0 B12R2.1081 BrC1=C2C=CC=NC2=CC=C1 CS21397 [0,0,0,0,0,0|3,0,0]=3 1 B12R2.1081 BrC1=C2C=CN=CC2=CC=C1 CS21395 [0,0,0,0,0,0|3,0,0]=3 2 B12R2.1081 BrC1=C2C=NC=CC2=CC=C1 CS21399 [0,0,0,0,0,0|3,0,0]=3 3 B12R2.1081 BrC1=C2C=NC=NC2=CC=C1 CS12892 [0,0,0,0,0,0|4,0,0]=4 4 B12R2.1081 BrC1=C2C=NN=CC2=CC=C1 CS16458 [0,0,0,0,0,0|4,0,0]=4 5 B12R2.1081 BrC1=C2N=CC=CC2=CC=C1 CS21400 [0,0,0,0,0,0|1,0,0]=1 6 B12R2.1081 BrC1=C2N=CC=CC2=CN=C1 MC442546 [0,0,0,0,0,0|2,0,0]=2 7 B12R2.1081 BrC1=CC=CC2=CC=CC=C12 CS19505 [0,0,0,0,0,0|2,0,0]=2 8 B12R2.1081 BrC1=CC=NC2=CC=CC=C12 CS22702 [0,0,0,0,0,0|3,0,0]=3 9 B12R2.1081 BrC1=CN=CC2=CC=CC=C12 CS10939 [0,0,0,0,0,0|3,0,0]=3 10 B12R2.1081 BrC1=NC=CC2=CC=NC=C21 MC442541 [0,0,0,0,0,0|4,0,0]=4 11 B12R2.1081 BrC1=NC=CC2=CN=CC=C21 CS16903 [0,0,0,0,0,0|4,0,0]=4 12 B12R2.1081 CC1=C2C=CC=NC2=CC=C1 MC33383 [0,0,0,0,0,0|3,0,0]=3 13 B12R2.1081 CC1=C2N=CC=CC2=CC=C1 CS11338 [0,0,0,0,0,0|1,0,0]=1 14 B12R2.1081 CC1=C2N=CC=NC2=CC=C1 CS19791 [0,0,0,0,0,0|2,0,0]=2 15 B12R2.1081 CC1=CC=NC2=CC=CC=C12 CS11332 [0,0,0,0,0,0|3,0,0]=3 16 B12R2.1081 CC1=CC=NC2=NC=CN=C12 MC107832 [0,0,0,0,0,0|3,0,0]=3 17 B12R2.1081 CC1=CN=CC2=CC=CC=C12 CS13187 [0,0,0,0,0,0|3,0,0]=3 18 B12R2.1081 C[N+]1=CC=NC2=CC=CC=C21 MC113795 [0,0,0,0,0,0|4,0,0]=4 19 B12R2.1081 ClC1=C2C=CC=NC2=CC=C1 CS21421 [0,0,0,0,0,0|3,0,0]=3 20 B12R2.1081 ClC1=C2C=CC=NC2=CC=N1 MC442539 [0,0,0,0,0,0|4,0,0]=4 21 B12R2.1081 ClC1=C2C=CN=CC2=CC=C1 CS21420 [0,0,0,0,0,0|3,0,0]=3 22 B12R2.1081 ClC1=C2C=NC=CC2=CC=C1 CS17692 [0,0,0,0,0,0|3,0,0]=3 23 B12R2.1081 ClC1=C2C=NC=NC2=CC=C1 CS17429 [0,0,0,0,0,0|4,0,0]=4 24 B12R2.1081 ClC1=C2N=CC=CC2=CC=C1 CS21426 [0,0,0,0,0,0|1,0,0]=1 25 B12R2.1081 ClC1=C2N=CC=CC2=CC=N1 MC442823 [0,0,0,0,0,0|2,0,0]=2 26 B12R2.1081 ClC1=CC=NC2=CC=CC=C12 CS19192 [0,0,0,0,0,0|3,0,0]=3 27 B12R2.1081 ClC1=CC=NC2=CN=CC=C12 MC102277 [0,0,0,0,0,0|4,0,0]=4 28 B12R2.1081 ClC1=CC=NC2=NC=CC=C12 CS22716 [0,0,0,0,0,0|4,0,0]=4 29 B12R2.1081 ClC1=CN=CC2=CC=CC=C12 CS12363 [0,0,0,0,0,0|3,0,0]=3 30 B12R2.1081 ClC1=CN=NC2=CC=CC=C12 MC427406 [0,0,0,0,0,0|4,0,0]=4 31 B12R2.1081 ClC1=NC=CC2=CC=CC=C21 CS10943 [0,0,0,0,0,0|3,0,0]=3 32 B12R2.1081 ClC1=NC=CC2=CC=NC=C21 CS14833 [0,0,0,0,0,0|4,0,0]=4 33 B12R2.1081 ClC1=NC=NC2=C1N=CC=C2 CS11912 [0,0,0,0,0,0|3,0,0]=3 34 B12R2.1081 ClC1=NC=NC2=CC=CC=C21 MC20865 [0,0,0,0,0,0|4,0,0]=4 35 B12R2.1081 ClC1=NC=NC2=NC=CN=C12 MC114621 [0,0,0,0,0,0|4,0,0]=4 36 B12R2.1081 FC1=CC=CC2=C1CC=CO2 MC41786 [0,0,0,0,0,0|3,0,0]=3 37 B12R2.1081 FC1=CC=CC2=CC=CC=C12 MC20582 [0,0,0,0,0,0|2,0,0]=2 38 B12R2.1081 FC1=CN=CC2=CN=CC=C12 MC442540 [0,0,0,0,0,0|4,0,0]=4 39 B12R2.1081 IC1=C2C=CN=CC2=CC=C1 MC33302 [0,0,0,0,0,0|3,0,0]=3 40 B12R2.1081 IC1=CN=CC2=CC=CC=C12 CS12479 [0,0,0,0,0,0|3,0,0]=3 41 B12R2.1081 Ic1cccc2ccccc12 MC434036 [0,0,0,0,0,0|2,0,0]=2 42 B12R2.1081 NC1=C2C=CN=CC2=CC=C1 CS11013 [0,0,0,0,0,0|3,0,0]=3 43 B12R2.1081 NC1=C2C=NC=CC2=CC=C1 CS18182 [0,0,0,0,0,0|3,0,0]=3 44 B12R2.1081 NC1=C2N=CC=CC2=CC=C1 CS22125 [0,0,0,0,0,0|1,0,0]=1 45 B12R2.1081 NC1=C2N=CC=CC2=CC=N1 MC442360 [0,0,0,0,0,0|2,0,0]=2 46 B12R2.1081 NC1=CC=CC2=C1C=CC=N2 CS11015 [0,0,0,0,0,0|3,0,0]=3 47 B12R2.1081 NC1=CC=CC2=C1C=NN=C2 CS11852 [0,0,0,0,0,0|4,0,0]=4 48 B12R2.1081 NC1=CC=CC2=CC=CC=C12 CS20774 [0,0,0,0,0,0|2,0,0]=2 49 B12R2.1081 NC1=CC=CC2=CC=CC=C12 MC41752 [0,0,0,0,0,0|2,0,0]=2 50 B12R2.1081 NC1=CC=NC2=CC=CC=C12 CS18376 [0,0,0,0,0,0|3,0,0]=3 51 B12R2.1081 NC1=CC=NC2=CC=CN=C12 MC106668 [0,0,0,0,0,0|2,0,0]=2 52 B12R2.1081 NC1=CN=CC2=CC=CC=C12 CS11011 [0,0,0,0,0,0|3,0,0]=3 53 B12R2.1081 NC1=CN=NC2=CC=CC=C12 MC427405 [0,0,0,0,0,0|4,0,0]=4 54 B12R2.1081 NC1=NC=CC2=C1C=CC=N2 MC111443 [0,0,0,0,0,0|4,0,0]=4 55 B12R2.1081 NC1=NC=CC2=CC=CC=C21 CS21592 [0,0,0,0,0,0|3,0,0]=3 56 B12R2.1081 NC1=NC=CC2=CC=NC=C21 MC442536 [0,0,0,0,0,0|4,0,0]=4 57 B12R2.1081 N[N+]1=CC=CC2=CC=CC=C21 MC107680 [0,0,0,0,0,0|3,0,0]=3 58 B12R2.1081 O=C1C=CNC2=CC=CC=C12 CS15452 [0,0,0,0,0,0|2,0,1]=3 59 B12R2.1081 O=C1C=CNC2=CN=CC=C12 MC105662 [0,0,0,0,0,0|3,0,1]=4 60 B12R2.1081 O=C1C=NNC2=CC=CC=C12 CS20704 [0,0,0,0,0,0|3,0,1]=4 61 B12R2.1081 O=C1CCCC2=C1N=CC=C2 CS15049 [0,0,0,0,0,0|0,0,4]=4 62 B12R2.1081 O=C1NC=CC2=C1C=CC=N2 MC442538 [0,0,0,0,0,0|3,0,1]=4 63 B12R2.1081 O=C1NC=CC2=C1N=CC=C2 CS15650 [0,0,0,0,0,0|1,0,1]=2 64 B12R2.1081 O=C1NC=CC2=CC=NC=C12 MC121076 [0,0,0,0,0,0|3,0,1]=4 65 B12R2.1081 O=C1NN=CC2=CC=CC=C12 CS19825 [0,0,0,0,0,0|3,0,1]=4 66 B12R2.1081 OC1=C2CNCCC2=CC=C1 MC105733 [0,0,0,0,0,0|2,0,2]=4 67 B12R2.1081 OC1=C2N=CC=CC2=CC=C1 MC30343 [0,0,0,0,0,0|0,0,0]=0 68 B12R2.1081 OC1=C2N=CN=CC2=CC=C1 MC115978 [0,0,0,0,0,0|1,0,0]=1 69 B12R2.1081 OC1=C2NCCCC2=CC=C1 CS19254 [0,0,0,0,0,0|0,0,4]=4 70 B12R2.1081 OC1=CC=CC2=C1C=CC=N2 CS10980 [0,0,0,0,0,0|2,0,0]=2 71 B12R2.1081 OC1=CC=CC2=C1C=CN=C2 CS10979 [0,0,0,0,0,0|2,0,0]=2 72 B12R2.1081 OC1=CC=CC2=C1C=NN=C2 MC116457 [0,0,0,0,0,0|3,0,0]=3 73 B12R2.1081 OC1=CC=CC2=C1CCNC2 MC425651 [0,0,0,0,0,0|2,0,2]=4 74 B12R2.1081 OC1=CC=CC2=C1OCCN2 MC441075 [0,0,0,0,0,0|2,0,2]=4 75 B12R2.1081 OC1=CC=CC2=C1OCCO2 CS12196 [0,0,0,0,0,0|2,0,2]=4 76 B12R2.1081 OC1=CC=CC2=CC=CC=C12 CS18546 [0,0,0,0,0,0|1,0,0]=1 77 B12R2.1081 OC1=CC=NC2=CC=CC=C12 CS21522 [0,0,0,0,0,0|2,0,0]=2 78 B12R2.1081 OC1=CN=NC2=CC=CC=C12 CS22888 [0,0,0,0,0,0|3,0,0]=3 79 B12R2.1081 OC1=NC=CC2=CC=CC=C21 CS10978 [0,0,0,0,0,0|2,0,0]=2 80 B12R2.1081 OC1=NC=NC2=CC=CC=C21 CS14542 [0,0,0,0,0,0|3,0,0]=3 81 B12R2.1081 OC1=NC=NC2=NC=CN=C12 CS22893 [0,0,0,0,0,0|3,0,0]=3 82 B12R2.1081 OC1CCCC2=C1N=CC=C2 CS18737 [0,0,0,0,0,0|0,0,4]=4 83 B12R2.1081 SC1=C2N=CC=CC2=CC=C1 MC427717 [0,0,0,0,0,0|0,1,0]=1 84 B12R2.1081 [O-]c1cccc2cccnc12 MC440649 [0,0,0,0,0,0|0,0,1]=1 85 B11R2.20 C1=CC2=CC=NC=C2C=N1 MC442537 [1,0,0,0,0,0|3,0,0]=4 86 B11R2.20 C1=CC2=CN=CC=C2C=N1 MC111272 [1,0,0,0,0,0|3,0,0]=4 87 B11R2.20 C1=CC2=CN=CC=C2N=C1 MC442547 [1,0,0,0,0,0|1,0,0]=2 88 B11R2.20 C1=CC=C2C=NC=CC2=C1 CS19770 [1,0,0,0,0,0|2,0,0]=3 89 B11R2.20 C1=CC=C2C=NN=CC2=C1 CS10532 [1,0,0,0,0,0|3,0,0]=4 90 B11R2.20 C1=CC=C2CC=CCC2=C1 CS11050 [1,0,0,0,0,0|1,0,1]=3 91 B11R2.20 C1=CC=C2N=CC=CC2=C1 CS11929 [1,0,0,0,0,0|0,0,0]=1 92 B11R2.20 C1=CC=C2N=CC=NC2=C1 CS11932 [1,0,0,0,0,0|1,0,0]=2 93 B11R2.20 C1=CC=C2N=CN=CC2=C1 CS11926 [1,0,0,0,0,0|1,0,0]=2 94 B11R2.20 C1=CC=C2N=NC=CC2=C1 CS11145 [1,0,0,0,0,0|1,0,0]=2 95 B11R2.20 C1=CN=C2C=CC=NC2=C1 CS20548 [1,0,0,0,0,0|1,0,0]=2 96 B13R2.32 BrC1=C(Br)C2=CC=CC=C2C=C1 MC418479 [0,1,0,0,0,0|2,0,0]=3 97 B13R2.32 BrC1=C(Br)C2=CC=CC=C2C=N1 CS14781 [0,1,0,0,0,0|3,0,0]=4 98 B13R2.32 CC1=C(Br)C=CC2=CC=CC=C21 MC100339 [0,1,0,0,0,0|2,0,0]=3 99 B13R2.32 CC1=C(O)C2=CC=CC=C2C=C1 CS11396 [0,1,0,0,0,0|1,0,0]=2 100 B13R2.32 CC1=C2N=CC=CC2=CC=C1Br CS16280 [0,1,0,0,0,0|1,0,0]=2 101 B13R2.32 CN1C=CC2=CC=CC=C2C1=O CS16983 [0,1,0,0,0,0|2,0,1]=4 102 B13R2.32 ClC1=C2C=CN=CC2=CC=C1Br MC443696 [0,1,0,0,0,0|3,0,0]=4 103 B13R2.32 FC1=CC=C2C=CC=NC2=C1F MC428247 [0,1,0,0,0,0|1,0,0]=2 104 B13R2.32 NC1=C(Br)C2=CC=CC=C2C=C1 MC443371 [0,1,0,0,0,0|2,0,0]=3 105 B13R2.32 NC1=C(Br)C2=CC=CC=C2C=N1 MC442467 [0,1,0,0,0,0|3,0,0]=4 106 B13R2.32 NC1=C(Br)C=NC2=CC=CC=C21 CS18266 [0,1,0,0,0,0|3,0,0]=4 107 B13R2.32 NC1=C(Cl)C=CC2=C1C=CC=N2 CS13243 [0,1,0,0,0,0|3,0,0]=4 108 B13R2.32 NC1=C(Cl)N=CC2=CC=CC=C21 CS12478 [0,1,0,0,0,0|3,0,0]=4 109 B13R2.32 NC1=C(I)C2=CC=CC=C2C=C1 MC432564 [0,1,0,0,0,0|2,0,0]=3 110 B13R2.32 NC1=C(O)C2=CC=CC=C2C=C1 MC111623 [0,1,0,0,0,0|1,0,0]=2 111 B13R2.32 NC1=C(O)C=CC2=CC=CC=C21 CS20594 [0,1,0,0,0,0|2,0,0]=3 112 B13R2.32 NC1=CC=C2C=NC=CC2=C1Br MC33376 [0,1,0,0,0,0|3,0,0]=4 113 B13R2.32 NC1=CC=C2C=NC=CC2=C1Cl MC33381 [0,1,0,0,0,0|3,0,0]=4 114 B13R2.32 NC1=CC=C2N=CC=CC2=C1N MC425891 [0,1,0,0,0,0|3,0,0]=4 115 B13R2.32 NC1=CC=C2N=CC=NC2=C1Br CS14570 [0,1,0,0,0,0|2,0,0]=3 116 B13R2.32 OC1=C(Br)C2=CC=CC=C2C=C1 CS11263 [0,1,0,0,0,0|2,0,0]=3 117 B13R2.32 OC1=C(Br)C=CC2=CC=CC=C21 MC443143 [0,1,0,0,0,0|1,0,0]=2 118 B13R2.32 OC1=C(I)C=NC2=CC=CC=C21 CS17705 [0,1,0,0,0,0|2,0,0]=3 119 B13R2.32 OC1=C2N=CC=CC2=CC=C1Br MC111852 [0,1,0,0,0,0|0,0,0]=1 120 B13R2.32 OC1=C2N=CC=CC2=CC=C1Cl CS16183 [0,1,0,0,0,0|0,0,0]=1 121 B13R2.32 OC1=CC=C2C=CN=CC2=C1Br MC443700 [0,1,0,0,0,0|3,0,0]=4 122 B13R2.32 OC1=CC=C2N=CC=CC2=C1Cl MC106814 [0,1,0,0,0,0|3,0,0]=4 123 B13R2.162 BrC1=CC=C2N=CC=C(I)C2=C1 CS19602 [0,1,0,0,0,0|3,0,0]=4 124 B13R2.162 BrC1=CC=CC2=CC=C(I)C=C12 MC445702 [0,1,0,0,0,0|2,0,0]=3 125 B13R2.162 BrC1=NC2=C(Br)C=CC=C2C=C1 MC115951 [0,1,0,0,0,0|1,0,0]=2 126 B13R2.162 Brc1ccc2nccc(Br)c2n1 MC102382 [0,1,0,0,0,0|2,0,0]=3 127 B13R2.162 CC1=CC=C2C=CN=C(Cl)C2=C1 MC443164 [0,1,0,0,0,0|3,0,0]=4 128 B13R2.162 CC1=CC=C2C=NC=C(Br)C2=C1 CS16559 [0,1,0,0,0,0|3,0,0]=4 129 B13R2.162 CC1=CC=C2N=CN=C(O)C2=C1 CS22882 [0,1,0,0,0,0|3,0,0]=4 130 B13R2.162 CC1=NC2=C(N)C=CC=C2C=C1 CS10006 [0,1,0,0,0,0|1,0,0]=2 131 B13R2.162 CC1=NC2=C(O)C=CC=C2C=C1 CS16057 [0,1,0,0,0,0|0,0,0]=1 132 B13R2.162 ClC1=CC2=C(Br)C=CC=C2C=N1 MC431275 [0,1,0,0,0,0|3,0,0]=4 133 B13R2.162 ClC1=CC=C2C=CN=C(Cl)C2=C1 CS13151 [0,1,0,0,0,0|3,0,0]=4 134 B13R2.162 ClC1=CC=NC2=CC=C(Br)C=C12 CS19242 [0,1,0,0,0,0|3,0,0]=4 135 B13R2.162 ClC1=NC2=C(Br)C=CC=C2C=C1 CS12582 [0,1,0,0,0,0|1,0,0]=2 136 B13R2.162 ClC1=NC2=C(Br)C=CC=C2C=N1 CS10843 [0,1,0,0,0,0|2,0,0]=3 137 B13R2.162 ClC1=NC2=C(Br)C=CC=C2N=C1 MC431161 [0,1,0,0,0,0|2,0,0]=3 138 B13R2.162 ClC1=NC2=C(Cl)C=CC=C2C=N1 CS13133 [0,1,0,0,0,0|2,0,0]=3 139 B13R2.162 ClC1=NC2=C(Cl)C=CC=C2N=C1 MC113236 [0,1,0,0,0,0|2,0,0]=3 140 B13R2.162 ClC1=NC2=C(Cl)C=CN=C2C=C1 MC102109 [0,1,0,0,0,0|2,0,0]=3 141 B13R2.162 FC1=CC=C2N=CC=C(Cl)C2=C1 CS21365 [0,1,0,0,0,0|3,0,0]=4 142 B13R2.162 NC1=CC=C2C=CN=C(Cl)C2=C1 MC116277 [0,1,0,0,0,0|3,0,0]=4 143 B13R2.162 NC1=CC=NC2=CC=C(Br)C=C12 CS18409 [0,1,0,0,0,0|3,0,0]=4 144 B13R2.162 NC1=NC2=C(Br)C=CC=C2C=C1 MC442437 [0,1,0,0,0,0|1,0,0]=2 145 B13R2.162 NC1=NC2=C(F)C=CC=C2C=N1 MC102929 [0,1,0,0,0,0|2,0,0]=3 146 B13R2.162 NC1=NC=CC2=CC=C(Br)C=C21 CS17665 [0,1,0,0,0,0|3,0,0]=4 147 B13R2.162 O=C1C=CC2=C(O1)C(Br)=CC=C2 CS12344 [0,1,0,0,0,0|2,0,0]=3 148 B13R2.162 O=C1C=CC2=CC=CC(Br)=C2N1 MC441083 [0,1,0,0,0,0|1,0,1]=3 149 B13R2.162 O=C1CCC2=CC=CC(O)=C2C1 MC20770 [0,1,0,0,0,0|1,0,2]=4 150 B13R2.162 O=C1NC=CC2=CC=C(Cl)C=C12 MC106952 [0,1,0,0,0,0|2,0,1]=4 151 B13R2.162 O=C1NC=NC2=C1N=C(Cl)C=C2 MC444428 [0,1,0,0,0,0|2,0,1]=4 152 B13R2.162 OC1=CC=C2C=CN=C(Cl)C2=C1 MC111226 [0,1,0,0,0,0|3,0,0]=4 153 B13R2.162 OC1=CC=CC2=C1C=C(Br)C=N2 CS15353 [0,1,0,0,0,0|2,0,0]=3 154 B13R2.162 OC1=CC=CC2=CC=C(Br)C=C12 MC432537 [0,1,0,0,0,0|1,0,0]=2 155 B13R2.162 OC1=CC=CC2=CC=C(F)C=C12 MC431686 [0,1,0,0,0,0|1,0,0]=2 156 B13R2.162 OC1=CC=NC2=CC=C(Br)C=C12 CS21403 [0,1,0,0,0,0|2,0,0]=3 157 B13R2.162 OC1=CC=NC2=CC=C(I)C=C12 CS18995 [0,1,0,0,0,0|2,0,0]=3 158 B13R2.162 OC1=CC=NC2=CC=C(I)C=C12 MC431692 [0,1,0,0,0,0|2,0,0]=3 159 B13R2.162 OC1=CN=NC2=CC=C(Br)C=C12 MC110833 [0,1,0,0,0,0|3,0,0]=4 160 B13R2.162 OC1=NC=CC2=CC=C(Br)C=C21 CS21409 [0,1,0,0,0,0|2,0,0]=3 161 B13R2.328 BrC1=CC(I)=CC2=CC=CC=C12 MC431929 [0,1,0,0,0,0|2,0,0]=3 162 B13R2.328 BrC1=CC2=CC=CC=C2C(Br)=N1 CS12194 [0,1,0,0,0,0|3,0,0]=4 163 B13R2.328 CC1=CC(Br)=CC2=CC=CC=C12 MC431970 [0,1,0,0,0,0|2,0,0]=3 164 B13R2.328 CC1=CC(Br)=NC2=CC=CC=C12 MC440080 [0,1,0,0,0,0|3,0,0]=4 165 B13R2.328 CC1=CC(Cl)=C2N=CC=CC2=C1 MC115947 [0,1,0,0,0,0|1,0,0]=2 166 B13R2.328 CC1=CC(O)=NC2=CC=CC=C12 CS10067 [0,1,0,0,0,0|3,0,0]=4 167 B13R2.328 CC1=CC2=CC=CC=C2C(=O)N1 MC33415 [0,1,0,0,0,0|2,0,1]=4 168 B13R2.328 CC1=CC2=CC=CC=C2C(Br)=C1 CS17170 [0,1,0,0,0,0|2,0,0]=3 169 B13R2.328 CC1=CC2=CC=CC=C2C(Cl)=N1 MC33405 [0,1,0,0,0,0|3,0,0]=4 170 B13R2.328 CC1=NC2=CC=CC=C2C(Br)=C1 CS22654 [0,1,0,0,0,0|3,0,0]=4 171 B13R2.328 ClC1=C2N=CC=CC2=CC(Br)=C1 CS16279 [0,1,0,0,0,0|1,0,0]=2 172 B13R2.328 ClC1=CC(Cl)=NC2=CC=CC=C12 CS10935 [0,1,0,0,0,0|3,0,0]=4 173 B13R2.328 ClC1=CC2=CC=CC=C2C(Cl)=N1 MC10229 [0,1,0,0,0,0|3,0,0]=4 174 B13R2.328 ClC1=NC2=C(N=CC=C2)C(Cl)=N1 CS21101 [0,1,0,0,0,0|3,0,0]=4 175 B13R2.328 NC1=CC(=O)NC2=CC=CC=C12 CS22591 [0,1,0,0,0,0|3,0,0]=4 176 B13R2.328 NC1=CC(Br)=CC2=C1C=CC=N2 CS17191 [0,1,0,0,0,0|3,0,0]=4 177 B13R2.328 NC1=CC(Br)=NC2=CC=CC=C12 MC442263 [0,1,0,0,0,0|3,0,0]=4 178 B13R2.328 NC1=CC(Cl)=C2N=CC=CC2=C1 CS16424 [0,1,0,0,0,0|1,0,0]=2 179 B13R2.328 NC1=CC(Cl)=NC2=CC=CC=C12 CS22546 [0,1,0,0,0,0|3,0,0]=4 180 B13R2.328 NC1=CC2=CC=CC=C2C(Br)=C1 CS17133 [0,1,0,0,0,0|2,0,0]=3 181 B13R2.328 NC1=NC2=CC=CC=C2C(Br)=C1 MC441080 [0,1,0,0,0,0|3,0,0]=4 182 B13R2.328 NC1=NC2=CC=CC=C2C(Cl)=C1 CS21246 [0,1,0,0,0,0|3,0,0]=4 183 B13R2.328 NC1=NC2=CC=CC=C2C(O)=C1 MC442487 [0,1,0,0,0,0|2,0,0]=3 184 B13R2.328 NC1=NC2=CC=CC=C2C(O)=N1 MC442491 [0,1,0,0,0,0|3,0,0]=4 185 B13R2.328 O=C1C=C(O)C2=NC=CC=C2N1 CS17474 [0,1,0,0,0,0|1,0,0]=2 186 B13R2.328 OC1=C2N=CC=CC2=CC(Br)=C1 MC443669 [0,1,0,0,0,0|0,0,0]=1 187 B13R2.328 OC1=C2N=CC=CC2=CC(F)=C1 MC121306 [0,1,0,0,0,0|0,0,0]=1 188 B13R2.328 OC1=CC(Cl)=NC2=CC=CC=C12 CS21445 [0,1,0,0,0,0|2,0,0]=3 189 B13R2.328 OC1=NC2=NC=CN=C2C(O)=N1 CS12994 [0,1,0,0,0,0|3,0,0]=4 190 B13R2.342 CC1=C2C=CNC(=O)C2=CC=C1 CS14564 [0,1,0,0,0,0|2,0,1]=4 191 B13R2.342 ClC1=C2C=CN=C(Br)C2=CC=C1 MC116276 [0,1,0,0,0,0|3,0,0]=4 192 B13R2.342 ClC1=NC=CC2=C(Br)C=CC=C12 MC441082 [0,1,0,0,0,0|3,0,0]=4 193 B13R2.342 ClC1=NC=NC2=C(Br)C=CC=C12 CS12097 [0,1,0,0,0,0|2,0,0]=3 194 B13R2.342 ClC1=NC=NC2=C(Cl)C=CC=C12 CS22517 [0,1,0,0,0,0|2,0,0]=3 195 B13R2.342 FC1=C2N=CN=C(Cl)C2=CC=C1 CS16817 [0,1,0,0,0,0|2,0,0]=3 196 B13R2.342 NC1=C2C=CNC(=O)C2=CC=C1 MC425883 [0,1,0,0,0,0|2,0,1]=4 197 B13R2.342 NC1=CC=CC2=C(Br)C=CC=C12 CS19078 [0,1,0,0,0,0|2,0,0]=3 198 B13R2.342 NC1=CC=CC2=C1C=CN=C2Cl MC425225 [0,1,0,0,0,0|3,0,0]=4 199 B13R2.342 NC1=NC=CC2=C(Br)C=CC=C12 MC441081 [0,1,0,0,0,0|3,0,0]=4 200 B13R2.342 NC1=NC=NC2=C(Br)C=CC=C12 MC121293 [0,1,0,0,0,0|2,0,0]=3 201 B13R2.342 O=C1C=CNC2=C(Cl)N=CC=C12 MC115669 [0,1,0,0,0,0|2,0,1]=4 202 B13R2.342 O=C1CCCC2=C(O)C=CC=C12 MC41791 [0,1,0,0,0,0|1,0,2]=4 203 B13R2.342 O=C1N=CNC2=C(Br)C=CC=C12 CS12345 [0,1,0,0,0,0|2,0,1]=4 204 B13R2.342 O=C1NCCC2=C(O)C=CC=C12 CS15002 [0,1,0,0,0,0|2,0,1]=4 205 B13R2.342 OC1=C2N=CC=C(Br)C2=CC=C1 CS18719 [0,1,0,0,0,0|0,0,0]=1 206 B13R2.342 OC1=CC=CC2=C(O)C=CC=C12 MC41776 [0,1,0,0,0,0|1,0,0]=2 207 B13R2.342 OC1=CC=CC2=C1C=CN=C2Cl MC111224 [0,1,0,0,0,0|2,0,0]=3 208 B13R2.342 OC1=NC=CC2=C(Br)C=CC=C12 CS14932 [0,1,0,0,0,0|2,0,0]=3 209 B13R2.342 OC1=NC=NC2=C(Cl)C=CC=C12 CS16818 [0,1,0,0,0,0|2,0,0]=3 210 B13R2.342 OC1=NC=NC2=C(F)C=CC=C12 MC430735 [0,1,0,0,0,0|2,0,0]=3 211 B13R2.371 BrC1=CC=C(Br)C2=CC=CC=C12 CS11241 [0,1,0,0,0,0|2,0,0]=3 212 B13R2.371 BrC1=CC=C(I)C2=CC=CC=C12 MC426177 [0,1,0,0,0,0|2,0,0]=3 213 B13R2.371 BrC1=CN=C(Br)C2=CC=CC=C12 CS19502 [0,1,0,0,0,0|3,0,0]=4 214 B13R2.371 CC1=C2N=CC=CC2=C(Br)C=C1 MC443275 [0,1,0,0,0,0|1,0,0]=2 215 B13R2.371 CC1=CN=C(Br)C2=CC=CC=C12 MC443347 [0,1,0,0,0,0|3,0,0]=4 216 B13R2.371 CC1=CN=C(Cl)C2=CC=CC=C12 MC442712 [0,1,0,0,0,0|3,0,0]=4 217 B13R2.371 ClC1=C2C=CC=NC2=C(Cl)N=N1 CS14662 [0,1,0,0,0,0|3,0,0]=4 218 B13R2.371 ClC1=CN=C(Cl)C2=CC=CC=C12 CS18756 [0,1,0,0,0,0|3,0,0]=4 219 B13R2.371 ClC1=NC=C(Br)C2=CC=CC=C21 CS21346 [0,1,0,0,0,0|3,0,0]=4 220 B13R2.371 ClC1=NC=C(Br)C2=NC=CN=C12 MC432220 [0,1,0,0,0,0|3,0,0]=4 221 B13R2.371 FC1=C2C=NC=CC2=C(Br)C=C1 CS16644 [0,1,0,0,0,0|3,0,0]=4 222 B13R2.371 FC1=CC=C(Br)C2=CC=CC=C12 MC41764 [0,1,0,0,0,0|2,0,0]=3 223 B13R2.371 NC1=C2N=CC=CC2=C(F)C=C1 CS13778 [0,1,0,0,0,0|1,0,0]=2 224 B13R2.371 NC1=CC=C(Br)C2=C1C=CN=C2 CS17145 [0,1,0,0,0,0|3,0,0]=4 225 B13R2.371 NC1=CC=C(Br)C2=CC=CC=C12 CS20596 [0,1,0,0,0,0|2,0,0]=3 226 B13R2.371 NC1=CC=C(F)C2=CC=CC=C12 MC431370 [0,1,0,0,0,0|2,0,0]=3 227 B13R2.371 NC1=CC=C(O)C2=CC=CC=C12 MC443752 [0,1,0,0,0,0|1,0,0]=2 228 B13R2.371 NC1=CC=C(O)C2=CC=CC=C12 MC445102 [0,1,0,0,0,0|1,0,0]=2 229 B13R2.371 NC1=CNC(=O)C2=CC=CC=C12 MC425884 [0,1,0,0,0,0|2,0,1]=4 230 B13R2.371 NC1=CNC(=O)C2=CC=CC=C12 MC425887 [0,1,0,0,0,0|2,0,1]=4 231 B13R2.371 NC1=NC=C(Br)C2=CC=CC=C21 CS13673 [0,1,0,0,0,0|3,0,0]=4 232 B13R2.371 O=C1C=CC(=O)C2=C1C=CC=N2 MC41807 [0,1,0,0,0,0|0,0,1]=2 233 B13R2.371 O=C1CCC(=O)C2=C1C=CC=N2 MC41775 [0,1,0,0,0,0|0,0,3]=4 234 B13R2.371 O=C1NC=C(Br)C2=CC=CC=C12 CS21408 [0,1,0,0,0,0|2,0,1]=4 235 B13R2.371 O=C1NC=C(Cl)C2=CC=CC=C12 MC106978 [0,1,0,0,0,0|2,0,1]=4 236 B13R2.371 OC1=CC=C(Br)C2=CC=CC=C12 CS19148 [0,1,0,0,0,0|1,0,0]=2 237 B13R2.371 OC1=CC=C(Cl)C2=CC=CC=C12 MC443632 [0,1,0,0,0,0|1,0,0]=2 238 B13R2.1613 BrCC1=C2C=CC=NC2=CC=C1 CS18500 [0,1,0,0,0,0|3,0,0]=4 239 B13R2.1613 BrCC1=C2C=CN=CC2=CC=C1 CS16181 [0,1,0,0,0,0|3,0,0]=4 240 B13R2.1613 BrCC1=CC=CC2=CC=CC=C21 CS18965 [0,1,0,0,0,0|2,0,0]=3 241 B13R2.1613 BrCC1=NC=CC2=CC=CC=C21 CS20656 [0,1,0,0,0,0|3,0,0]=4 242 B13R2.1613 BrCC1=NC=CC2=CC=CC=C21 MC113760 [0,1,0,0,0,0|3,0,0]=4 243 B13R2.1613 C#CC1=C2C=CN=CC2=CC=C1 CS19463 [0,1,0,0,0,0|3,0,0]=4 244 B13R2.1613 C#CC1=C2N=CC=CC2=CC=C1 CS14719 [0,1,0,0,0,0|1,0,0]=2 245 B13R2.1613 C#CC1=CC=NC2=CC=CC=C12 CS13117 [0,1,0,0,0,0|3,0,0]=4 246 B13R2.1613 C#CC1=NC=CC2=CC=CC=C21 CS12328 [0,1,0,0,0,0|3,0,0]=4 247 B13R2.1613 CNC1=CC=CC2=CC=CC=C21 CS10073 [0,1,0,0,0,0|2,0,0]=3 248 B13R2.1613 COC1=C2C=CC=NC2=CC=C1 CS13083 [0,1,0,0,0,0|2,0,0]=3 249 B13R2.1613 COC1=C2C=CN=CC2=CC=C1 CS13088 [0,1,0,0,0,0|2,0,0]=3 250 B13R2.1613 COC1=CC=CC2=CC=CC=C21 CS19878 [0,1,0,0,0,0|1,0,0]=2 251 B13R2.1613 COC1=CN=CC2=CC=CC=C21 CS13081 [0,1,0,0,0,0|2,0,0]=3 252 B13R2.1613 N#CC1=C2N=CC=CC2=CC=C1 MC107110 [0,1,0,0,0,0|1,0,0]=2 253 B13R2.1613 N#CC1=CC=CC2=C1C=CN=C2 MC425214 [0,1,0,0,0,0|3,0,0]=4 254 B13R2.1613 N#CC1=CN=CC2=CC=CC=C12 CS17749 [0,1,0,0,0,0|3,0,0]=4 255 B13R2.1613 N#CC1=NC=CC2=CC=CC=C21 MC33380 [0,1,0,0,0,0|3,0,0]=4 256 B13R2.1613 NCC1=C2C=NC=CC2=CC=C1 MC431336 [0,1,0,0,0,0|3,0,0]=4 257 B13R2.1613 NCC1=CC=NC2=CC=CC=C12 CS18368 [0,1,0,0,0,0|3,0,0]=4 258 B13R2.1613 NCC1=CN=CC2=CC=CC=C21 MC33404 [0,1,0,0,0,0|3,0,0]=4 259 B13R2.1613 NCC1=NC=CC2=CC=CC=C21 CS14852 [0,1,0,0,0,0|3,0,0]=4 260 B13R2.1613 O=CC1=CC=CC2=C1C=CC=N2 CS13974 [0,1,0,0,0,0|2,0,1]=4 261 B13R2.1613 O=CC1=CC=CC2=C1C=CN=C2 MC33251 [0,1,0,0,0,0|2,0,1]=4 262 B13R2.1613 O=CC1=CC=NC2=CC=CC=C12 CS11270 [0,1,0,0,0,0|2,0,1]=4 263 B13R2.1613 O=CC1=CN=CC2=CC=CC=C21 MC442435 [0,1,0,0,0,0|2,0,1]=4 264 B13R2.1613 OCC1=C2C=CC=NC2=CC=C1 CS18777 [0,1,0,0,0,0|2,0,0]=3 265 B13R2.1613 OCC1=CC=CC2=CC=CC=C21 CS20773 [0,1,0,0,0,0|1,0,0]=2 266 B13R2.1613 OCC1=CC=NC2=CC=CC=C12 CS14784 [0,1,0,0,0,0|2,0,0]=3 267 B13R2.1613 O\N=C1/C=CC=C2C=NC=CC21 MC106823 [0,1,0,0,0,0|2,0,1]=4 268 B13R2.4818 BrC1=CC=CC2=CC=CC(Br)=C12 CS19790 [0,1,0,0,0,0|2,0,0]=3 269 B13R2.4818 BrC1=CC=CC2=CC=CC(I)=C12 MC440554 [0,1,0,0,0,0|2,0,0]=3 270 B13R2.4818 ClC1=C2C(=CC=C1)C=CN=C2Br MC111223 [0,1,0,0,0,0|3,0,0]=4 271 B13R2.4818 ClC1=C2C(Br)=CC=CC2=CC=C1 MC431532 [0,1,0,0,0,0|2,0,0]=3 272 B13R2.4818 ClC1=C2C(Br)=CN=CC2=CC=C1 MC431274 [0,1,0,0,0,0|3,0,0]=4 273 B13R2.4818 ClC1=NC=CC2=CC=CC(Cl)=C21 CS16425 [0,1,0,0,0,0|3,0,0]=4 274 B13R2.4818 FC1=C2C(Cl)=CC=NC2=CC=C1 CS19590 [0,1,0,0,0,0|3,0,0]=4 275 B13R2.4818 NC1=C2C(=CC=C1)C=CN=C2Cl MC116278 [0,1,0,0,0,0|3,0,0]=4 276 B13R2.4818 NC1=CC=CC2=CC=CC(Br)=C12 MC440588 [0,1,0,0,0,0|2,0,0]=3 277 B13R2.4818 O=C1NC=CC2=CC=CC(Br)=C12 CS12645 [0,1,0,0,0,0|2,0,1]=4 278 B13R2.4818 OC1=C2C(=CC=C1)C=CN=C2Cl MC111227 [0,1,0,0,0,0|2,0,0]=3 279 B13R2.4818 OC1=CC=CC2=CC=CC(O)=C12 CS20557 [0,1,0,0,0,0|1,0,0]=2 280 B13R2.4818 OC1=NC=NC2=CC=CC(Br)=C21 CS15136 [0,1,0,0,0,0|3,0,0]=4 281 B13R2.4818 [O-][N+]1=CC=CC2=CC=CC(O)=C21 CS14898 [0,1,0,0,0,0|0,0,1]=2 282 B13R2.5179 BrC1=C2N=CC(I)=CC2=CC=C1 MC115647 [0,1,0,0,0,0|1,0,0]=2 283 B13R2.5179 BrC1=CC2=CC=CC(I)=C2N=C1 MC102529 [0,1,0,0,0,0|1,0,0]=2 284 B13R2.5179 BrC1=CC2=NC=CC(Br)=C2N=C1 MC103649 [0,1,0,0,0,0|2,0,0]=3 285 B13R2.5179 CC1=CC=C2C(Cl)=CC=NC2=C1 MC443382 [0,1,0,0,0,0|3,0,0]=4 286 B13R2.5179 CC1=CC=C2C(N)=CC=CC2=C1 MC443731 [0,1,0,0,0,0|2,0,0]=3 287 B13R2.5179 CC1=CC=NC2=CC(Br)=CC=C12 CS14818 [0,1,0,0,0,0|3,0,0]=4 288 B13R2.5179 CC1=CC=NC2=CC(N)=CC=C12 CS14685 [0,1,0,0,0,0|3,0,0]=4 289 B13R2.5179 CC1=NC2=CC=CC(N)=C2C=C1 MC41751 [0,1,0,0,0,0|3,0,0]=4 290 B13R2.5179 ClC1=CC2=NC=CC(Cl)=C2N=C1 MC102404 [0,1,0,0,0,0|2,0,0]=3 291 B13R2.5179 ClC1=CC=C2C(=C1)C=CN=C2Br MC111222 [0,1,0,0,0,0|3,0,0]=4 292 B13R2.5179 ClC1=CC=C2C(=C1)C=CN=C2Cl CS18402 [0,1,0,0,0,0|3,0,0]=4 293 B13R2.5179 ClC1=CC=C2C(Br)=CC=NC2=C1 CS19437 [0,1,0,0,0,0|3,0,0]=4 294 B13R2.5179 ClC1=CC=C2C(Cl)=CC=NC2=C1 CS21354 [0,1,0,0,0,0|3,0,0]=4 295 B13R2.5179 ClC1=CC=NC2=CC(Br)=CC=C12 CS19306 [0,1,0,0,0,0|3,0,0]=4 296 B13R2.5179 ClC1=CC=NC2=CC(I)=CC=C12 CS18880 [0,1,0,0,0,0|3,0,0]=4 297 B13R2.5179 ClC1=NC2=CC=CC(Cl)=C2N=C1 MC115889 [0,1,0,0,0,0|2,0,0]=3 298 B13R2.5179 ClC1=NC=CC2=CC(Br)=CC=C21 CS18144 [0,1,0,0,0,0|3,0,0]=4 299 B13R2.5179 FC1=C2C=NC(Cl)=CC2=CC=C1 MC10452 [0,1,0,0,0,0|3,0,0]=4 300 B13R2.5179 FC1=C2N=CC(Br)=CC2=CC=C1 MC429330 [0,1,0,0,0,0|1,0,0]=2 301 B13R2.5179 FC1=C2N=CC(I)=CC2=CC=C1 MC115831 [0,1,0,0,0,0|1,0,0]=2 302 B13R2.5179 FC1=CC=C2C(Br)=CC=NC2=C1 CS19584 [0,1,0,0,0,0|3,0,0]=4 303 B13R2.5179 FC1=CC=C2C(Cl)=CC=NC2=C1 CS19031 [0,1,0,0,0,0|3,0,0]=4 304 B13R2.5179 NC1=CC=C2C(=C1)C=CN=C2Cl CS16892 [0,1,0,0,0,0|3,0,0]=4 305 B13R2.5179 NC1=CC=C2C(=C1)C=CN=C2O MC33375 [0,1,0,0,0,0|2,0,0]=3 306 B13R2.5179 NC1=CC=C2C(Cl)=CC=NC2=C1 CS16423 [0,1,0,0,0,0|3,0,0]=4 307 B13R2.5179 NC1=CC=CC2=CC(F)=CC=C12 MC432422 [0,1,0,0,0,0|2,0,0]=3 308 B13R2.5179 NC1=CC=NC2=CC(Cl)=CC=C12 MC107756 [0,1,0,0,0,0|3,0,0]=4 309 B13R2.5179 NC1=NC2=CC=CC(Br)=C2C=C1 MC441079 [0,1,0,0,0,0|3,0,0]=4 310 B13R2.5179 NC1=NC=CC2=CC(Br)=CC=C21 CS17632 [0,1,0,0,0,0|3,0,0]=4 311 B13R2.5179 NC1=NC=CC2=CC(Cl)=CC=C21 MC443742 [0,1,0,0,0,0|3,0,0]=4 312 B13R2.5179 O=C1C=CC2=C(Cl)C=CC=C2N1 MC103322 [0,1,0,0,0,0|3,0,0]=4 313 B13R2.5179 O=C1C=CNC2=CC(Br)=CC=C12 CS16698 [0,1,0,0,0,0|2,0,1]=4 314 B13R2.5179 O=C1C=COC2=CC(Br)=CC=C12 CS16488 [0,1,0,0,0,0|2,0,1]=4 315 B13R2.5179 O=C1COC2=C(C=CC=C2O)N1 MC441078 [0,1,0,0,0,0|2,0,1]=4 316 B13R2.5179 O=C1NC=CC2=CC(Br)=CC=C12 CS17624 [0,1,0,0,0,0|2,0,1]=4 317 B13R2.5179 O=C1NC=CC2=CC(F)=CC=C12 CS12603 [0,1,0,0,0,0|2,0,1]=4 318 B13R2.5179 OC1=CC2=NC=CC(Cl)=C2N=C1 MC443590 [0,1,0,0,0,0|2,0,0]=3 319 B13R2.5179 OC1=CC=C2C(=C1)C=CN=C2Cl MC111225 [0,1,0,0,0,0|3,0,0]=4 320 B13R2.5179 OC1=CC=C2C(O)=CC=CC2=C1 CS15075 [0,1,0,0,0,0|1,0,0]=2 321 B13R2.5179 OC1=CC=C2C(O)=CC=NC2=C1 MC425086 [0,1,0,0,0,0|2,0,0]=3 322 B13R2.5179 OC1=CC=CC2=CC(Br)=CC=C12 CS16736 [0,1,0,0,0,0|1,0,0]=2 323 B13R2.5179 OC1=CC=CC2=CC(F)=CC=C12 MC431749 [0,1,0,0,0,0|1,0,0]=2 324 B13R2.5179 OC1=CC=NC2=CC(Br)=CC=C12 CS15357 [0,1,0,0,0,0|2,0,0]=3 325 B13R2.5179 OC1=CC=NC2=CC(F)=CC=C12 MC431988 [0,1,0,0,0,0|2,0,0]=3 326 B11R1.53 C=CC1=C(C(=O)O)C=CC=C1 CS16516 [0,0,1,0,0,0|2,0,0]=3 327 B11R1.53 COC1=CC=CN=C1C(=O)O CS22335 [0,0,1,0,0,0|2,0,1]=4 328 B11R1.53 N#CC1=CC=CN=C1C(=O)O MC103589 [0,0,1,0,0,0|2,0,1]=4 329 B11R1.53 O=CC1=C(C(=O)O)C=CC=C1 CS13542 [0,0,1,0,0,0|3,0,0]=4 330 B11R1.265 COC1=C(C=O)C=CC=C1O MC425754 [0,0,1,0,0,0|2,0,1]=4 331 B11R2.1 BrC1=C2N=CC=CN2N=C1 MC443319 [0,0,0,0,1,0|3,0,0]=4 332 B11R2.1 BrC1=CN=C2C=CC=NN12 CS22175 [0,0,0,0,1,0|3,0,0]=4 333 B11R2.1 BrC1=CNC2=CC=CN=C12 CS13195 [0,0,0,0,1,0|2,0,0]=3 334 B11R2.1 BrC1=CNC2=NC=CN=C12 CS22145 [0,0,0,0,1,0|3,0,0]=4 335 B11R2.1 BrC1=COC2=C1C=CC=C2 CS20626 [0,0,0,0,1,0|3,0,0]=4 336 B11R2.1 BrC1=CSC2=C1N=CN=C2 MC100229 [0,0,0,0,1,0|3,0,0]=4 337 B11R2.1 BrC1=CSC2=CC=CN=C12 MC103962 [0,0,0,0,1,0|2,0,0]=3 338 B11R2.1 BrC1=CSC2=NC=CN=C12 MC113247 [0,0,0,0,1,0|3,0,0]=4 339 B11R2.1 BrC1=NNC2=CC=CN=C21 CS12243 [0,0,0,0,1,0|3,0,0]=4 340 B11R2.1 CC1=CCC2=CC=CC=C12 MC106180 [0,0,0,0,1,0|2,0,1]=4 341 B11R2.1 CC1=CNC2=CC=CC=C12 CS11030 [0,0,0,0,1,0|3,0,0]=4 342 B11R2.1 CC1=COC2=C1C=CC=C2 MC30270 [0,0,0,0,1,0|3,0,0]=4 343 B11R2.1 CC1=NNC2=CC=CN=C21 MC442333 [0,0,0,0,1,0|3,0,0]=4 344 B11R2.1 CN1C=CC2=CC=CC=C21 CS11026 [0,0,0,0,1,0|3,0,0]=4 345 B11R2.1 CN1C=CC2=CC=CN=C21 CS20755 [0,0,0,0,1,0|2,0,0]=3 346 B11R2.1 ClC1=CNC2=CC=CC=C12 MC427199 [0,0,0,0,1,0|3,0,0]=4 347 B11R2.1 ClC1=COC2=C1C=CC=C2 MC114725 [0,0,0,0,1,0|3,0,0]=4 348 B11R2.1 IC1=CNC2=CC=CN=C12 CS15332 [0,0,0,0,1,0|2,0,0]=3 349 B11R2.1 IC1=CSC2=C1C=CC=C2 CS22329 [0,0,0,0,1,0|3,0,0]=4 350 B11R2.1 IC1=NNC2=CC=CN=C21 MC442332 [0,0,0,0,1,0|3,0,0]=4 351 B11R2.1 NC1=CN=C2C=CC=NN12 CS11478 [0,0,0,0,1,0|3,0,0]=4 352 B11R2.1 NC1=CNC2=CC=CN=C12 MC102979 [0,0,0,0,1,0|2,0,0]=3 353 B11R2.1 NC1=CSC2=C1C=CC=C2 CS13998 [0,0,0,0,1,0|3,0,0]=4 354 B11R2.1 NC1=NOC2=CC=CN=C21 CS12630 [0,0,0,0,1,0|3,0,0]=4 355 B11R2.1 NN1C=CC2=CC=CC=C21 CS19942 [0,0,0,0,1,0|3,0,0]=4 356 B11R2.1 O=C1CCC2=CC=CN=C12 CS10816 [0,0,0,0,1,0|0,0,3]=4 357 B11R2.1 O=C1COC2=CC=CN=C12 MC103039 [0,0,0,0,1,0|1,0,2]=4 358 B11R2.1 O=C1NNC2=CC=CN=C12 CS16829 [0,0,0,0,1,0|2,0,1]=4 359 B11R2.1 OC1=NOC2=C1C=CC=C2 MC442249 [0,0,0,0,1,0|3,0,0]=4 360 B11R2.1 OC1CCC2=CC=CN=C21 CS10573 [0,0,0,0,1,0|0,0,3]=4 361 B11R2.1 ON1N=NC2=CC=CN=C21 CS22721 [0,0,0,0,1,0|3,0,0]=4 362 B11R2.106 BrC1=C2C=CNC2=CC=C1 CS20686 [0,0,0,0,1,0|2,0,0]=3 363 B11R2.106 BrC1=C2C=CNC2=CN=C1 CS14401 [0,0,0,0,1,0|3,0,0]=4 364 B11R2.106 BrC1=C2C=CNC2=NC=C1 CS18255 [0,0,0,0,1,0|3,0,0]=4 365 B11R2.106 BrC1=C2C=CSC2=CN=C1 MC441175 [0,0,0,0,1,0|3,0,0]=4 366 B11R2.106 BrC1=C2C=CSC2=NC=C1 MC441319 [0,0,0,0,1,0|3,0,0]=4 367 B11R2.106 BrC1=C2C=NNC2=CC=C1 CS18090 [0,0,0,0,1,0|3,0,0]=4 368 B11R2.106 BrC1=C2N=CNC2=NC=C1 MC444450 [0,0,0,0,1,0|3,0,0]=4 369 B11R2.106 BrC1=C2NC=CC2=CC=C1 CS10709 [0,0,0,0,1,0|1,0,1]=3 370 B11R2.106 BrC1=C2NC=CC2=NC=C1 MC105225 [0,0,0,0,1,0|2,0,1]=4 371 B11R2.106 BrC1=C2NN=CC2=CC=C1 MC444453 [0,0,0,0,1,0|2,0,1]=4 372 B11R2.106 BrC1=C2SC=CC2=CC=N1 MC441878 [0,0,0,0,1,0|3,0,0]=4 373 B11R2.106 BrC1=CC=CC2=C1C=CO2 MC103536 [0,0,0,0,1,0|2,0,0]=3 374 B11R2.106 BrC1=CC=CC2=C1C=CS2 CS22672 [0,0,0,0,1,0|2,0,0]=3 375 B11R2.106 BrC1=CC=CC2=C1C=NO2 CS12976 [0,0,0,0,1,0|3,0,0]=4 376 B11R2.106 BrC1=CC=CC2=C1N=CN2 CS12099 [0,0,0,0,1,0|2,0,0]=3 377 B11R2.106 BrC1=CC=CC2=C1N=CO2 CS22673 [0,0,0,0,1,0|2,0,0]=3 378 B11R2.106 BrC1=CC=CC2=C1OC=C2 MC441050 [0,0,0,0,1,0|2,0,0]=3 379 B11R2.106 BrC1=CC=CC2=C1OC=N2 CS10796 [0,0,0,0,1,0|3,0,0]=4 380 B11R2.106 BrC1=CC=CC2=C1SC=C2 CS12307 [0,0,0,0,1,0|2,0,0]=3 381 B11R2.106 BrC1=CC=CC2=C1SC=N2 MC104750 [0,0,0,0,1,0|3,0,0]=4 382 B11R2.106 BrC1=CC=CC2=NC=CN12 MC425444 [0,0,0,0,1,0|3,0,0]=4 383 B11R2.106 BrC1=CC=CC2=NC=NN12 CS10235 [0,0,0,0,1,0|3,0,0]=4 384 B11R2.106 BrC1=CC=CN2C=CN=C12 CS18511 [0,0,0,0,1,0|2,0,0]=3 385 B11R2.106 BrC1=CC=CN2N=CN=C12 MC429711 [0,0,0,0,1,0|3,0,0]=4 386 B11R2.106 BrC1=CN=CC2=C1NC=C2 CS12622 [0,0,0,0,1,0|2,0,1]=4 387 B11R2.106 BrC1=NC=CC2=C1C=CN2 MC121216 [0,0,0,0,1,0|3,0,0]=4 388 B11R2.106 BrC1=NC=CC2=C1C=CS2 MC441331 [0,0,0,0,1,0|3,0,0]=4 389 B11R2.106 BrC1=NC=CC2=C1N=CN2 MC103979 [0,0,0,0,1,0|3,0,0]=4 390 B11R2.106 CC1=C2C=CNC2=CC=C1 CS21706 [0,0,0,0,1,0|2,0,0]=3 391 B11R2.106 CC1=C2C=CNC2=CN=C1 MC103792 [0,0,0,0,1,0|3,0,0]=4 392 B11R2.106 CC1=C2C=CNC2=NC=C1 MC444356 [0,0,0,0,1,0|3,0,0]=4 393 B11R2.106 CC1=C2C=NNC2=CC=C1 CS22943 [0,0,0,0,1,0|3,0,0]=4 394 B11R2.106 CC1=C2N=CNC2=NC=C1 MC444458 [0,0,0,0,1,0|3,0,0]=4 395 B11R2.106 CC1=C2NC=CC2=CC=C1 CS11034 [0,0,0,0,1,0|1,0,1]=3 396 B11R2.106 CC1=C2NC=CC2=NC=C1 MC104033 [0,0,0,0,1,0|2,0,1]=4 397 B11R2.106 CC1=C2NN=CC2=CC=C1 CS10824 [0,0,0,0,1,0|2,0,1]=4 398 B11R2.106 CC1=CC=CC2=C1C=CS2 MC441056 [0,0,0,0,1,0|2,0,0]=3 399 B11R2.106 CC1=CC=CC2=C1NC=N2 MC106503 [0,0,0,0,1,0|2,0,1]=4 400 B11R2.106 CC1=CC=CC2=C1OC=C2 MC441162 [0,0,0,0,1,0|2,0,0]=3 401 B11R2.106 CC1=CC=CC2=C1SC=C2 MC441270 [0,0,0,0,1,0|2,0,0]=3 402 B11R2.106 CC1=NC=CC2=C1C=CN2 MC103793 [0,0,0,0,1,0|3,0,0]=4 403 B11R2.106 ClC1=C2C=CNC2=CC=C1 CS10725 [0,0,0,0,1,0|2,0,0]=3 404 B11R2.106 ClC1=C2C=CNC2=CN=C1 CS15333 [0,0,0,0,1,0|3,0,0]=4 405 B11R2.106 ClC1=C2C=CNC2=NC=C1 CS18360 [0,0,0,0,1,0|3,0,0]=4 406 B11R2.106 ClC1=C2C=COC2=NC=C1 MC105245 [0,0,0,0,1,0|3,0,0]=4 407 B11R2.106 ClC1=C2C=CSC2=CN=C1 MC441327 [0,0,0,0,1,0|3,0,0]=4 408 B11R2.106 ClC1=C2C=NNC2=CC=C1 CS22715 [0,0,0,0,1,0|3,0,0]=4 409 B11R2.106 ClC1=C2NC=CC2=CC=C1 CS14936 [0,0,0,0,1,0|1,0,1]=3 410 B11R2.106 ClC1=C2NC=CC2=CC=N1 CS18260 [0,0,0,0,1,0|2,0,1]=4 411 B11R2.106 ClC1=C2NC=CC2=CN=C1 MC105224 [0,0,0,0,1,0|2,0,1]=4 412 B11R2.106 ClC1=C2NC=CC2=NC=C1 CS10799 [0,0,0,0,1,0|2,0,1]=4 413 B11R2.106 ClC1=C2NN=CC2=CC=C1 MC444455 [0,0,0,0,1,0|2,0,1]=4 414 B11R2.106 ClC1=C2OC=CC2=CC=N1 MC100091 [0,0,0,0,1,0|3,0,0]=4 415 B11R2.106 ClC1=C2OC=CC2=NC=C1 MC113020 [0,0,0,0,1,0|3,0,0]=4 416 B11R2.106 ClC1=C2SC=CC2=CC=N1 MC441879 [0,0,0,0,1,0|3,0,0]=4 417 B11R2.106 ClC1=C2SC=CC2=NC=C1 MC441903 [0,0,0,0,1,0|3,0,0]=4 418 B11R2.106 ClC1=CC=CC2=C1C=CO2 MC21109 [0,0,0,0,1,0|2,0,0]=3 419 B11R2.106 ClC1=CC=CC2=C1C=CS2 MC441271 [0,0,0,0,1,0|2,0,0]=3 420 B11R2.106 ClC1=CC=CC2=C1N=CS2 CS12362 [0,0,0,0,1,0|2,0,0]=3 421 B11R2.106 ClC1=CC=CC2=C1OC=C2 MC441165 [0,0,0,0,1,0|2,0,0]=3 422 B11R2.106 ClC1=CC=CC2=C1SC=C2 MC442796 [0,0,0,0,1,0|2,0,0]=3 423 B11R2.106 ClC1=CC=CC2=NC=CN12 CS15361 [0,0,0,0,1,0|3,0,0]=4 424 B11R2.106 ClC1=CC=NC2=CC=NN12 CS10810 [0,0,0,0,1,0|3,0,0]=4 425 B11R2.106 ClC1=NC=CC2=C1C=CN2 CS22768 [0,0,0,0,1,0|3,0,0]=4 426 B11R2.106 ClC1=NC=CC2=C1C=CO2 CS22787 [0,0,0,0,1,0|3,0,0]=4 427 B11R2.106 ClC1=NC=CC2=C1C=CS2 MC441332 [0,0,0,0,1,0|3,0,0]=4 428 B11R2.106 ClC1=NC=CC2=C1N=CN2 CS22720 [0,0,0,0,1,0|3,0,0]=4 429 B11R2.106 FC1=C2C=CNC2=CC=C1 CS10745 [0,0,0,0,1,0|2,0,0]=3 430 B11R2.106 FC1=C2C=CNC2=CN=C1 MC105227 [0,0,0,0,1,0|3,0,0]=4 431 B11R2.106 FC1=C2C=CNC2=NC=C1 CS22834 [0,0,0,0,1,0|3,0,0]=4 432 B11R2.106 FC1=C2C=NNC2=CC=C1 MC425694 [0,0,0,0,1,0|3,0,0]=4 433 B11R2.106 FC1=C2NC=CC2=CC=C1 CS10747 [0,0,0,0,1,0|1,0,1]=3 434 B11R2.106 FC1=C2NC=CC2=CN=C1 MC105234 [0,0,0,0,1,0|2,0,1]=4 435 B11R2.106 FC1=C2NC=CC2=NC=C1 MC105237 [0,0,0,0,1,0|2,0,1]=4 436 B11R2.106 FC1=C2NN=CC2=CC=C1 CS10814 [0,0,0,0,1,0|2,0,1]=4 437 B11R2.106 FC1=CC=CC2=C1C=CO2 MC443205 [0,0,0,0,1,0|2,0,0]=3 438 B11R2.106 FC1=CC=CC2=C1C=CS2 MC441148 [0,0,0,0,1,0|2,0,0]=3 439 B11R2.106 FC1=CC=CC2=C1N=CN2 MC445693 [0,0,0,0,1,0|2,0,0]=3 440 B11R2.106 FC1=CC=CC2=C1OC=C2 MC441166 [0,0,0,0,1,0|2,0,0]=3 441 B11R2.106 FC1=CC=CC2=C1SC=C2 MC115513 [0,0,0,0,1,0|2,0,0]=3 442 B11R2.106 FC1=CC=CC2=NC=CN12 MC443445 [0,0,0,0,1,0|3,0,0]=4 443 B11R2.106 FC1=CC=CN2C=CN=C12 CS12996 [0,0,0,0,1,0|2,0,0]=3 444 B11R2.106 IC1=C2C=CNC2=NC=C1 CS22903 [0,0,0,0,1,0|3,0,0]=4 445 B11R2.106 IC1=C2C=NNC2=CC=C1 MC444353 [0,0,0,0,1,0|3,0,0]=4 446 B11R2.106 IC1=CC=CC2=C1NC=N2 MC427402 [0,0,0,0,1,0|2,0,1]=4 447 B11R2.106 NC1=C2C=CNC2=CC=C1 CS20916 [0,0,0,0,1,0|2,0,0]=3 448 B11R2.106 NC1=C2C=CNC2=CC=N1 MC103418 [0,0,0,0,1,0|3,0,0]=4 449 B11R2.106 NC1=C2C=COC2=CC=C1 MC116403 [0,0,0,0,1,0|2,0,0]=3 450 B11R2.106 NC1=C2N=COC2=CC=C1 MC443226 [0,0,0,0,1,0|2,0,0]=3 451 B11R2.106 NC1=C2NC=CC2=CC=C1 CS10501 [0,0,0,0,1,0|1,0,1]=3 452 B11R2.106 NC1=C2NC=CC2=NC=C1 CS13692 [0,0,0,0,1,0|2,0,1]=4 453 B11R2.106 NC1=C2NN=CC2=CC=C1 MC444437 [0,0,0,0,1,0|2,0,1]=4 454 B11R2.106 NC1=CC=CC2=C1C=NN2 CS20710 [0,0,0,0,1,0|3,0,0]=4 455 B11R2.106 NC1=CC=CC2=C1N=CS2 MC427104 [0,0,0,0,1,0|2,0,0]=3 456 B11R2.106 NC1=CC=CC2=C1NC=N2 MC20436 [0,0,0,0,1,0|2,0,1]=4 457 B11R2.106 NC1=CC=CC2=C1OC=N2 CS17297 [0,0,0,0,1,0|3,0,0]=4 458 B11R2.106 NC1=CC=CC2=C1ON=C2 CS17211 [0,0,0,0,1,0|3,0,0]=4 459 B11R2.106 NC1=CC=CC2=C1SC=C2 MC443211 [0,0,0,0,1,0|2,0,0]=3 460 B11R2.106 NC1=CC=CC2=C1SC=N2 CS10782 [0,0,0,0,1,0|3,0,0]=4 461 B11R2.106 NC1=CC=CN2C=CN=C12 CS17745 [0,0,0,0,1,0|2,0,0]=3 462 B11R2.106 NC1=CC=NC2=C1C=CN2 CS18445 [0,0,0,0,1,0|3,0,0]=4 463 B11R2.106 NC1=CC=NC2=C1C=CN2 MC425221 [0,0,0,0,1,0|3,0,0]=4 464 B11R2.106 NC1=CC=NN2C=CC=C12 MC103375 [0,0,0,0,1,0|3,0,0]=4 465 B11R2.106 NC1=CC=NN2C=CN=C12 MC104804 [0,0,0,0,1,0|3,0,0]=4 466 B11R2.106 NC1=NC=CC2=C1C=CO2 MC103086 [0,0,0,0,1,0|3,0,0]=4 467 B11R2.106 O=C1C=CNC2=CC=NN12 CS12290 [0,0,0,0,1,0|2,0,1]=4 468 B11R2.106 O=C1N=CC=C2N=CN=C12 MC114303 [0,0,0,0,1,0|2,0,1]=4 469 B11R2.106 O=C1NC=CC2=C1C=CN2 CS22878 [0,0,0,0,1,0|2,0,1]=4 470 B11R2.106 O=C1NC=CC2=C1C=CO2 CS18921 [0,0,0,0,1,0|2,0,1]=4 471 B11R2.106 O=C1NC=CC2=C1C=CS2 MC429953 [0,0,0,0,1,0|2,0,1]=4 472 B11R2.106 O=C1NC=CN2C=CN=C12 CS18497 [0,0,0,0,1,0|2,0,1]=4 473 B11R2.106 OC1=C2C=CN=C2NC=N1 CS18265 [0,0,0,0,1,0|3,0,0]=4 474 B11R2.106 OC1=C2C=COC2=CC=C1 MC441157 [0,0,0,0,1,0|1,0,0]=2 475 B11R2.106 OC1=C2C=NNC2=CC=C1 MC444351 [0,0,0,0,1,0|2,0,0]=3 476 B11R2.106 OC1=C2C=NNC2=NC=C1 MC103914 [0,0,0,0,1,0|3,0,0]=4 477 B11R2.106 OC1=C2N=COC2=CC=C1 MC443775 [0,0,0,0,1,0|1,0,0]=2 478 B11R2.106 OC1=C2N=CSC2=CC=C1 CS22602 [0,0,0,0,1,0|1,0,0]=2 479 B11R2.106 OC1=C2NN=CC2=CC=C1 CS17029 [0,0,0,0,1,0|1,0,1]=3 480 B11R2.106 OC1=C2SC=CC2=NC=C1 CS12021 [0,0,0,0,1,0|2,0,0]=3 481 B11R2.106 OC1=CC=CC2=C1C=CN2 CS10821 [0,0,0,0,1,0|1,0,0]=2 482 B11R2.106 OC1=CC=CC2=C1CCC2 CS22898 [0,0,0,0,1,0|0,0,3]=4 483 B11R2.106 OC1=CC=CC2=C1OC=C2 MC441279 [0,0,0,0,1,0|1,0,0]=2 484 B11R2.106 OC1=CC=CN2C=CN=C12 MC425445 [0,0,0,0,1,0|1,0,0]=2 485 B11R2.106 [O-][N+]1=C2N=CNC2=CC=C1 MC107148 [0,0,0,0,1,0|2,0,1]=4 486 B10R1.2 CC1=C(C=O)C=CC=C1O CS15258 [1,0,1,0,0,0|1,0,1]=4 487 B10R1.2 O=CC1=C(Br)C(O)=CC=C1 CS13249 [1,0,1,0,0,0|2,0,0]=4 488 B10R1.2 O=CC1=C(F)C(O)=CC=C1 MC441017 [1,0,1,0,0,0|2,0,0]=4 489 B10R1.2 O=CC1=C(O)C(O)=CC=C1 CS21044 [1,0,1,0,0,0|2,0,0]=4 490 B10R1.10 C=CCC1=CC=CC(O)=C1 MC425380 [1,0,1,0,0,0|0,0,1]=3 491 B10R1.10 O=CCC1=CC(O)=CC=C1 MC106361 [1,0,1,0,0,0|1,0,1]=4 492 B10R1.17 ClC\C=C\C1=CC=CC=C1 MC41818 [1,0,1,0,0,0|1,0,1]=4 493 B10R1.61 CC1=CC=CN=C1C(=O)O CS19680 [1,0,1,0,0,0|1,0,1]=4 494 B10R1.61 NC1=CC=CN=C1C(=O)O CS17409 [1,0,1,0,0,0|2,0,0]=4 495 B10R1.61 NC1=CC=CN=C1C(=O)O CS19360 [1,0,1,0,0,0|2,0,0]=4 496 B10R1.61 O=C(O)C1=NC=CC=C1Br CS22914 [1,0,1,0,0,0|2,0,0]=4 497 B10R1.61 O=C(O)C1=NC=CC=C1Cl CS15072 [1,0,1,0,0,0|2,0,0]=4 498 B10R1.61 O=C(O)C1=NC=CC=C1F CS18754 [1,0,1,0,0,0|2,0,0]=4 499 B10R1.61 O=C(O)C1=NC=CC=C1I CS12162 [1,0,1,0,0,0|2,0,0]=4 500 B10R1.61 O=C(O)C1=NC=CC=C1O CS22996 [1,0,1,0,0,0|2,0,0]=4 501 B10R1.245 C=CC1=C(F)C=CC=C1F MC41563 [1,0,1,0,0,0|2,0,0]=4 502 B10R1.245 CC1=CC=CC(O)=C1C=O MC442494 [1,0,1,0,0,0|1,0,1]=4 503 B10R1.245 O=CC1=C(Br)C=CC=C1O CS21383 [1,0,1,0,0,0|2,0,0]=4 504 B10R1.245 O=CC1=C(Cl)C=CC=C1O CS20108 [1,0,1,0,0,0|2,0,0]=4 505 B10R1.245 O=CC1=C(F)C=CC=C1O CS20127 [1,0,1,0,0,0|2,0,0]=4 506 B12R1.280 C=CCC1=C(O)C(OC)=CC=C1 MC112509 [0,1,1,0,0,0|1,0,1]=4 507 B12R1.121 COC1=C(\C=C\C=O)C=CC=C1 CS15311 [0,1,1,0,0,0|2,0,0]=4 508 B12R1.374 O=C\C=C\C1=C(O)C=CC(Cl)=C1 MC111789 [0,1,1,0,0,0|2,0,0]=4 509 B12R1.226 O=C(O)\C=C\C1=CC(Br)=CC=C1 CS21499 [0,1,1,0,0,0|2,0,0]=4 510 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 CS21503 [0,1,1,0,0,0|2,0,0]=4 511 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 MC40208 [0,1,1,0,0,0|2,0,0]=4 512 B12R1.226 O=C(O)\C=C\C1=CC(F)=CC=C1 CS10976 [0,1,1,0,0,0|2,0,0]=4 513 B12R1.226 O=C(O)\C=C\C1=CC(F)=CC=C1 MC40216 [0,1,1,0,0,0|2,0,0]=4 514 B12R1.261 O=C(O)C1=CC=CN=C1C(=O)O CS20149 [0,1,1,0,0,0|2,0,0]=4 515 B12R1.261 O=C(O)C1=CC=CN=C1C(=O)O MC41634 [0,1,1,0,0,0|2,0,0]=4 516 B12R2.24 BrC1=CC2=CC=CC=C2C=C1 CS19153 [1,1,0,0,0,0|1,0,0]=3 517 B12R2.24 BrC1=CC2=CC=CC=C2C=N1 CS22177 [1,1,0,0,0,0|2,0,0]=4 518 B12R2.24 BrC1=CC2=CC=CC=C2N=C1 CS21394 [1,1,0,0,0,0|0,0,0]=2 519 B12R2.24 BrC1=CC2=CC=CN=C2N=C1 MC442578 [1,1,0,0,0,0|1,0,0]=3 520 B12R2.24 BrC1=CC2=NC=CC=C2N=C1 CS22124 [1,1,0,0,0,0|1,0,0]=3 521 B12R2.24 BrC1=CC2=NC=CN=C2N=C1 CS19867 [1,1,0,0,0,0|2,0,0]=4 522 B12R2.24 BrC1=CC=C2C=CC=NC2=C1 CS19085 [1,1,0,0,0,0|0,0,0]=2 523 B12R2.24 BrC1=CC=C2C=CN=CC2=C1 CS19165 [1,1,0,0,0,0|2,0,0]=4 524 B12R2.24 BrC1=CC=C2C=NC=CC2=C1 CS21398 [1,1,0,0,0,0|2,0,0]=4 525 B12R2.24 BrC1=CC=C2C=NC=NC2=C1 MC121072 [1,1,0,0,0,0|1,0,0]=3 526 B12R2.24 BrC1=CC=C2N=CC=CC2=C1 CS10941 [1,1,0,0,0,0|0,0,0]=2 527 B12R2.24 BrC1=CC=C2N=CC=NC2=C1 CS14624 [1,1,0,0,0,0|1,0,0]=3 528 B12R2.24 BrC1=CC=C2N=CN=CC2=C1 CS18543 [1,1,0,0,0,0|1,0,0]=3 529 B12R2.24 BrC1=CC=C2N=NC=CC2=C1 CS14598 [1,1,0,0,0,0|1,0,0]=3 530 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 CS21392 [1,1,0,0,0,0|0,0,0]=2 531 B12R2.24 BrC1=NC2=CC=CC=C2C=N1 MC440083 [1,1,0,0,0,0|1,0,0]=3 532 B12R2.24 BrC1=NC2=CC=CC=C2N=C1 CS19018 [1,1,0,0,0,0|1,0,0]=3 533 B12R2.24 CC1=CC2=CC=CC=C2C=N1 CS19703 [1,1,0,0,0,0|2,0,0]=4 534 B12R2.24 CC1=CC2=CC=CC=C2N=C1 CS11336 [1,1,0,0,0,0|0,0,0]=2 535 B12R2.24 CC1=CC=C2C=CC=NC2=C1 MC20324 [1,1,0,0,0,0|0,0,0]=2 536 B12R2.24 CC1=CC=C2C=NC=CC2=C1 CS10742 [1,1,0,0,0,0|2,0,0]=4 537 B12R2.24 CC1=CC=C2N=CC=CC2=C1 CS10066 [1,1,0,0,0,0|0,0,0]=2 538 B12R2.24 CC1=CC=C2N=CC=NC2=C1 CS15412 [1,1,0,0,0,0|1,0,0]=3 539 B12R2.24 CC1=NC2=C(C=CC=C2)N=N1 MC106658 [1,1,0,0,0,0|2,0,0]=4 540 B12R2.24 CC1=NC2=CC=CC=C2C=C1 CS11335 [1,1,0,0,0,0|0,0,0]=2 541 B12R2.24 CC1=NC2=CN=CC=C2C=C1 MC111420 [1,1,0,0,0,0|1,0,0]=3 542 B12R2.24 CC1=NC2=NC=CC=C2C=C1 CS18023 [1,1,0,0,0,0|1,0,0]=3 543 B12R2.24 CC1=NC2=NC=CN=C2C=C1 MC445685 [1,1,0,0,0,0|2,0,0]=4 544 B12R2.24 ClC1=CC2=C(C=N1)N=CN=C2 CS10697 [1,1,0,0,0,0|2,0,0]=4 545 B12R2.24 ClC1=CC2=CC=CC=C2C=N1 CS22238 [1,1,0,0,0,0|2,0,0]=4 546 B12R2.24 ClC1=CC2=CC=CC=C2N=C1 CS22245 [1,1,0,0,0,0|0,0,0]=2 547 B12R2.24 ClC1=CC=C2C=CC=NC2=C1 CS10811 [1,1,0,0,0,0|0,0,0]=2 548 B12R2.24 ClC1=CC=C2C=NC=CC2=C1 CS11526 [1,1,0,0,0,0|2,0,0]=4 549 B12R2.24 ClC1=CC=C2C=NC=NC2=C1 MC20750 [1,1,0,0,0,0|1,0,0]=3 550 B12R2.24 ClC1=CC=C2N=CC=CC2=C1 CS21425 [1,1,0,0,0,0|0,0,0]=2 551 B12R2.24 ClC1=CN=C2C=CC=NC2=N1 CS17190 [1,1,0,0,0,0|2,0,0]=4 552 B12R2.24 ClC1=NC2=C(C=CC=N2)C=N1 MC103563 [1,1,0,0,0,0|2,0,0]=4 553 B12R2.24 ClC1=NC2=C(C=CN=C2)C=N1 MC103930 [1,1,0,0,0,0|2,0,0]=4 554 B12R2.24 ClC1=NC2=C(C=N1)N=CC=C2 MC103931 [1,1,0,0,0,0|2,0,0]=4 555 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 CS21419 [1,1,0,0,0,0|0,0,0]=2 556 B12R2.24 ClC1=NC2=CC=CC=C2C=N1 CS19965 [1,1,0,0,0,0|1,0,0]=3 557 B12R2.24 ClC1=NC2=CC=CN=C2C=C1 CS16799 [1,1,0,0,0,0|1,0,0]=3 558 B12R2.24 ClC1=NC2=NC=CN=C2C=C1 MC113122 [1,1,0,0,0,0|2,0,0]=4 559 B12R2.24 FC1=CC2=CC=CC=C2C=N1 MC429919 [1,1,0,0,0,0|2,0,0]=4 560 B12R2.24 FC1=CC=C2C=NC=CC2=C1 CS14751 [1,1,0,0,0,0|2,0,0]=4 561 B12R2.24 FC1=CC=C2N=CC=CC2=C1 CS12098 [1,1,0,0,0,0|0,0,0]=2 562 B12R2.24 FC1=CC=C2N=CN=CC2=C1 CS17781 [1,1,0,0,0,0|1,0,0]=3 563 B12R2.24 IC1=CC=C2N=CC=CC2=C1 MC30340 [1,1,0,0,0,0|0,0,0]=2 564 B12R2.24 NC1=CC2=CC=CC=C2C=C1 MC41753 [1,1,0,0,0,0|1,0,0]=3 565 B12R2.24 NC1=CC2=CC=CC=C2C=N1 CS21593 [1,1,0,0,0,0|2,0,0]=4 566 B12R2.24 NC1=CC2=CC=CC=C2N=C1 CS11010 [1,1,0,0,0,0|0,0,0]=2 567 B12R2.24 NC1=CC=C2C=CC=NC2=C1 CS12077 [1,1,0,0,0,0|0,0,0]=2 568 B12R2.24 NC1=CC=C2C=CN=CC2=C1 CS18893 [1,1,0,0,0,0|2,0,0]=4 569 B12R2.24 NC1=CC=C2C=NC=CC2=C1 CS18181 [1,1,0,0,0,0|2,0,0]=4 570 B12R2.24 NC1=CC=C2C=NC=NC2=C1 CS16110 [1,1,0,0,0,0|1,0,0]=3 571 B12R2.24 NC1=CC=C2N=CC=CC2=C1 CS11016 [1,1,0,0,0,0|0,0,0]=2 572 B12R2.24 NC1=CC=C2N=CC=NC2=C1 CS10612 [1,1,0,0,0,0|1,0,0]=3 573 B12R2.24 NC1=NC2=CC=CC=C2C=C1 CS11009 [1,1,0,0,0,0|0,0,0]=2 574 B12R2.24 NC1=NC2=CC=CN=C2C=C1 MC115906 [1,1,0,0,0,0|1,0,0]=3 575 B12R2.24 NC1=NC2=NC=CC=C2C=C1 CS20558 [1,1,0,0,0,0|1,0,0]=3 576 B12R2.24 O=C1C=C2C=CC=CC2=NN1 CS16596 [1,1,0,0,0,0|1,0,0]=3 577 B12R2.24 O=C1C=CC2=CN=CC=C2N1 MC442445 [1,1,0,0,0,0|1,0,1]=4 578 B12R2.24 O=C1C=CC2=NC=CN=C2N1 CS12516 [1,1,0,0,0,0|2,0,0]=4 579 B12R2.24 O=C1C=NC2=C(N=CC=C2)N1 CS17925 [1,1,0,0,0,0|2,0,0]=4 580 B12R2.24 OC1=CC2=CC=CC=C2C=C1 CS21708 [1,1,0,0,0,0|1,0,0]=3 581 B12R2.24 OC1=CC2=CC=CC=C2N=C1 CS19154 [1,1,0,0,0,0|0,0,0]=2 582 B12R2.24 OC1=CC=C2C=CC=NC2=C1 CS10982 [1,1,0,0,0,0|0,0,0]=2 583 B12R2.24 OC1=CC=C2C=CN=CC2=C1 MC441084 [1,1,0,0,0,0|2,0,0]=4 584 B12R2.24 OC1=CC=C2C=NC=CC2=C1 CS18471 [1,1,0,0,0,0|2,0,0]=4 585 B12R2.24 OC1=NC2=CC=CC=C2N=C1 CS21605 [1,1,0,0,0,0|1,0,0]=3 586 B12R2.24 OC1=NC2=CC=CN=C2C=C1 MC442462 [1,1,0,0,0,0|1,0,0]=3 587 B12R2.24 [O-][N+]1=CC2=CC=CC=C2C=C1 CS21529 [1,1,0,0,0,0|2,0,0]=4 588 B12R2.1 NCC1=CNC2=CC=CN=C12 MC111171 [0,1,0,0,1,0|2,0,0]=4 589 B12R2.1 OCC1=CNC2=C1C=CC=C2 MC20402 [0,1,0,0,1,0|2,0,0]=4 590 B12R2.18 CC1=C(O)C2=NC=CC=C2O1 MC427139 [0,1,0,0,1,0|1,0,0]=3 591 B12R2.132 CN1C=CC2=CC=C(N)N=C21 MC104469 [0,1,0,0,1,0|2,0,0]=4 592 B12R2.132 Cn1ccc2ccc(N)nc21 MC104470 [0,1,0,0,1,0|2,0,0]=4 593 B12R2.196 CN1C=CC2=C(Cl)C=CN=C21 CS13174 [0,1,0,0,1,0|2,0,0]=4 594 B12R2.612 CN1C=CC2=CC(Br)=CN=C21 MC443223 [0,1,0,0,1,0|2,0,0]=4 595 B12R2.612 CN1C=CC2=CC(N)=CN=C21 MC113007 [0,1,0,0,1,0|2,0,0]=4 596 B12R2.612 CN1C=CC2=CC(O)=CN=C21 MC425497 [0,1,0,0,1,0|2,0,0]=4 597 B12R2.2028 CN1C=C(Br)C2=CC=CN=C21 CS13199 [0,1,0,0,1,0|2,0,0]=4 598 B12R2.2028 O=C1OC(=O)C2=NC=CC=C12 CS15659 [0,1,0,0,1,0|1,0,1]=4 599 B12R2.82 CC1=C(Br)C2=C(C=C1)NC=N2 MC430306 [0,1,0,0,1,0|2,0,0]=4 600 B12R2.82 CC1=C(Br)C=CC2=CC=NN21 MC445664 [0,1,0,0,1,0|2,0,0]=4 601 B12R2.82 CC1=C(Cl)C2=C(C=C1)NC=N2 MC430305 [0,1,0,0,1,0|2,0,0]=4 602 B12R2.82 CC1=C(Cl)C=CC2=C1N=CN2 MC430295 [0,1,0,0,1,0|2,0,0]=4 603 B12R2.82 CC1=C(F)C2=C(C=C1)NC=N2 MC430311 [0,1,0,0,1,0|2,0,0]=4 604 B12R2.82 CC1=C(F)C=CC2=C1N=CN2 MC430282 [0,1,0,0,1,0|2,0,0]=4 605 B12R2.82 CC1=C(N)C=CC2=C1N=CN2 MC430518 [0,1,0,0,1,0|2,0,0]=4 606 B12R2.82 CC1=C(O)C=CC2=C1N=CN2 MC430520 [0,1,0,0,1,0|2,0,0]=4 607 B12R2.82 CC1=C2C=CNC2=CC=C1O MC111282 [0,1,0,0,1,0|2,0,0]=4 608 B12R2.82 CC1=C2NC=CC2=CC=C1F MC20606 [0,1,0,0,1,0|1,0,1]=4 609 B12R2.82 CC1=CC=C2NC=CC2=C1Br CS16082 [0,1,0,0,1,0|2,0,0]=4 610 B12R2.82 CC1=CC=C2NC=CC2=C1F MC432493 [0,1,0,0,1,0|2,0,0]=4 611 B12R2.82 ClC1=C(Br)C=CC2=C1OC=C2 MC441282 [0,1,0,0,1,0|2,0,0]=4 612 B12R2.82 ClC1=C(Cl)C2=C(C=C1)NC=N2 MC430308 [0,1,0,0,1,0|2,0,0]=4 613 B12R2.82 ClC1=C(I)C=CN2C=CN=C12 MC432637 [0,1,0,0,1,0|2,0,0]=4 614 B12R2.82 FC1=C(Br)C2=C(C=CO2)C=C1 MC441156 [0,1,0,0,1,0|2,0,0]=4 615 B12R2.82 FC1=C(Br)C2=C(C=CS2)C=C1 MC441274 [0,1,0,0,1,0|2,0,0]=4 616 B12R2.82 FC1=C(Br)C=CC2=C1C=CS2 MC441276 [0,1,0,0,1,0|2,0,0]=4 617 B12R2.82 FC1=C(Br)C=CC2=C1OC=C2 MC441284 [0,1,0,0,1,0|2,0,0]=4 618 B12R2.82 FC1=C(Br)C=CC2=C1SC=C2 MC441273 [0,1,0,0,1,0|2,0,0]=4 619 B12R2.82 FC1=C(Cl)C2=C(C=C1)NC=N2 MC430511 [0,1,0,0,1,0|2,0,0]=4 620 B12R2.82 FC1=C(F)C2=C(C=CS2)C=C1 MC441275 [0,1,0,0,1,0|2,0,0]=4 621 B12R2.82 FC1=C2C=CNC2=CC=C1Br CS16496 [0,1,0,0,1,0|2,0,0]=4 622 B12R2.82 FC1=CC=C2NC=CC2=C1F MC20235 [0,1,0,0,1,0|2,0,0]=4 623 B12R2.82 FC1=CC=C2NC=CC2=C1I MC107475 [0,1,0,0,1,0|2,0,0]=4 624 B12R2.82 NC1=C(Cl)C2=C(C=C1)NC=N2 MC430517 [0,1,0,0,1,0|2,0,0]=4 625 B12R2.82 OC1=C(Cl)C2=C(C=C1)NC=N2 MC430516 [0,1,0,0,1,0|2,0,0]=4 626 B12R2.82 OC1=C(F)C=NC2=C1C=CN2 MC430966 [0,1,0,0,1,0|2,0,0]=4 627 B12R2.202 CC1=CC2=C(Br)C=CC=C2N1 CS14478 [0,1,0,0,1,0|2,0,0]=4 628 B12R2.202 CC1=CC2=C(O)C=CN=C2N1 MC104046 [0,1,0,0,1,0|2,0,0]=4 629 B12R2.202 CC1=CC=CC2=C1N=C(N)S2 MC31057 [0,1,0,0,1,0|2,0,0]=4 630 B12R2.202 CC1=CN2C=CC=C(N)C2=N1 CS12224 [0,1,0,0,1,0|2,0,0]=4 631 B12R2.202 CC1=NC2=C(C=CC=C2Br)N1 CS14639 [0,1,0,0,1,0|2,0,0]=4 632 B12R2.202 CC1=NC2=C(C=CC=C2Br)O1 MC442517 [0,1,0,0,1,0|2,0,0]=4 633 B12R2.202 CC1=NC2=C(C=CC=C2Br)S1 MC427102 [0,1,0,0,1,0|2,0,0]=4 634 B12R2.202 CN1C=C2C=CC=C(Br)C2=N1 CS12326 [0,1,0,0,1,0|2,0,0]=4 635 B12R2.202 ClC1=CC=CC2=C1N=C(Br)N2 MC106094 [0,1,0,0,1,0|2,0,0]=4 636 B12R2.202 ClC1=CC=CC2=C1N=C(Cl)N2 MC106093 [0,1,0,0,1,0|2,0,0]=4 637 B12R2.202 ClC1=CC=CC2=C1N=C(Cl)S2 CS14203 [0,1,0,0,1,0|2,0,0]=4 638 B12R2.202 ClC1=NC2=C(C=CC=C2Br)S1 CS13851 [0,1,0,0,1,0|2,0,0]=4 639 B12R2.202 FC1=CC=CC2=C1N=C(Cl)N2 CS20700 [0,1,0,0,1,0|2,0,0]=4 640 B12R2.202 FC1=CC=CC2=C1N=C(Cl)S2 CS13850 [0,1,0,0,1,0|2,0,0]=4 641 B12R2.202 NC1=CC2=C(C=CC=C2Br)S1 MC104026 [0,1,0,0,1,0|2,0,0]=4 642 B12R2.202 NC1=NC2=C(C=CC=C2Br)S1 MC427242 [0,1,0,0,1,0|2,0,0]=4 643 B12R2.202 NC1=NC2=C(C=CC=C2Cl)N1 CS16891 [0,1,0,0,1,0|2,0,0]=4 644 B12R2.202 NC1=NC2=C(C=CC=C2Cl)S1 CS20101 [0,1,0,0,1,0|2,0,0]=4 645 B12R2.202 NC1=NC2=C(C=CC=C2F)S1 CS21249 [0,1,0,0,1,0|2,0,0]=4 646 B12R2.202 NC1=NC2=C(C=CC=C2O)S1 CS21252 [0,1,0,0,1,0|1,0,0]=3 647 B12R2.202 OC1=C2N=C(Br)SC2=CC=C1 CS17617 [0,1,0,0,1,0|1,0,0]=3 648 B12R2.202 SC1=NC2=C(C=CC=C2Cl)S1 CS16409 [0,1,0,0,1,0|2,0,0]=4 649 B12R2.221 BrC1=CC=C(Br)C2=C1C=CO2 MC441292 [0,1,0,0,1,0|2,0,0]=4 650 B12R2.221 CC1=C2C=CCC2=C(C)C=C1 MC20297 [0,1,0,0,1,0|1,0,1]=4 651 B12R2.221 CC1=C2NC=CC2=C(Cl)C=C1 CS22779 [0,1,0,0,1,0|1,0,1]=4 652 B12R2.221 CC1=CC=C(Br)C2=C1C=CO2 MC441291 [0,1,0,0,1,0|2,0,0]=4 653 B12R2.221 CC1=CC=C(O)C2=C1NC=C2 MC444627 [0,1,0,0,1,0|1,0,0]=3 654 B12R2.221 ClC1=C2NC=CC2=C(Br)C=C1 MC113829 [0,1,0,0,1,0|1,0,1]=4 655 B12R2.221 ClC1=CC=C(Br)C2=C1C=CO2 MC441290 [0,1,0,0,1,0|2,0,0]=4 656 B12R2.221 ClC1=CC=C(Br)C2=C1OC=C2 MC115473 [0,1,0,0,1,0|2,0,0]=4 657 B12R2.221 ClC1=CC=C(Cl)C2=C1C=CO2 MC441281 [0,1,0,0,1,0|2,0,0]=4 658 B12R2.221 ClC1=CC=C(Cl)C2=C1C=CS2 MC114614 [0,1,0,0,1,0|2,0,0]=4 659 B12R2.221 FC1=C2C=CNC2=C(Br)C=C1 CS10792 [0,1,0,0,1,0|1,0,1]=4 660 B12R2.221 FC1=C2C=CNC2=C(F)C=C1 MC10425 [0,1,0,0,1,0|1,0,1]=4 661 B12R2.221 FC1=C2C=CNC2=C(I)C=C1 MC101709 [0,1,0,0,1,0|1,0,1]=4 662 B12R2.221 FC1=C2NC=CC2=C(Br)C=C1 CS13270 [0,1,0,0,1,0|1,0,1]=4 663 B12R2.221 FC1=C2NC=CC2=C(I)C=C1 MC101710 [0,1,0,0,1,0|1,0,1]=4 664 B12R2.221 FC1=CC=C(Br)C2=C1C=CO2 MC441153 [0,1,0,0,1,0|2,0,0]=4 665 B12R2.221 FC1=CC=C(Br)C2=C1C=CS2 MC430434 [0,1,0,0,1,0|2,0,0]=4 666 B12R2.221 FC1=CC=C(Br)C2=C1OC=C2 MC441169 [0,1,0,0,1,0|2,0,0]=4 667 B12R2.221 FC1=CC=C(F)C2=C1N=CN2 MC429321 [0,1,0,0,1,0|2,0,0]=4 668 B12R2.221 NC1=CC=C(Br)C2=C1SC=N2 MC106306 [0,1,0,0,1,0|2,0,0]=4 669 B12R2.221 OC1=CC=C(Br)C2=C1C=CN2 MC444628 [0,1,0,0,1,0|1,0,0]=3 670 B12R2.246 BrC1=CC(I)=C2C=CNC2=C1 CS16444 [0,1,0,0,1,0|2,0,0]=4 671 B12R2.246 BrC1=CC2=C(OC=C2)C(Br)=C1 MC441163 [0,1,0,0,1,0|2,0,0]=4 672 B12R2.246 BrC1=CN2C=CN=C2C(Br)=C1 MC445137 [0,1,0,0,1,0|2,0,0]=4 673 B12R2.246 CC1=C2C=CNC2=CC(N)=C1 MC121299 [0,1,0,0,1,0|2,0,0]=4 674 B12R2.246 CC1=C2NC=CC2=CC(Br)=C1 MC107262 [0,1,0,0,1,0|1,0,1]=4 675 B12R2.246 CC1=CC(Br)=CC2=C1OC=C2 MC441285 [0,1,0,0,1,0|2,0,0]=4 676 B12R2.246 CC1=CC2=C(OC=C2)C(Br)=C1 MC441295 [0,1,0,0,1,0|2,0,0]=4 677 B12R2.246 CC1=CN2C=CN=C2C(Br)=C1 MC431378 [0,1,0,0,1,0|2,0,0]=4 678 B12R2.246 ClC1=CC(Br)=C2NC=CC2=C1 CS12110 [0,1,0,0,1,0|1,0,1]=4 679 B12R2.246 ClC1=CC(Br)=CC2=C1C=CS2 MC441277 [0,1,0,0,1,0|2,0,0]=4 680 B12R2.246 ClC1=CC(Br)=CC2=C1OC=C2 MC441283 [0,1,0,0,1,0|2,0,0]=4 681 B12R2.246 ClC1=CC(Br)=CN2C=CN=C12 MC445153 [0,1,0,0,1,0|2,0,0]=4 682 B12R2.246 ClC1=CC(Cl)=C2NC=CC2=C1 MC107692 [0,1,0,0,1,0|1,0,1]=4 683 B12R2.246 ClC1=CC2=C(C=CO2)C(Cl)=C1 MC443313 [0,1,0,0,1,0|2,0,0]=4 684 B12R2.246 ClC1=CC2=C(OC=C2)C(Br)=C1 MC115291 [0,1,0,0,1,0|2,0,0]=4 685 B12R2.246 ClC1=CC2=C(OC=C2)C(Cl)=C1 CS16926 [0,1,0,0,1,0|2,0,0]=4 686 B12R2.246 ClC1=CN2C=CN=C2C(Br)=C1 MC445136 [0,1,0,0,1,0|2,0,0]=4 687 B12R2.246 ClC1=CN2C=CN=C2C(Cl)=C1 MC445138 [0,1,0,0,1,0|2,0,0]=4 688 B12R2.246 FC1=C2C=CNC2=CC(Br)=C1 MC105774 [0,1,0,0,1,0|2,0,0]=4 689 B12R2.246 FC1=C2NC=CC2=CC(I)=C1 MC101707 [0,1,0,0,1,0|1,0,1]=4 690 B12R2.246 FC1=CC(Br)=C2C=CNC2=C1 CS16762 [0,1,0,0,1,0|2,0,0]=4 691 B12R2.246 FC1=CC(Br)=CC2=C1C=CS2 MC441151 [0,1,0,0,1,0|2,0,0]=4 692 B12R2.246 FC1=CC(Br)=CC2=C1OC=C2 MC441155 [0,1,0,0,1,0|2,0,0]=4 693 B12R2.246 FC1=CC(F)=C2C=CNC2=C1 MC20399 [0,1,0,0,1,0|2,0,0]=4 694 B12R2.246 FC1=CC(F)=C2NC=CC2=C1 MC20236 [0,1,0,0,1,0|1,0,1]=4 695 B12R2.246 FC1=CC(I)=C2NC=CC2=C1 MC101708 [0,1,0,0,1,0|1,0,1]=4 696 B12R2.246 FC1=CC2=C(OC=C2)C(Br)=C1 MC441294 [0,1,0,0,1,0|2,0,0]=4 697 B12R2.246 NC1=C2C=CNC2=CC(I)=C1 MC107269 [0,1,0,0,1,0|2,0,0]=4 698 B12R2.246 NC1=CC(Cl)=CC2=C1C=CN2 CS22575 [0,1,0,0,1,0|2,0,0]=4 699 B12R2.246 NC1=CC(F)=C2C=CNC2=C1 CS17242 [0,1,0,0,1,0|2,0,0]=4 700 B12R2.246 NC1=CC(F)=C2NC=CC2=C1 MC113034 [0,1,0,0,1,0|1,0,1]=4 701 B12R2.246 O=C1C=C(O)C2=C(N1)SC=C2 CS22896 [0,1,0,0,1,0|2,0,0]=4 702 B12R2.246 OC1=C2C=NNC2=CC(Br)=C1 MC105023 [0,1,0,0,1,0|2,0,0]=4 703 B12R2.246 OC1=CC(Br)=CN2C=CN=C12 MC445132 [0,1,0,0,1,0|1,0,0]=3 704 B12R2.246 OC1=CC(Cl)=CC2=C1C=NN2 MC441200 [0,1,0,0,1,0|2,0,0]=4 705 B12R2.246 OC1=CC(O)=NC2=CC=NN12 MC446707 [0,1,0,0,1,0|2,0,0]=4 706 B12R2.246 OC1=CC2=C(OC=C2)C(Br)=C1 MC443694 [0,1,0,0,1,0|2,0,0]=4 707 B12R2.315 BrCC1=CC=CC2=C1N=CO2 CS16693 [0,1,0,0,1,0|2,0,0]=4 708 B12R2.315 BrCC1=CC=CC2=C1SC=C2 CS17546 [0,1,0,0,1,0|2,0,0]=4 709 B12R2.315 COC1=C2C=CNC2=CC=C1 CS21717 [0,1,0,0,1,0|1,0,0]=3 710 B12R2.315 COC1=C2C=CNC2=NC=C1 MC10480 [0,1,0,0,1,0|2,0,0]=4 711 B12R2.315 COC1=C2C=NNC2=CC=C1 MC102407 [0,1,0,0,1,0|2,0,0]=4 712 B12R2.315 COC1=C2NC=CC2=CN=C1 MC105233 [0,1,0,0,1,0|1,0,1]=4 713 B12R2.315 COC1=C2NC=CC2=NC=C1 MC105235 [0,1,0,0,1,0|1,0,1]=4 714 B12R2.315 COC1=C2OC=CC2=CC=N1 MC104057 [0,1,0,0,1,0|2,0,0]=4 715 B12R2.315 COC1=CC=CC2=C1OC=C2 CS21625 [0,1,0,0,1,0|1,0,0]=3 716 B12R2.315 COC1=NC=CC2=C1N=CN2 MC427181 [0,1,0,0,1,0|2,0,0]=4 717 B12R2.315 COC1=NC=CN2C=CN=C12 CS18501 [0,1,0,0,1,0|2,0,0]=4 718 B12R2.315 N#CC1=C2NC=CC2=CC=C1 CS16384 [0,1,0,0,1,0|1,0,1]=4 719 B12R2.315 N#CC1=CC=CC2=C1C=CN2 CS10950 [0,1,0,0,1,0|2,0,0]=4 720 B12R2.315 N#CC1=CC=CC2=C1N=CN2 CS15041 [0,1,0,0,1,0|2,0,0]=4 721 B12R2.315 O=CC1=C2C=COC2=CC=C1 MC441168 [0,1,0,0,1,0|1,0,1]=4 722 B12R2.315 O=CC1=C2NC=CC2=CC=C1 CS21528 [0,1,0,0,1,0|0,0,2]=4 723 B12R2.315 O=CC1=CC=CC2=C1C=CN2 CS10984 [0,1,0,0,1,0|1,0,1]=4 724 B12R2.315 O=CC1=CC=CC2=C1C=CS2 MC441866 [0,1,0,0,1,0|1,0,1]=4 725 B12R2.315 O=CC1=CC=CC2=C1SC=C2 MC441865 [0,1,0,0,1,0|1,0,1]=4 726 B12R2.315 O=CC1=CC=CN2C=CN=C12 CS17746 [0,1,0,0,1,0|1,0,1]=4 727 B12R2.315 OCC1=C2C=CNC2=NC=C1 MC103956 [0,1,0,0,1,0|2,0,0]=4 728 B12R2.315 OCC1=C2NN=CC2=CC=C1 MC444435 [0,1,0,0,1,0|1,0,1]=4 729 B12R2.315 OCC1=CC=CC2=C1N=CN2 MC429976 [0,1,0,0,1,0|1,0,0]=3 730 B12R2.315 OCC1=CC=CC2=C1SC=N2 CS17762 [0,1,0,0,1,0|2,0,0]=4 731 B12R2.315 OCC1=CC=CC2=NC=CN12 CS16533 [0,1,0,0,1,0|2,0,0]=4 732 B12R2.315 OCC1=NC=CN2C=CC=C12 MC104880 [0,1,0,0,1,0|2,0,0]=4 733 B12R2.315 OCc1cccc2ccoc12 MC103541 [0,1,0,0,1,0|1,0,0]=3 734 B14R2.92 COC1=C(Br)C2=CC=CC=C2C=C1 CS11559 [0,2,0,0,0,0|2,0,0]=4 735 B14R2.92 COC1=CC=C2C=CC=NC2=C1Br MC106848 [0,2,0,0,0,0|1,0,0]=3 736 B14R2.92 N#CC1=C(N)C2=CC=CC=C2C=C1 MC445278 [0,2,0,0,0,0|2,0,0]=4 737 B14R2.92 NC1=C2N=CC=CC2=CC=C1C=O MC440081 [0,2,0,0,0,0|1,0,0]=3 738 B14R2.4513 CC1=NC2=C(F)C(F)=CC=C2C=C1 MC111416 [0,2,0,0,0,0|1,0,0]=3 739 B14R2.4513 CC1=NC2=C(N)C(N)=CC=C2C=C1 MC111423 [0,2,0,0,0,0|1,0,0]=3 740 B14R2.4513 FC1=CC=C2C=CC(Cl)=NC2=C1Br MC113860 [0,2,0,0,0,0|1,0,0]=3 741 B14R2.4513 OC1=CC2=C(F)C(F)=CC=C2C=C1 MC114837 [0,2,0,0,0,0|2,0,0]=4 742 B14R2.7724 CC1=CC(C)=C2C=CC=NC2=C1O MC33384 [0,2,0,0,0,0|0,0,0]=2 743 B14R2.7724 O=C1C=C(Cl)C2=CC=CC=C2C1=O MC113411 [0,2,0,0,0,0|1,0,1]=4 744 B14R2.7724 OC1=C2N=CC=CC2=C(Br)C=C1Br CS14732 [0,2,0,0,0,0|0,0,0]=2 745 B14R2.8038 CC1=C2N=CC=C(Br)C2=CC=C1Cl MC113632 [0,2,0,0,0,0|1,0,0]=3 746 B14R2.8038 ClC1=C(Cl)C2=CC=NC(Cl)=C2N=C1 MC102263 [0,2,0,0,0,0|2,0,0]=4 747 B14R2.142 COC1=CC=C2C=CC=C(F)C2=C1 MC114055 [0,2,0,0,0,0|2,0,0]=4 748 B14R2.142 COC1=NC2=C(Cl)C=CN=C2C=C1 MC113270 [0,2,0,0,0,0|2,0,0]=4 749 B14R2.142 O=CC1=CC2=C(Br)C=CC=C2C=C1 MC432432 [0,2,0,0,0,0|2,0,0]=4 750 B14R2.8045 CC1=CC(Br)=C2N=CN=C(Cl)C2=C1 MC107461 [0,2,0,0,0,0|2,0,0]=4 751 B14R2.8045 CC1=CC(Br)=C2N=CNC(=O)C2=C1 MC105723 [0,2,0,0,0,0|2,0,0]=4 752 B14R2.8045 ClC1=NC2=C(Br)C=CC=C2C(Cl)=N1 CS12626 [0,2,0,0,0,0|2,0,0]=4 753 B14R2.8045 ClC1=NC2=C(Cl)C=CC=C2C(Cl)=N1 CS13093 [0,2,0,0,0,0|2,0,0]=4 754 B14R2.8045 ClC1=NC2=C(I)C=CC=C2C(Cl)=N1 MC114672 [0,2,0,0,0,0|2,0,0]=4 755 B14R2.8045 FC1=C2N=C(Cl)N=C(Cl)C2=CC=C1 MC425518 [0,2,0,0,0,0|2,0,0]=4 756 B14R2.8045 FC1=CC(F)=C2N=CC=C(Br)C2=C1 MC431977 [0,2,0,0,0,0|1,0,0]=3 757 B14R2.8045 NC1=NC(Cl)=NC2=C(Br)C=CC=C12 CS13314 [0,2,0,0,0,0|2,0,0]=4 758 B14R2.8045 NC1=NC(Cl)=NC2=C(Cl)C=CC=C12 CS17064 [0,2,0,0,0,0|2,0,0]=4 759 B14R2.8045 NC1=NC(Cl)=NC2=C(I)C=CC=C12 MC114671 [0,2,0,0,0,0|2,0,0]=4 760 B14R2.8045 NC1=NC2=C(F)C=CC=C2C(N)=N1 MC106787 [0,2,0,0,0,0|2,0,0]=4 761 B14R2.8045 O=C1C=C(Cl)N=C2C(O)=CC=CN12 MC104704 [0,2,0,0,0,0|1,0,0]=3 762 B14R2.8045 OC1=CC=NC2=C(F)C=C(Br)C=C12 MC107712 [0,2,0,0,0,0|1,0,0]=3 763 B14R2.8235 CC1=CC=C2N=C(O)C=C(O)C2=C1 CS12343 [0,2,0,0,0,0|2,0,0]=4 764 B14R2.8235 CC1=NC2=C(C)C=C(Br)C=C2C=C1 CS17647 [0,2,0,0,0,0|1,0,0]=3 765 B14R2.8235 FC1=C2N=C(Cl)N=CC2=CC(Br)=C1 MC104053 [0,2,0,0,0,0|2,0,0]=4 766 B14R2.8235 FC1=CC(Br)=C2N=C(Cl)N=CC2=C1 MC113609 [0,2,0,0,0,0|2,0,0]=4 767 B14R2.8235 O=C1C=C(O)C2=CC(Br)=CC=C2N1 CS15981 [0,2,0,0,0,0|2,0,0]=4 768 B14R2.8235 OC1=CC2=C(F)C=C(Br)C=C2C=C1 MC100565 [0,2,0,0,0,0|2,0,0]=4 769 B14R2.11684 COC1=C2N=C(Br)C=CC2=CC=C1 MC443451 [0,2,0,0,0,0|0,0,0]=2 770 B14R2.11684 COC1=C2N=C(N)N=CC2=CC=C1 CS15461 [0,2,0,0,0,0|1,0,0]=3 771 B14R2.11684 COC1=NC=CC2=CC=C(N)C=C21 MC116285 [0,2,0,0,0,0|2,0,0]=4 772 B14R2.1019 COC1=CC(Br)=C2N=CC=CC2=C1 CS14701 [0,2,0,0,0,0|1,0,0]=3 773 B14R2.1019 COC1=CC(Cl)=C2N=CC=CC2=C1 MC21031 [0,2,0,0,0,0|1,0,0]=3 774 B14R2.1019 O=CC1=CC2=CC=CC=C2C(Br)=C1 MC431958 [0,2,0,0,0,0|2,0,0]=4 775 B14R2.1146 COC1=C2N=CC=CC2=CC(Cl)=C1 MC428127 [0,2,0,0,0,0|0,0,0]=2 776 B14R2.1146 COC1=C2N=CC=CC2=CC(N)=N1 MC111063 [0,2,0,0,0,0|1,0,0]=3 777 B14R2.1146 COC1=CC(N)=CC2=CC=CC=C21 MC437965 [0,2,0,0,0,0|1,0,0]=3 778 B14R2.29365 O=C1C=CC2=C(O)C=C(O)C=C2O1 CS10182 [0,2,0,0,0,0|2,0,0]=4 779 B14R2.1078 COC1=C2N=CC=C(Cl)C2=CC=C1 MC443187 [0,2,0,0,0,0|0,0,0]=2 780 B14R2.1078 COC1=C2N=CN=C(Cl)C2=CC=C1 CS12188 [0,2,0,0,0,0|1,0,0]=3 781 B14R2.1078 COC1=C2N=CN=C(O)C2=CC=C1 CS16819 [0,2,0,0,0,0|1,0,0]=3 782 B14R2.1078 COC1=NC=CC2=C1C=CC=C2N MC116283 [0,2,0,0,0,0|2,0,0]=4 783 B14R2.1078 COC1=NC=CC2=C1N=CN=C2Cl MC33374 [0,2,0,0,0,0|2,0,0]=4 784 B14R2.1078 COC1=NC=CC2=C1N=CNC2=O MC33373 [0,2,0,0,0,0|2,0,0]=4 785 B14R2.1078 O=CC1=CC=CC2=C(F)C=CC=C12 MC431949 [0,2,0,0,0,0|1,0,1]=4 786 B14R2.8051 CC1=CC=NC2=C(Br)C=CC(C)=C12 CS17104 [0,2,0,0,0,0|1,0,0]=3 787 B14R2.1131 BrCC1=CC=C(Br)C2=CC=CC=C12 MC20998 [0,2,0,0,0,0|2,0,0]=4 788 B14R2.1131 COC1=CC=C(F)C2=CC=CC=C12 MC107674 [0,2,0,0,0,0|1,0,0]=3 789 B14R2.1131 COC1=NC=C(Br)C2=CC=CC=C21 CS12237 [0,2,0,0,0,0|2,0,0]=4 790 B14R2.1131 O=CC1=CC=C(F)C2=CC=CC=C12 CS16549 [0,2,0,0,0,0|1,0,1]=4 791 B14R2.1131 OCC1=C2N=CC=CC2=C(Br)C=C1 MC443276 [0,2,0,0,0,0|0,0,0]=2 792 B14R2.1073 COC1=NC=CC2=CC(N)=CC=C21 MC116284 [0,2,0,0,0,0|2,0,0]=4 793 B14R2.7150 N#CCC1=CC=CC2=CC=CC=C21 CS13607 [0,2,0,0,0,0|2,0,0]=4 794 B14R2.7150 NNCC1=CC=CC2=CC=CC=C21 MC107736 [0,2,0,0,0,0|2,0,0]=4 795 B14R2.7150 OCCC1=CC=CC2=CC=CC=C21 CS11636 [0,2,0,0,0,0|1,0,0]=3 796 B14R2.11635 COC1=C2C(O)=CC=NC2=CC=C1 MC102759 [0,2,0,0,0,0|2,0,0]=4 797 B14R2.11635 O=CC1=CC=CC2=CC=CC(O)=C12 MC425788 [0,2,0,0,0,0|1,0,0]=3 798 B14R2.31359 CC(=O)C1=CC=CC2=CC=CC=C21 CS20585 [0,2,0,0,0,0|1,0,1]=4 799 B14R2.31359 CC(N)C1=CC=CC2=CC=CC=C21 CS14252 [0,2,0,0,0,0|2,0,0]=4 800 B14R2.31359 CC(O)C1=CC=CC2=CC=CC=C21 CS18766 [0,2,0,0,0,0|1,0,0]=3 801 B14R2.31359 O=C(O)C1=C2N=CC=CC2=CC=C1 CS11273 [0,2,0,0,0,0|0,0,0]=2 802 B14R2.31359 O=C(O)C1=CC=CC2=C1C=CC=N2 CS11278 [0,2,0,0,0,0|2,0,0]=4 803 B14R2.31359 O=C(O)C1=CC=CC2=C1C=CN=C2 CS11275 [0,2,0,0,0,0|2,0,0]=4 804 B14R2.31359 O=C(O)C1=CC=CC2=C1N=CC=N2 CS18425 [0,2,0,0,0,0|1,0,0]=3 805 B14R2.31359 O=C(O)C1=CC=CC2=CC=CC=C21 CS16170 [0,2,0,0,0,0|1,0,0]=3 806 B14R2.31359 O=C(O)C1=CN=CC2=CC=CC=C21 CS18438 [0,2,0,0,0,0|2,0,0]=4 807 B14R2.31359 O=C(O)C1=NC=CC2=CC=CC=C21 CS21774 [0,2,0,0,0,0|2,0,0]=4 808 B14R2.31359 O=[N+]([O-])C1=C2N=CC=CC2=CC=C1 CS10954 [0,2,0,0,0,0|0,0,1]=3 809 B14R2.31359 O=[N+]([O-])C1=CC=CC2=CC=CC=C21 MC427706 [0,2,0,0,0,0|1,0,1]=4 810 B14R2.31359 OB(O)C1=C2C=CC=NC2=CC=C1 CS21555 [0,2,0,0,0,0|2,0,0]=4 811 B14R2.31359 OB(O)C1=C2N=CC=CC2=CC=C1 MC440043 [0,2,0,0,0,0|0,0,0]=2 812 B14R2.31359 OB(O)C1=CC=CC2=CC=CC=C21 CS11317 [0,2,0,0,0,0|1,0,0]=3 813 B14R2.31359 OB(O)C1=CC=NC2=CC=CC=C21 CS18268 [0,2,0,0,0,0|2,0,0]=4 814 B14R2.31359 OB(O)C1=CN=CC2=CC=CC=C21 CS21554 [0,2,0,0,0,0|2,0,0]=4 815 B14R2.31359 OB(O)C1=CN=CC2=CC=CC=C21 MC31182 [0,2,0,0,0,0|2,0,0]=4 816 B14R2.1801 COC1=CC2=NC=CC(Cl)=C2N=C1 MC101943 [0,2,0,0,0,0|2,0,0]=4 817 B14R2.1801 COC1=CC=C2C(Br)=CC=CC2=C1 MC10530 [0,2,0,0,0,0|2,0,0]=4 818 B14R2.1801 COC1=CC=C2C(O)=CC=NC2=C1 MC425081 [0,2,0,0,0,0|2,0,0]=4 819 B14R2.1801 N#CC1=CC2=CC=CC(F)=C2N=C1 MC432585 [0,2,0,0,0,0|1,0,0]=3 820 B14R2.1801 N#CC1=NC2=CC=CC(O)=C2C=C1 MC101984 [0,2,0,0,0,0|2,0,0]=4 821 B12R2.2 C1=CC=C(C2=CC=CN2)C=C1 MC443684 [0,0,1,1,0,0|2,0,0]=4 822 B12R2.2 C1=CC=C(C2=CC=CO2)C=C1 MC114862 [0,0,1,1,0,0|1,0,0]=3 823 B12R2.2 C1=CC=C(C2=CC=CS2)C=C1 CS21744 [0,0,1,1,0,0|1,1,0]=4 824 B12R2.2 C1=CC=C(C2=CN=CO2)C=C1 CS10486 [0,0,1,1,0,0|2,0,0]=4 825 B12R2.2 C1=CC=C(C2=NC=CO2)C=C1 CS12838 [0,0,1,1,0,0|2,0,0]=4 826 B12R2.2 C1=CN=C(C2=CNC=N2)C=C1 MC103054 [0,0,1,1,0,0|2,0,0]=4 827 B12R2.2 C1=CN=C(C2=NNC=C2)C=C1 CS20822 [0,0,1,1,0,0|2,0,0]=4 828 B12R2.2 C1=CN=C(N2C=CC=N2)C=C1 MC425202 [0,0,1,1,0,0|2,0,0]=4 829 B12R2.32 BrCC1=NC2=C(C=CC=C2)O1 CS12836 [0,0,1,1,0,0|1,0,1]=4 830 B12R2.32 CSC1=NC2=C(C=CC=C2)O1 MC31049 [0,0,1,1,0,0|1,0,1]=4 831 B12R2.32 ClCC1=NC2=C(C=CC=C2)O1 MC442523 [0,0,1,1,0,0|1,0,1]=4 832 B12R2.32 O=CC1=NC2=C(C=CC=C2)N1 MC33243 [0,0,1,1,0,0|2,0,0]=4 833 B14R3.164 C1=CC2=CC=CC3=C2C(=C1)C=C3 CS10876 [0,1,0,1,0,0|2,0,0]=4 834 B10R2.7 C1=CC2=C(C=C1)NC=N2 MC41756 [1,0,0,0,1,0|1,0,0]=3 835 B10R2.7 C1=CC2=C(C=C1)OC=N2 CS10994 [1,0,0,0,1,0|1,0,0]=3 836 B10R2.7 C1=CC2=C(C=C1)SC=C2 CS16362 [1,0,0,0,1,0|1,0,0]=3 837 B10R2.7 C1=CC2=C(C=C1)SC=N2 CS10992 [1,0,0,0,1,0|1,0,0]=3 838 B10R2.7 C1=CC2=C(C=CN2)C=N1 CS20237 [1,0,0,0,1,0|1,0,1]=4 839 B10R2.7 C1=CC2=C(C=CS2)C=N1 MC441330 [1,0,0,0,1,0|2,0,0]=4 840 B10R2.7 C1=CC2=C(C=N1)NC=N2 CS22307 [1,0,0,0,1,0|2,0,0]=4 841 B10R2.7 C1=CC2=C(C=N1)SC=N2 CS14769 [1,0,0,0,1,0|2,0,0]=4 842 B10R2.7 C1=CC2=C(C=NC=N2)N1 CS20526 [1,0,0,0,1,0|2,0,0]=4 843 B10R2.7 C1=CC2=C(N=N1)NC=C2 MC105641 [1,0,0,0,1,0|2,0,0]=4 844 B10R2.7 C1=CC2=CC=CN2C=C1 MC441215 [1,0,0,0,1,0|1,0,0]=3 845 B10R2.7 C1=CC2=CC=NC=C2N1 CS20238 [1,0,0,0,1,0|1,0,1]=4 846 B10R2.7 C1=CC2=CC=NC=C2O1 MC100123 [1,0,0,0,1,0|2,0,0]=4 847 B10R2.7 C1=CC2=CC=NC=C2S1 CS13198 [1,0,0,0,1,0|2,0,0]=4 848 B10R2.7 C1=CC2=CC=NN2C=C1 MC106678 [1,0,0,0,1,0|1,0,0]=3 849 B10R2.7 C1=CC2=CN=CN2C=C1 CS17747 [1,0,0,0,1,0|2,0,0]=4 850 B10R2.7 C1=CC2=CN=CNC2=N1 MC444144 [1,0,0,0,1,0|2,0,0]=4 851 B10R2.7 C1=CC2=CNN=C2C=N1 CS15726 [1,0,0,0,1,0|2,0,0]=4 852 B10R2.7 C1=CC2=NC=CN2C=C1 CS18927 [1,0,0,0,1,0|1,0,0]=3 853 B10R2.7 C1=CC2=NC=CN2C=N1 MC443383 [1,0,0,0,1,0|2,0,0]=4 854 B10R2.7 C1=CC2=NC=CN2N=C1 CS19141 [1,0,0,0,1,0|2,0,0]=4 855 B10R2.7 C1=CC2=NN=CN2C=C1 MC33369 [1,0,0,0,1,0|2,0,0]=4 856 B10R2.7 C1=CC2=NNC=C2C=N1 MC442795 [1,0,0,0,1,0|2,0,0]=4 857 B10R2.7 C1=CC2=NON=C2C=C1 CS10977 [1,0,0,0,1,0|2,0,0]=4 858 B10R2.7 C1=CC2=NSN=C2C=C1 CS22942 [1,0,0,0,1,0|2,0,0]=4 859 B10R2.7 C1=CC=C2CC=CC2=C1 MC20914 [1,0,0,0,1,0|0,0,1]=3 860 B10R2.7 C1=CC=C2NC=CC2=C1 CS11496 [1,0,0,0,1,0|0,0,1]=3 861 B10R2.7 C1=CC=C2NN=CC2=C1 CS11488 [1,0,0,0,1,0|1,0,1]=4 862 B10R2.7 C1=CC=C2OC=CC2=C1 CS11169 [1,0,0,0,1,0|1,0,0]=3 863 B10R2.7 C1=CN2C=CN=C2C=N1 MC425604 [1,0,0,0,1,0|2,0,0]=4 864 B10R2.7 C1=CN2C=CN=C2N=C1 CS14068 [1,0,0,0,1,0|2,0,0]=4 865 B10R2.7 C1=CN=C2C=CNC2=C1 CS20236 [1,0,0,0,1,0|1,0,0]=3 866 B10R2.7 C1=CN=C2C=CSC2=C1 CS14375 [1,0,0,0,1,0|1,0,0]=3 867 B10R2.7 C1=CN=C2C=NNC2=C1 MC442331 [1,0,0,0,1,0|2,0,0]=4 868 B10R2.7 C1=CN=C2N=CNC2=C1 CS14066 [1,0,0,0,1,0|2,0,0]=4 869 B10R2.7 C1=CN=C2NC=CC2=C1 CS10447 [1,0,0,0,1,0|1,0,0]=3 870 B10R2.7 C1=CN=C2NC=CC2=N1 CS22516 [1,0,0,0,1,0|2,0,0]=4 871 B10R2.7 C1=CN=C2NN=CC2=C1 CS18202 [1,0,0,0,1,0|2,0,0]=4 872 B10R2.7 C1=CN=C2OC=CC2=C1 MC107657 [1,0,0,0,1,0|1,0,0]=3 873 B10R2.7 C1=CN=C2SC=CC2=C1 CS14590 [1,0,0,0,1,0|1,0,0]=3 874 B10R2.7 C1=CN=C2SC=CC2=N1 CS12514 [1,0,0,0,1,0|2,0,0]=4