 B10R1.30 N#CC1=C(O)C=CC(F)=C1 F44550 [1,0,1,0,0,0|1,0,1]=4 511 B10R1.30 NNC1=C(Br)C=CC(F)=C1 B42737 [1,0,1,0,0,0|1,0,1]=4 512 B10R1.30 NNC1=C(Cl)C=CC(F)=C1 C42761 [1,0,1,0,0,0|1,0,1]=4 513 B10R1.30 NNC1=C(F)C=CC(F)=C1 D43515 [1,0,1,0,0,0|1,0,1]=4 514 B10R1.30 O=CC1=C(O)C=CC(F)=C1 F67833 [1,0,1,0,0,0|2,0,0]=4 515 B10R1.61 C=C(C)C1=C(N)C=CC=C1 P49976 [1,0,1,0,0,0|2,0,0]=4 516 B10R1.61 CC(=O)C1=C(N)C=CC=C1 A49645 [1,0,1,0,0,0|1,0,1]=4 517 B10R1.61 CC1=C(C(=N)N)C=CC=C1 M49487 [1,0,1,0,0,0|2,0,0]=4 518 B10R1.61 CC1=C(C(=O)O)C=CC=C1 T69330 [1,0,1,0,0,0|2,0,0]=4 519 B10R1.61 N=C(N)C1=C(F)C=CC=C1 F46532 [1,0,1,0,0,0|2,0,0]=4 520 B10R1.61 NC(=O)C1=C(N)C=CC=C1 A64967 [1,0,1,0,0,0|0,0,2]=4 521 B10R1.61 NC1=C(B(O)O)C=CC=C1 A1340 [1,0,1,0,0,0|2,0,0]=4 522 B10R1.61 NC1=C(C(=O)O)C=CC=N1 A12487 [1,0,1,0,0,0|2,0,0]=4 523 B10R1.61 NC1=C(C(=O)O)C=CN=C1 A1102 [1,0,1,0,0,0|2,0,0]=4 524 B10R1.61 NC1=C(C(=O)O)C=NC=C1 A4739 [1,0,1,0,0,0|2,0,0]=4 525 B10R1.61 NC1=CC=CN=C1C(=O)O A0472 [1,0,1,0,0,0|2,0,0]=4 526 B10R2.7 C1=CC2=C(C=C1)NC=N2 B69282 [2,0,0,0,0,0|2,0,0]=4 527 B10R2.7 C1=CC2=C(C=C1)NN=C2 I14459 [2,0,0,0,0,0|0,0,0]=2 528 B10R2.7 C1=CC2=C(C=C1)NN=N2 B38421 [2,0,0,0,0,0|1,0,0]=3 529 B10R2.7 C1=CC2=C(C=CN2)C=N1 A3184 [2,0,0,0,0,0|2,0,0]=4 530 B10R2.7 C1=CC2=C(C=N1)C=NN2 P0513 [2,0,0,0,0,0|1,0,0]=3 531 B10R2.7 C1=CC2=C(C=N1)NC=C2 A2957 [2,0,0,0,0,0|2,0,0]=4 532 B10R2.7 C1=CC2=C(C=N1)NN=C2 P9749 [2,0,0,0,0,0|1,0,0]=3 533 B10R2.7 C1=CC2=C(C=N1)NN=N2 T40817 [2,0,0,0,0,0|2,0,0]=4 534 B10R2.7 C1=CC2=CN=CN2C=C1 K62512 [2,0,0,0,0,0|2,0,0]=4 535 B10R2.7 C1=CC2=CN=NN2C=C1 T6808 [2,0,0,0,0,0|1,0,1]=4 536 B10R2.7 C1=CN=C2C=CNC2=C1 A2958 [2,0,0,0,0,0|2,0,0]=4 537 B10R2.7 C1=CN=C2C=NNC2=C1 P0514 [2,0,0,0,0,0|1,0,0]=3 538 B10R2.7 C1=CN=C2N=NNC2=C1 T40816 [2,0,0,0,0,0|2,0,0]=4 539 B10R2.7 C1=CN=C2NC=CC2=C1 A4765 [2,0,0,0,0,0|2,0,0]=4 540 B10R2.7 C1=CN=C2NN=CC2=C1 P6130 [2,0,0,0,0,0|1,0,0]=3 541 B10R2.7 C1=CN=C2NN=CC2=N1 P6228 [2,0,0,0,0,0|2,0,0]=4 542 B10R2.7 C1=NC=C2C=NNC2=N1 P15484 [2,0,0,0,0,0|2,0,0]=4 543 B10R2.7 C1=NNC2=CN=NC=C12 P37768 [2,0,0,0,0,0|2,0,0]=4 544 B12R1.1703 NNC(=O)C1=C(F)C=C(F)C=C1 D37659 [0,1,1,0,0,0|0,0,2]=4 545 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 F51935 [0,1,1,0,0,0|2,0,0]=4 546 B12R1.226 O=C(O)COC1=CC=CC(F)=C1 F48670 [0,1,1,0,0,0|2,0,0]=4 547 B12R1.57 COC1=C(C(=O)O)C=CC(F)=C1 F48675 [0,1,1,0,0,0|2,0,0]=4 548 B12R1.57 NNC1=C(C(=O)O)C=CC(Br)=C1 B45645 [0,1,1,0,0,0|0,1,1]=4 549 B12R1.57 O=CC1=C(C(=O)O)C=CC(F)=C1 F47805 [0,1,1,0,0,0|2,0,0]=4 550 B12R1.232 CC1=C(Cl)C=C(N)C(C(=O)O)=C1 A65831 [0,1,1,0,0,0|1,1,0]=4 551 B12R1.232 CC1=CC(C(=O)O)=C(Br)C=C1F B48144 [0,1,1,0,0,0|2,0,0]=4 552 B12R1.232 CC1=CC(C(=O)O)=C(F)C=C1F D48193 [0,1,1,0,0,0|2,0,0]=4 553 B12R1.232 CC1=CC(F)=C(F)C=C1C(=O)O D48198 [0,1,1,0,0,0|2,0,0]=4 554 B12R1.232 CC1=CC(N)=C(C(=O)O)C=C1C A50065 [0,1,1,0,0,0|2,0,0]=4 555 B12R1.232 NC1=CC(Br)=C(Br)C=C1C(=O)O A44932 [0,1,1,0,0,0|1,1,0]=4 556 B12R1.232 NC1=CC(Br)=C(Cl)C=C1C(=O)O A37910 [0,1,1,0,0,0|1,1,0]=4 557 B12R1.232 NC1=CC(Br)=C(F)C=C1C(=O)O A37099 [0,1,1,0,0,0|1,1,0]=4 558 B12R1.232 NC1=CC(Cl)=C(Br)C=C1C(=O)O A39023 [0,1,1,0,0,0|1,1,0]=4 559 B12R1.232 NC1=CC(Cl)=C(F)C=C1C(=O)O A67721 [0,1,1,0,0,0|1,1,0]=4 560 B12R1.232 NC1=CC(F)=C(Br)C=C1C(=O)O A37782 [0,1,1,0,0,0|1,0,0]=3 561 B12R1.232 NC1=CC(F)=C(Cl)C=C1C(=O)O A44974 [0,1,1,0,0,0|1,0,0]=3 562 B12R1.232 NC1=CC(F)=C(F)C=C1C(=O)O A67487 [0,1,1,0,0,0|1,0,0]=3 563 B12R1.232 O=C(O)C1=C(Br)C=C(F)C(F)=C1 B44198 [0,1,1,0,0,0|2,0,0]=4 564 B12R1.232 O=C(O)C1=C(Cl)C=C(F)C(F)=C1 C44211 [0,1,1,0,0,0|2,0,0]=4 565 B12R1.232 O=C(O)C1=C(I)C=C(F)C(F)=C1 D44221 [0,1,1,0,0,0|2,0,0]=4 566 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1F B22818 [0,1,1,0,0,0|2,0,0]=4 567 B12R1.232 O=C(O)C1=CC(Cl)=C(F)C=C1F C44216 [0,1,1,0,0,0|2,0,0]=4 568 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1O D44627 [0,1,1,0,0,0|2,0,0]=4 569 B12R1.232 O=C(O)C1=CC(I)=C(F)C=C1Cl C44218 [0,1,1,0,0,0|2,0,0]=4 570 B12R1.232 O=C(O)C1=CC(I)=C(F)C=C1F D29699 [0,1,1,0,0,0|2,0,0]=4 571 B12R1.452 COC1=CC(N)=C(C(=O)O)C=C1 A10725 [0,1,1,0,0,0|2,0,0]=4 572 B12R1.893 CC1=C(Br)C=CC(C(=O)O)=C1N A48927 [0,1,1,0,0,0|1,1,0]=4 573 B12R1.893 CC1=C(C(=O)O)C=CC(F)=C1F D48197 [0,1,1,0,0,0|2,0,0]=4 574 B12R1.893 CC1=C(C)C(N)=C(C(=O)O)C=C1 A50064 [0,1,1,0,0,0|2,0,0]=4 575 B12R1.893 CC1=C(F)C=CC(C(=O)O)=C1F D48192 [0,1,1,0,0,0|2,0,0]=4 576 B12R1.893 CC1=C(F)C=CC(C(=O)O)=C1N A48977 [0,1,1,0,0,0|1,0,0]=3 577 B12R1.893 NC1=C(C(=O)O)C=CC(Br)=C1F A31092 [0,1,1,0,0,0|1,1,0]=4 578 B12R1.893 NC1=C(Cl)C(Cl)=CC=C1C(=O)O A44960 [0,1,1,0,0,0|1,1,0]=4 579 B12R1.893 NC1=C(F)C(F)=CC=C1C(=O)O A44985 [0,1,1,0,0,0|1,0,0]=3 580 B12R1.893 O=C(O)C1=CC=C(F)C(Cl)=C1Cl D44204 [0,1,1,0,0,0|2,0,0]=4 581 B12R1.893 O=C(O)C1=CC=C(F)C(Cl)=C1F C44213 [0,1,1,0,0,0|2,0,0]=4 582 B12R1.893 O=C(O)C1=CC=C(F)C(F)=C1Br B44196 [0,1,1,0,0,0|2,0,0]=4 583 B12R1.893 O=C(O)C1=CC=C(F)C(F)=C1F T60789 [0,1,1,0,0,0|2,0,0]=4 584 B12R1.893 O=C(O)C1=CC=C(F)C(F)=C1O D44626 [0,1,1,0,0,0|2,0,0]=4 585 B12R1.1000 CC(=O)C1=C(F)C=C(F)C=C1N A48550 [0,1,1,0,0,0|1,0,1]=4 586 B12R1.1000 CC1=CC(Br)=CC(N)=C1C(=O)O A48928 [0,1,1,0,0,0|1,1,0]=4 587 B12R1.1000 CC1=CC(F)=CC(Br)=C1C(=O)O B48145 [0,1,1,0,0,0|2,0,0]=4 588 B12R1.1000 NC1=CC(Br)=CC(Br)=C1C(=O)O A38955 [0,1,1,0,0,0|1,1,0]=4 589 B12R1.1000 NC1=CC(Br)=CC(F)=C1C(=O)O A63778 [0,1,1,0,0,0|1,1,0]=4 590 B12R1.1000 NC1=CC(Cl)=CC(Cl)=C1C(=O)O A44962 [0,1,1,0,0,0|1,1,0]=4 591 B12R1.1000 NC1=CC(F)=CC(F)=C1C(=O)O A44987 [0,1,1,0,0,0|1,0,0]=3 592 B12R1.1000 O=C(O)C1=C(Br)C=C(F)C=C1F B62354 [0,1,1,0,0,0|2,0,0]=4 593 B12R1.1000 O=C(O)C1=C(Cl)C=C(F)C=C1F C44212 [0,1,1,0,0,0|2,0,0]=4 594 B12R1.1000 O=C(O)C1=C(F)C=C(F)C=C1F T44222 [0,1,1,0,0,0|2,0,0]=4 595 B12R2.1 BrCC1=NOC2=C1C=CC=C2 B48074 [1,1,0,0,0,0|2,0,0]=4 596 B12R2.1 COC1=NNC2=C1C=CC=C2 M15069 [1,1,0,0,0,0|0,0,0]=2 597 B12R2.1 N#CC1=NNC2=C1C=CC=C2 C23955 [1,1,0,0,0,0|1,0,0]=3 598 B12R2.1 N#CC1=NNC2=C1C=CC=N2 P11887 [1,1,0,0,0,0|2,0,0]=4 599 B12R2.1 N#CC1=NNC2=C1C=CN=C2 C11358 [1,1,0,0,0,0|2,0,0]=4 600 B12R2.1 NCC1=CNC2=C1C=CC=C2 K22443 [1,1,0,0,0,0|2,0,0]=4 601 B12R2.1 NCC1=NNC2=C1C=CC=C2 I14709 [1,1,0,0,0,0|1,0,0]=3 602 B12R2.1 NCC1=NNC2=C1C=CC=C2 K49688 [1,1,0,0,0,0|1,0,0]=3 603 B12R2.1 NCC1=NNC2=NC=CC=C12 A12582 [1,1,0,0,0,0|2,0,0]=4 604 B12R2.1 O=CC1=NNC2=C1C=CC=C2 K9332 [1,1,0,0,0,0|0,0,1]=3 605 B12R2.1 O=CC1=NNC2=C1C=CC=N2 P10434 [1,1,0,0,0,0|1,0,1]=4 606 B12R2.1 OCC1=C2C=CC=CN2C=N1 I29505 [1,1,0,0,0,0|2,0,0]=4 607 B12R2.1 OCC1=CNC2=C1C=CC=C2 I4626 [1,1,0,0,0,0|1,0,0]=3 608 B12R2.1 OCC1=CNC2=C1C=CC=N2 H12376 [1,1,0,0,0,0|2,0,0]=4 609 B12R2.1 OCC1=NNC2=C1C=CC=C2 H7713 [1,1,0,0,0,0|0,0,0]=2 610 B12R2.1 OCC1=NNC2=CC=CN=C21 P45740 [1,1,0,0,0,0|1,0,0]=3 611 B12R2.1 OCN1N=NC2=C1C=CC=C2 H45733 [1,1,0,0,0,0|1,0,1]=4 612 B12R2.18 CC1=C(C)C2=C(C=CC=C2)N1 D68340 [1,1,0,0,0,0|2,0,0]=4 613 B12R2.132 BrC1=CC2=C(C=C1)NN=C2I D6152 [1,1,0,0,0,0|1,0,0]=3 614 B12R2.132 BrC1=CC2=C(C=N1)NN=C2I B41872 [1,1,0,0,0,0|2,0,0]=4 615 B12R2.132 BrC1=CC2=C(N=C1)NN=C2I B0440 [1,1,0,0,0,0|2,0,0]=4 616 B12R2.132 BrC1=NC=C2NN=C(Br)C2=C1 D41862 [1,1,0,0,0,0|2,0,0]=4 617 B12R2.132 BrC1=NNC2=C1C=C(I)C=C2 B44316 [1,1,0,0,0,0|1,0,0]=3 618 B12R2.132 CC1=CC2=C(N=C1)NN=C2I I27898 [1,1,0,0,0,0|2,0,0]=4 619 B12R2.132 CC1=CNC2=C1C=C(Br)C=C2 B15960 [1,1,0,0,0,0|2,0,0]=4 620 B12R2.132 CC1=CNC2=C1C=C(Cl)C=C2 C12130 [1,1,0,0,0,0|2,0,0]=4 621 B12R2.132 CC1=CNC2=C1C=C(F)C=C2 F4725 [1,1,0,0,0,0|2,0,0]=4 622 B12R2.132 CC1=NNC2=C1C=C(Br)C=C2 B7595 [1,1,0,0,0,0|1,0,0]=3 623 B12R2.132 CC1=NNC2=C1C=C(N)C=C2 A7593 [1,1,0,0,0,0|1,0,0]=3 624 B12R2.132 CC1=NNC2=C1N=C(Cl)C=C2 C25843 [1,1,0,0,0,0|2,0,0]=4 625 B12R2.132 CC1=NNC2=CN=C(Br)C=C21 B26576 [1,1,0,0,0,0|2,0,0]=4 626 B12R2.132 CC1=NNC2=NC=C(Br)C=C12 B0462 [1,1,0,0,0,0|2,0,0]=4 627 B12R2.132 CC1=NNC2=NC=C(N)C=C12 M17054 [1,1,0,0,0,0|2,0,0]=4 628 B12R2.132 CC1=NOC2=C1C=C(Br)C=C2 B64889 [1,1,0,0,0,0|2,0,0]=4 629 B12R2.132 CC1=NOC2=C1C=C(N)C=C2 A48809 [1,1,0,0,0,0|2,0,0]=4 630 B12R2.132 ClC1=CC2=C(C=C1)NN=C2Br B44296 [1,1,0,0,0,0|1,0,0]=3 631 B12R2.132 ClC1=CC2=C(C=C1)NN=C2I C4883 [1,1,0,0,0,0|1,0,0]=3 632 B12R2.132 ClC1=CC2=C(C=C1)ON=C2Cl D44182 [1,1,0,0,0,0|2,0,0]=4 633 B12R2.132 ClC1=CC=C2NN=C(Br)C2=N1 B41866 [1,1,0,0,0,0|2,0,0]=4 634 B12R2.132 ClC1=CC=C2NN=C(I)C2=N1 C41880 [1,1,0,0,0,0|2,0,0]=4 635 B12R2.132 ClC1=NNC2=C1C=C(Br)C=C2 B0592 [1,1,0,0,0,0|1,0,0]=3 636 B12R2.132 ClC1=NOC2=C1C=C(Br)C=C2 B61945 [1,1,0,0,0,0|2,0,0]=4 637 B12R2.132 FC1=CC2=C(C=C1)NN=C2Br B9807 [1,1,0,0,0,0|1,0,0]=3 638 B12R2.132 FC1=CC2=C(C=C1)NN=C2I F9743 [1,1,0,0,0,0|1,0,0]=3 639 B12R2.132 FC1=CC2=C(C=C1)ON=C2Cl C44185 [1,1,0,0,0,0|2,0,0]=4 640 B12R2.132 FC1=CC2=C(N=C1)NN=C2I F11093 [1,1,0,0,0,0|2,0,0]=4 641 B12R2.132 FC1=NNC2=C1C=C(Br)C=C2 B44306 [1,1,0,0,0,0|1,0,0]=3 642 B12R2.132 NC1=CC2=C(C=C1)NN=C2Br B23841 [1,1,0,0,0,0|1,0,0]=3 643 B12R2.132 NC1=CC2=C(C=C1)NN=C2Cl A12802 [1,1,0,0,0,0|1,0,0]=3 644 B12R2.132 NC1=CC2=C(C=C1)NN=C2I A0593 [1,1,0,0,0,0|1,0,0]=3 645 B12R2.132 NC1=CC2=C(N=C1)NN=C2Br B9851 [1,1,0,0,0,0|2,0,0]=4 646 B12R2.132 NC1=CC2=C(N=C1)NN=C2I A14386 [1,1,0,0,0,0|2,0,0]=4 647 B12R2.132 NC1=NNC2=C1C=C(Br)C=C2 A12794 [1,1,0,0,0,0|1,0,0]=3 648 B12R2.132 NC1=NNC2=C1C=C(Cl)C=C2 A45294 [1,1,0,0,0,0|1,0,0]=3 649 B12R2.132 NC1=NNC2=NC=C(Br)C=C12 B0074 [1,1,0,0,0,0|2,0,0]=4 650 B12R2.132 NC1=NNC2=NC=C(F)C=C12 A0459 [1,1,0,0,0,0|2,0,0]=4 651 B12R2.132 NC1=NOC2=C1C=C(Br)C=C2 B44831 [1,1,0,0,0,0|2,0,0]=4 652 B12R2.132 OC1=NNC2=C1C=C(Br)C=C2 B38675 [1,1,0,0,0,0|0,0,0]=2 653 B12R2.196 BrC1=CC=CC2=C1NN=C2I B10359 [1,1,0,0,0,0|1,0,0]=3 654 B12R2.196 CC1=CC=CC2=C1NN=C2I K48346 [1,1,0,0,0,0|1,0,0]=3 655 B12R2.196 CC1=CNC2=C(N)C=CC=C12 M16465 [1,1,0,0,0,0|2,0,0]=4 656 B12R2.196 CC1=NNC2=C(Br)C=CC=C12 B1701 [1,1,0,0,0,0|1,0,0]=3 657 B12R2.196 CC1=NOC2=C(Br)C=CC=C12 B48076 [1,1,0,0,0,0|2,0,0]=4 658 B12R2.196 ClC1=NNC2=C(Br)C=CC=C12 B12793 [1,1,0,0,0,0|1,0,0]=3 659 B12R2.196 ClC1=NOC2=C(Br)C=CC=C12 B63414 [1,1,0,0,0,0|2,0,0]=4 660 B12R2.196 FC1=CC=CC2=C1NN=C2Br B18131 [1,1,0,0,0,0|1,0,0]=3 661 B12R2.196 NC1=CC=CC2=C1NN=C2Br B14094 [1,1,0,0,0,0|1,0,0]=3 662 B12R2.196 NC1=CC=CC2=C1NN=C2Cl A12804 [1,1,0,0,0,0|1,0,0]=3 663 B12R2.196 NC1=CC=CC2=C1NN=C2Cl N12805 [1,1,0,0,0,0|1,0,0]=3 664 B12R2.196 NC1=CC=CC2=C1NN=C2I A1854 [1,1,0,0,0,0|1,0,0]=3 665 B12R2.196 NC1=NNC2=C(Br)C=CC=C12 B17856 [1,1,0,0,0,0|1,0,0]=3 666 B12R2.196 NC1=NOC2=C(Br)C=CC=C12 B44829 [1,1,0,0,0,0|2,0,0]=4 667 B12R2.196 O=C1NC=CC2=C1NN=C2Br B42173 [1,1,0,0,0,0|2,0,0]=4 668 B12R2.203 BrC1=C2C(=CC=C1)NN=C2I B12522 [1,1,0,0,0,0|1,0,0]=3 669 B12R2.203 CC1=CNC2=C1C(N)=CC=C2 M25969 [1,1,0,0,0,0|2,0,0]=4 670 B12R2.203 CC1=CNC2=CC=CC(Br)=C12 B23812 [1,1,0,0,0,0|2,0,0]=4 671 B12R2.203 CC1=NNC2=CC=CC(Br)=C21 B1857 [1,1,0,0,0,0|1,0,0]=3 672 B12R2.203 CC1=NNC2=CN=CC(Br)=C21 B27079 [1,1,0,0,0,0|2,0,0]=4 673 B12R2.203 ClC1=C2C(=CC=C1)NN=C2I C39094 [1,1,0,0,0,0|1,0,0]=3 674 B12R2.203 ClC1=C2C(=CC=N1)NN=C2I C12578 [1,1,0,0,0,0|2,0,0]=4 675 B12R2.203 ClC1=C2C(Br)=CNC2=CC=C1 B37689 [1,1,0,0,0,0|2,0,0]=4 676 B12R2.203 ClC1=C2C(I)=NNC2=NC=C1 C12565 [1,1,0,0,0,0|2,0,0]=4 677 B12R2.203 ClC1=NNC2=CC=CC(Br)=C21 B12792 [1,1,0,0,0,0|1,0,0]=3 678 B12R2.203 FC1=C2C(=CC=C1)NN=C2I F24044 [1,1,0,0,0,0|1,0,0]=3 679 B12R2.203 NC1=C2C(=CC=C1)NN=C2Br B26148 [1,1,0,0,0,0|1,0,0]=3 680 B12R2.203 NC1=C2C(=CC=C1)NN=C2Cl A12801 [1,1,0,0,0,0|1,0,0]=3 681 B12R2.203 NC1=C2C(=CC=C1)NN=C2I A1735 [1,1,0,0,0,0|1,0,0]=3 682 B12R2.203 NC1=NNC2=CC=CC(Br)=C21 A10487 [1,1,0,0,0,0|1,0,0]=3 683 B12R2.203 NC1=NNC2=CC=CC(Cl)=C21 C45288 [1,1,0,0,0,0|1,0,0]=3 684 B12R2.203 NC1=NNC2=CC=CC(F)=C21 F9797 [1,1,0,0,0,0|1,0,0]=3 685 B12R2.203 NC1=NNC2=CC=CC(I)=C21 I0073 [1,1,0,0,0,0|1,0,0]=3 686 B12R2.203 NC1=NOC2=CC=CC(Br)=C21 B44828 [1,1,0,0,0,0|2,0,0]=4 687 B12R2.203 OC1=NNC2=CC=CC(Br)=C21 B15307 [1,1,0,0,0,0|0,0,0]=2 688 B12R2.2028 CC1=CN(C)C2=C1C=CC=C2 D52502 [1,1,0,0,0,0|2,0,0]=4 689 B12R2.2028 CN1N=C(Br)C2=C1C=CC=C2 B12796 [1,1,0,0,0,0|1,0,0]=3 690 B12R2.2028 CN1N=C(Br)C2=C1N=CC=C2 B37356 [1,1,0,0,0,0|2,0,0]=4 691 B12R2.2028 CN1N=C(I)C2=C1C=CC=C2 I14462 [1,1,0,0,0,0|1,0,0]=3 692 B12R2.2028 CN1N=C(I)C2=C1N=CC=C2 I13889 [1,1,0,0,0,0|2,0,0]=4 693 B12R2.2028 CN1N=C(I)C2=NC=CC=C21 I18942 [1,1,0,0,0,0|2,0,0]=4 694 B12R2.2028 CN1N=C(N)C2=CC=CN=C21 A12806 [1,1,0,0,0,0|2,0,0]=4 695 B12R2.2028 CN1NC(=O)C2=C1C=CC=C2 M48798 [1,1,0,0,0,0|0,0,2]=4 696 B12R2.44 BrCC1=CC2=C(C=C1)C=NN2 B48325 [1,1,0,0,0,0|0,1,0]=3 697 B12R2.44 C#CC1=CC2=C(C=C1)C=NN2 E14470 [1,1,0,0,0,0|1,0,0]=3 698 B12R2.44 COC1=CC2=C(C=C1)C=NN2 M0480 [1,1,0,0,0,0|1,0,0]=3 699 B12R2.44 COC1=CC2=C(C=CN2)C=C1 M2150 [1,1,0,0,0,0|2,0,0]=4 700 B12R2.44 COC1=NC2=C(C=C1)C=NN2 M13723 [1,1,0,0,0,0|2,0,0]=4 701 B12R2.44 N#CC1=CC2=C(C=C1)C=NN2 I0381 [1,1,0,0,0,0|1,0,0]=3 702 B12R2.44 N#CC1=CC2=C(C=CN2)C=C1 I20501 [1,1,0,0,0,0|2,0,0]=4 703 B12R2.44 N#CC1=CN=C2C=NNC2=C1 P18884 [1,1,0,0,0,0|2,0,0]=4 704 B12R2.44 NCC1=CC2=C(C=C1)C=NN2 I9288 [1,1,0,0,0,0|1,0,0]=3 705 B12R2.44 O=CC1=CC2=C(C=C1)C=NN2 I9282 [1,1,0,0,0,0|1,0,0]=3 706 B12R2.44 O=CC1=CC2=C(C=CN2)C=C1 F2138 [1,1,0,0,0,0|2,0,0]=4 707 B12R2.44 OCC1=CC2=C(C=C1)C=NN2 I9283 [1,1,0,0,0,0|1,0,0]=3 708 B12R2.82 CC1=C(Br)C2=C(C=C1)C=NN2 B18119 [1,1,0,0,0,0|1,0,0]=3 709 B12R2.82 CC1=C(F)C=CC2=C1C=NN2 F48342 [1,1,0,0,0,0|2,0,0]=4 710 B12R2.82 ClC1=C(Br)C2=C(C=C1)C=NN2 B19647 [1,1,0,0,0,0|0,1,0]=3 711 B12R2.82 ClC1=C(Cl)C2=C(C=CN2)C=C1 D15035 [1,1,0,0,0,0|1,1,0]=4 712 B12R2.82 FC1=C(Br)C=CC2=C1NC=C2 B26665 [1,1,0,0,0,0|1,1,0]=4 713 B12R2.82 FC1=C(F)C2=C(C=C1)C=NN2 D32290 [1,1,0,0,0,0|0,0,0]=2 714 B12R2.82 NC1=C(Cl)C2=C(C=C1)C=NN2 C45293 [1,1,0,0,0,0|1,0,0]=3 715 B12R2.82 OC1=C(Cl)C=CC2=C1NN=C2 C21516 [1,1,0,0,0,0|0,1,0]=3 716 B12R2.100 BrC1=C(Br)C=C2NC=CC2=C1 D63582 [1,1,0,0,0,0|1,1,0]=4 717 B12R2.100 CC1=C(Br)C=C2C=CNC2=C1 B15871 [1,1,0,0,0,0|2,0,0]=4 718 B12R2.100 CC1=C(Br)C=C2C=NNC2=C1 B5186 [1,1,0,0,0,0|1,0,0]=3 719 B12R2.100 CC1=C(Br)C=C2NC=CC2=C1 B22627 [1,1,0,0,0,0|1,1,0]=4 720 B12R2.100 CC1=C(Br)C=C2NN=CC2=C1 B5193 [1,1,0,0,0,0|0,1,0]=3 721 B12R2.100 CC1=C(Cl)C=C2C=CNC2=C1 C51456 [1,1,0,0,0,0|2,0,0]=4 722 B12R2.100 CC1=C(Cl)C=C2NC=CC2=C1 C20627 [1,1,0,0,0,0|1,1,0]=4 723 B12R2.100 CC1=C(Cl)C=C2NN=CC2=C1 C48334 [1,1,0,0,0,0|0,1,0]=3 724 B12R2.100 CC1=C(F)C=C2NC=CC2=C1 F20630 [1,1,0,0,0,0|1,0,0]=3 725 B12R2.100 CC1=C(I)C=C2NN=CC2=C1 I37252 [1,1,0,0,0,0|0,1,0]=3 726 B12R2.100 CC1=C(O)C=C2NN=CC2=C1 M16451 [1,1,0,0,0,0|1,0,0]=3 727 B12R2.100 CC1=CC2=C(C=NN2)C=C1N A25493 [1,1,0,0,0,0|1,0,0]=3 728 B12R2.100 ClC1=C(Br)C=C2C=CNC2=C1 B17693 [1,1,0,0,0,0|1,1,0]=4 729 B12R2.100 ClC1=C(Br)C=C2C=NNC2=C1 B18174 [1,1,0,0,0,0|0,1,0]=3 730 B12R2.100 ClC1=C(Br)C=C2C=NNC2=N1 B29733 [1,1,0,0,0,0|1,1,0]=4 731 B12R2.100 ClC1=C(Br)C=C2NC=CC2=C1 B11186 [1,1,0,0,0,0|1,1,0]=4 732 B12R2.100 ClC1=C(Br)C=C2NN=CC2=C1 B13439 [1,1,0,0,0,0|0,1,0]=3 733 B12R2.100 ClC1=C(Cl)C=C2NC=CC2=C1 D12046 [1,1,0,0,0,0|1,1,0]=4 734 B12R2.100 ClC1=C(Cl)C=C2NN=CC2=C1 D12523 [1,1,0,0,0,0|0,1,0]=3 735 B12R2.100 FC1=C(Br)C=C2C=CNC2=C1 B11776 [1,1,0,0,0,0|1,0,0]=3 736 B12R2.100 FC1=C(Br)C=C2C=CNC2=N1 B17486 [1,1,0,0,0,0|2,0,0]=4 737 B12R2.100 FC1=C(Br)C=C2C=NNC2=C1 B9769 [1,1,0,0,0,0|0,0,0]=2 738 B12R2.100 FC1=C(Br)C=C2CCNC2=C1 B48426 [1,1,0,0,0,0|1,0,1]=4 739 B12R2.100 FC1=C(Br)C=C2N=CNC2=C1 B44310 [1,1,0,0,0,0|2,0,0]=4 740 B12R2.100 FC1=C(Br)C=C2NC=CC2=C1 B1597 [1,1,0,0,0,0|1,1,0]=4 741 B12R2.100 FC1=C(Br)C=C2NN=CC2=C1 B8120 [1,1,0,0,0,0|0,1,0]=3 742 B12R2.100 FC1=C(Br)C=C2NN=NC2=C1 B41870 [1,1,0,0,0,0|1,0,1]=4 743 B12R2.100 FC1=C(Cl)C=C2NC=CC2=C1 C7633 [1,1,0,0,0,0|1,1,0]=4 744 B12R2.100 FC1=C(Cl)C=C2NN=CC2=C1 C0479 [1,1,0,0,0,0|0,1,0]=3 745 B12R2.100 FC1=C(F)C=C2NC=CC2=C1 D21740 [1,1,0,0,0,0|1,0,0]=3 746 B12R2.100 FC1=C(F)C=C2NC=NC2=C1 D61648 [1,1,0,0,0,0|2,0,0]=4 747 B12R2.100 FC1=C(F)C=C2NCCC2=C1 D48433 [1,1,0,0,0,0|1,0,1]=4 748 B12R2.100 FC1=C(F)C=C2NN=CC2=C1 D44341 [1,1,0,0,0,0|0,0,0]=2 749 B12R2.100 FC1=C(I)C=C2C=NNC2=C1 F44347 [1,1,0,0,0,0|0,0,0]=2 750 B12R2.100 NC1=C(Br)C=C2C=CNC2=C1 B48308 [1,1,0,0,0,0|2,0,0]=4 751 B12R2.100 NC1=C(Br)C=C2NN=CC2=C1 B19006 [1,1,0,0,0,0|0,1,0]=3 752 B12R2.100 NC1=C(Cl)C=C2C=CNC2=C1 C25967 [1,1,0,0,0,0|2,0,0]=4 753 B12R2.100 NC1=C(Cl)C=C2C=NNC2=C1 C45291 [1,1,0,0,0,0|1,0,0]=3 754 B12R2.100 NC1=C(F)C=C2NC=CC2=C1 F19097 [1,1,0,0,0,0|1,0,0]=3 755 B12R2.100 NC1=C(F)C=C2NN=CC2=C1 F9886 [1,1,0,0,0,0|0,0,0]=2 756 B12R2.100 OC1=C(Br)C=C2NC=CC2=C1 B15386 [1,1,0,0,0,0|1,1,0]=4 757 B12R2.100 OC1=C(Br)C=C2NN=CC2=C1 B11888 [1,1,0,0,0,0|0,1,0]=3 758 B12R2.100 OC1=C(Cl)C=C2NC=CC2=C1 C15382 [1,1,0,0,0,0|1,1,0]=4 759 B12R2.100 OC1=C(Cl)C=C2NN=CC2=C1 C11890 [1,1,0,0,0,0|0,1,0]=3 760 B12R2.100 OC1=C(F)C=C2NN=CC2=C1 F18993 [1,1,0,0,0,0|0,0,0]=2 761 B12R2.100 OC1=C(O)C=C2NC=CC2=C1 D69163 [1,1,0,0,0,0|2,0,0]=4 762 B12R2.246 BrC1=C2C=NNC2=CC(I)=C1 B44318 [1,1,0,0,0,0|0,1,0]=3 763 B12R2.246 BrC1=CC(Br)=C2C=CNC2=C1 D27015 [1,1,0,0,0,0|1,1,0]=4 764 B12R2.246 BrC1=CC(I)=C2C=NNC2=C1 B13413 [1,1,0,0,0,0|0,1,0]=3 765 B12R2.246 CC1=C2C=NNC2=CC(Br)=C1 B48310 [1,1,0,0,0,0|0,1,0]=3 766 B12R2.246 CC1=CC(Br)=C2C=CNC2=C1 B26131 [1,1,0,0,0,0|2,0,0]=4 767 B12R2.246 CC1=CC(Br)=C2C=NNC2=N1 B13434 [1,1,0,0,0,0|2,0,0]=4 768 B12R2.246 CC1=CC(Cl)=C2C=CNC2=C1 C51454 [1,1,0,0,0,0|2,0,0]=4 769 B12R2.246 CC1=CC(Cl)=C2C=NNC2=C1 C48332 [1,1,0,0,0,0|1,0,0]=3 770 B12R2.246 CC1=CC(F)=C2C=NNC2=C1 F48341 [1,1,0,0,0,0|1,0,0]=3 771 B12R2.246 CC1=CC(O)=C2C=CNC2=C1 M51754 [1,1,0,0,0,0|2,0,0]=4 772 B12R2.246 CC1=CC2=C(C=NN2)C(Cl)=N1 C16859 [1,1,0,0,0,0|2,0,0]=4 773 B12R2.246 ClC1=C2C=CNC2=CC(Br)=C1 B26116 [1,1,0,0,0,0|1,1,0]=4 774 B12R2.246 ClC1=C2C=NNC2=CC(Br)=C1 B14787 [1,1,0,0,0,0|0,1,0]=3 775 B12R2.246 ClC1=C2C=NNC2=CC(I)=C1 C44334 [1,1,0,0,0,0|0,1,0]=3 776 B12R2.246 ClC1=CC(Br)=C2C=CNC2=C1 B26118 [1,1,0,0,0,0|1,1,0]=4 777 B12R2.246 ClC1=CC(Br)=C2C=NNC2=C1 B13304 [1,1,0,0,0,0|0,1,0]=3 778 B12R2.246 ClC1=CC(Cl)=C2C=CNC2=C1 D15033 [1,1,0,0,0,0|1,1,0]=4 779 B12R2.246 ClC1=CC(I)=C2C=NNC2=C1 C10770 [1,1,0,0,0,0|0,1,0]=3 780 B12R2.246 ClC1=CC2=C(C=NN2)C(Cl)=N1 D61827 [1,1,0,0,0,0|1,1,0]=4 781 B12R2.246 FC1=C2C=CNC2=CC(Br)=C1 B26137 [1,1,0,0,0,0|1,1,0]=4 782 B12R2.246 FC1=C2C=CNC2=CC(Cl)=C1 C26145 [1,1,0,0,0,0|1,1,0]=4 783 B12R2.246 FC1=C2C=NNC2=CC(Br)=C1 B5187 [1,1,0,0,0,0|0,1,0]=3 784 B12R2.246 FC1=C2C=NNC2=CC(I)=C1 F44346 [1,1,0,0,0,0|0,1,0]=3 785 B12R2.246 FC1=CC(Br)=C2C=CNC2=C1 B26142 [1,1,0,0,0,0|1,0,0]=3 786 B12R2.246 FC1=CC(Br)=C2C=NNC2=C1 B15614 [1,1,0,0,0,0|0,0,0]=2 787 B12R2.246 FC1=CC(Cl)=C2C=CNC2=C1 C26144 [1,1,0,0,0,0|1,0,0]=3 788 B12R2.246 FC1=CC(F)=C2C=NNC2=C1 D29981 [1,1,0,0,0,0|0,0,0]=2 789 B12R2.246 FC1=CC(F)=C2CCNC2=C1 D49603 [1,1,0,0,0,0|1,0,1]=4 790 B12R2.246 NC1=C2C=CNC2=CC(Br)=C1 B23219 [1,1,0,0,0,0|1,1,0]=4 791 B12R2.246 NC1=C2C=CNC2=CC(Cl)=C1 C48330 [1,1,0,0,0,0|1,1,0]=4 792 B12R2.246 NC1=C2C=CNC2=CC(F)=C1 F26106 [1,1,0,0,0,0|1,0,0]=3 793 B12R2.246 NC1=C2C=CNC2=CC(I)=C1 K48345 [1,1,0,0,0,0|1,1,0]=4 794 B12R2.246 NC1=C2C=NNC2=CC(Br)=C1 A15125 [1,1,0,0,0,0|0,1,0]=3 795 B12R2.246 NC1=C2C=NNC2=CC(Cl)=C1 C45292 [1,1,0,0,0,0|0,1,0]=3 796 B12R2.246 NC1=C2C=NNC2=CC(I)=C1 A15137 [1,1,0,0,0,0|0,1,0]=3 797 B12R2.246 NC1=CC(Br)=C2C=NNC2=C1 A15126 [1,1,0,0,0,0|1,0,0]=3 798 B12R2.246 NC1=CC(Cl)=C2C=NNC2=C1 C45290 [1,1,0,0,0,0|1,0,0]=3 799 B12R2.246 NC1=CC(F)=C2C=CNC2=C1 F26107 [1,1,0,0,0,0|2,0,0]=4 800 B12R2.246 NC1=CC(F)=C2C=NNC2=C1 A11652 [1,1,0,0,0,0|1,0,0]=3 801 B12R2.246 NC1=CC(I)=C2C=NNC2=C1 A15138 [1,1,0,0,0,0|1,0,0]=3 802 B12R2.246 OC1=C2C=NNC2=CC(Br)=C1 B15132 [1,1,0,0,0,0|0,1,0]=3 803 B12R2.246 OC1=CC(Br)=C2C=NNC2=C1 B15133 [1,1,0,0,0,0|1,0,0]=3 804 B12R2.246 OC1=CC(F)=C2C=NNC2=C1 F44841 [1,1,0,0,0,0|1,0,0]=3 805 B12R2.606 CC1=CC2=C(C=C(Br)C=C2)N1 B24529 [1,1,0,0,0,0|1,1,0]=4 806 B12R2.606 CC1=CC2=C(C=C(Cl)C=C2)N1 C24527 [1,1,0,0,0,0|1,1,0]=4 807 B12R2.606 CC1=CC2=C(C=C(F)C=C2)N1 F23531 [1,1,0,0,0,0|1,0,0]=3 808 B12R2.606 CC1=CC2=C(C=C(I)C=C2)N1 I18181 [1,1,0,0,0,0|1,1,0]=4 809 B12R2.606 CC1=CC2=C(C=C(N)C=C2)N1 M13891 [1,1,0,0,0,0|2,0,0]=4 810 B12R2.606 CC1=CC2=C(C=C(O)C=C2)N1 M24189 [1,1,0,0,0,0|2,0,0]=4 811 B12R2.606 CC1=CC2=C(C=C1)C=C(C)N2 D52503 [1,1,0,0,0,0|2,0,0]=4 812 B12R2.606 FC1=CC2=C(C=C1)N=C(Cl)N2 C37507 [1,1,0,0,0,0|2,0,0]=4 813 B12R2.606 FC1=CC2=C(C=C1)NC(=S)N2 F44802 [1,1,0,0,0,0|2,0,0]=4 814 B12R2.606 O=C1CC2=C(C=C(F)C=C2)N1 F24289 [1,1,0,0,0,0|1,0,1]=4 815 B12R2.606 O=C1NC2=C(C=C(F)C=C2)N1 F44847 [1,1,0,0,0,0|2,0,0]=4 816 B12R2.606 O=C1NC2=C(C=CC(F)=C2)O1 F44453 [1,1,0,0,0,0|2,0,0]=4 817 B14R2.8235 CC1=NC2=CC=C(F)C=C2C(Cl)=N1 C50806 [0,1,0,0,0,1|2,0,0]=4 818 B14R2.8235 FC1=CC2=CN=C(Cl)N=C2C(Br)=C1 B14710 [0,1,0,0,0,1|2,0,0]=4 819 B14R2.8235 FC1=CC=C2C=C(Cl)N=C(Cl)C2=C1 D26704 [0,1,0,0,0,1|2,0,0]=4 820 B14R2.8235 FC1=CC=C2N=C(Cl)N=C(Cl)C2=C1 D18808 [0,1,0,0,0,1|2,0,0]=4 821 B14R2.8235 OC1=NC(O)=C2C=C(F)C=CC2=N1 F47589 [0,1,0,0,0,1|1,0,0]=3 822 B14R2.1073 COC1=C2C=CC(Br)=CC2=NC=N1 B63338 [0,1,0,0,0,1|0,1,1]=4 823 B14R2.1801 COC1=CC2=C(C=C1)C(=O)N=CN2 M51376 [0,1,0,0,0,1|1,0,1]=4 824 B14R2.8751 OC1=C2C=CC(Br)=CC2=C(O)N=N1 B47568 [0,1,0,0,0,1|0,1,1]=4 825 B14R2.28472 FC1=C(F)C=C2C(=C1)N=CN=C2Cl C47249 [0,1,0,0,0,1|1,0,1]=4 826 B14R2.28472 O=C1N=CNC2=CC(Cl)=C(Br)C=C12 B7870 [0,1,0,0,0,1|0,1,1]=4 827 B14R2.28480 FC1=CC(F)=C2C(=C1)N=CN=C2Cl C47248 [0,1,0,0,0,1|1,0,1]=4 828 B14R2.29365 CC1=NC2=CC(F)=CC=C2C(Cl)=N1 C50807 [0,1,0,0,0,1|1,0,1]=4 829 B14R2.29365 FC1=CC=C2C(=C1)C=C(Cl)N=C2Cl D1225 [0,1,0,0,0,1|2,0,0]=4 830 B14R2.29365 FC1=CC=C2C(=C1)N=C(Cl)N=C2Cl D21840 [0,1,0,0,0,1|1,0,1]=4 831 B14R2.29365 O=C1C=C(O)C2=C(C=C(F)C=C2)O1 F63742 [0,1,0,0,0,1|2,0,0]=4 832 B14R2.29365 O=C1NC(=O)C2=C(C=C(F)C=C2)N1 F47591 [0,1,0,0,0,1|0,0,2]=4 833 B14R2.29365 O=C1NC2=C(C=CC(F)=C2)C(=O)O1 F47419 [0,1,0,0,0,1|1,0,1]=4 834 B14R2.300 CC1=CC2=C(C=C1)C(C(=O)O)=CN2 M22301 [0,2,0,0,0,0|2,0,0]=4 835 B14R2.300 CC1=CC2=C(C=C1)C(C(N)=O)=NN2 M20178 [0,2,0,0,0,0|1,0,1]=4 836 B14R2.300 O=C(O)C1=CNC2=C1C=CC(Br)=C2 B14540 [0,2,0,0,0,0|1,1,0]=4 837 B14R2.300 O=C(O)C1=CNC2=C1C=CC(Cl)=C2 C50878 [0,2,0,0,0,0|1,1,0]=4 838 B14R2.300 O=C(O)C1=CNC2=C1C=CC(F)=C2 F50888 [0,2,0,0,0,0|1,0,0]=3 839 B14R2.300 O=C(O)C1=COC2=C1C=CC(F)=C2 F62979 [0,2,0,0,0,0|2,0,0]=4 840 B14R2.300 O=C(O)C1=NNC2=C1C=CC(Br)=C2 B5670 [0,2,0,0,0,0|0,1,0]=3 841 B14R2.300 O=C(O)C1=NNC2=C1C=CC(Cl)=C2 C9727 [0,2,0,0,0,0|0,1,0]=3 842 B14R2.300 O=C(O)C1=NNC2=CC(Br)=CN=C21 B13909 [0,2,0,0,0,0|1,1,0]=4 843 B14R2.300 O=C(O)C1=NOC2=C1C=CC(Cl)=C2 C36731 [0,2,0,0,0,0|1,1,0]=4 844 B14R2.300 O=C(O)C1=NSC2=C1C=CC(Br)=C2 B24856 [0,2,0,0,0,0|1,1,0]=4 845 B14R2.467 OCCC1=CNC2=C1C=CC(Br)=C2 B52393 [0,2,0,0,0,0|1,1,0]=4 846 B14R2.12145 N#CC1=NNC2=CC(Cl)=C(Cl)C=C21 D47263 [0,2,0,0,0,0|1,1,0]=4 847 B14R2.12145 N#CC1=NNC2=CC(F)=C(F)C=C21 D47264 [0,2,0,0,0,0|1,0,0]=3 848 B14R2.12145 O=CC1=CNC2=CC(F)=C(Br)C=C12 B17734 [0,2,0,0,0,0|1,0,1]=4 849 B14R2.1812 COC1=CC2=C(C=C1)C(I)=NN2C K51700 [0,2,0,0,0,0|2,0,0]=4 850 B14R2.5719 CC1=NNC2=C1C=CC(B(O)O)=C2 M5685 [0,2,0,0,0,0|2,0,0]=4 851 B14R2.5719 CC1=NNC2=C1C=CC([N+](=O)[O-])=C2 M0240 [0,2,0,0,0,0|2,0,0]=4 852 B14R2.5719 NC1=NNC2=C1C=CC(C(=O)O)=C2 A38865 [0,2,0,0,0,0|2,0,0]=4 853 B14R2.5719 NC1=NNC2=C1C=CC([N+](=O)[O-])=C2 N45312 [0,2,0,0,0,0|2,0,0]=4 854 B14R2.5719 O=C(O)C1=CC2=C(C=C1)C(Br)=NN2 B14106 [0,2,0,0,0,0|2,0,0]=4 855 B14R2.5719 O=C(O)C1=CC2=C(C=C1)C(I)=NN2 I14107 [0,2,0,0,0,0|2,0,0]=4 856 B14R2.5719 O=[N+]([O-])C1=CC2=C(C=C1)C(Br)=NN2 B1549 [0,2,0,0,0,0|2,0,0]=4 857 B14R2.5719 O=[N+]([O-])C1=CC2=C(C=C1)C(Cl)=NN2 C12798 [0,2,0,0,0,0|2,0,0]=4 858 B14R2.5719 O=[N+]([O-])C1=CC2=C(C=C1)C(I)=NN2 I6038 [0,2,0,0,0,0|2,0,0]=4 859 B14R2.25731 CN1N=C(Cl)C2=CC(Cl)=C(Br)C=C21 B30081 [0,2,0,0,0,0|1,1,0]=4 860 B14R2.645 O=C1NC2=CC(F)=C(F)C=C2C1=O D47294 [0,2,0,0,0,0|1,0,1]=4 861 B14R2.27750 O=C1NC2=CC(F)=CC(F)=C2C1=O D47296 [0,2,0,0,0,0|1,0,1]=4 862 B12R2.24 FC1=CC2=C(C=C1)OCCN2 F49619 [0,0,1,1,0,0|1,0,1]=4 863 B12R2.24 FC1=CC2=CN=CC=C2C=C1 F9904 [0,0,1,1,0,0|2,0,0]=4 864 B12R2.1081 FC1=C2OCCNC2=CC=C1 F49054 [0,0,1,1,0,0|1,0,1]=4 865 B12R2.1081 FC1=CC=CC2=CN=CN=C12 F47556 [0,0,1,1,0,0|2,0,0]=4 866 B10R2.320 O=C1CC2=C1C=CC=C2 B36727 [1,0,0,0,1,0|1,0,1]=4 867 B12R1.49 NNC(=O)CC1=CC=C(F)C=C1 F49198 [0,0,1,0,0,1|0,0,2]=4 868 B12R1.233 CC1=C(CC(=O)O)C=CC(F)=C1 F51952 [0,0,1,0,0,1|2,0,0]=4 869 B12R1.233 N=C(N)NC1=C(Cl)C=C(F)C=C1 C66340 [0,0,1,0,0,1|2,0,0]=4 870 B12R1.233 O=C(O)CC1=C(Br)C=C(F)C=C1 B48142 [0,0,1,0,0,1|2,0,0]=4 871 B12R1.233 O=C(O)CC1=C(Cl)C=C(F)C=C1 C48172 [0,0,1,0,0,1|2,0,0]=4 872 B12R1.233 O=C(O)CC1=C(F)C=C(F)C=C1 D69394 [0,0,1,0,0,1|2,0,0]=4