0 B12R2.246 BrC1=CC(=NC2=C1C=CN2)Br Z1269210309 [0,0,0,0,0,0|3,0,1]=4 1 B12R2.246 CC1=C2NN=NC2=CC(=C1)Br Z1322795309 [0,0,0,0,0,0|4,0,0]=4 2 B12R2.246 CC1=CC2=C(NC=C2)C(=O)N1 Z1255368377 [0,0,0,0,0,0|3,0,0]=3 3 B12R2.246 CC1=CC2=C(NC=N2)C(=C1)N Z1551929441 [0,0,0,0,0,0|4,0,0]=4 4 B12R2.246 CC1=CN2N=CC=C2C(=O)N1 Z3301681831 [0,0,0,0,0,0|4,0,0]=4 5 B12R2.246 CC1=NC2=C(C=NN2)C(=O)N1 Z732618066 [0,0,0,0,0,0|3,0,1]=4 6 B12R2.246 ClC1=C2OC=NC2=CC(=C1)Br Z1269148239 [0,0,0,0,0,0|4,0,0]=4 7 B12R2.246 ClC1=NC2=C(NC=C2)C(=N1)Cl Z1198175555 [0,0,0,0,0,0|2,1,1]=4 8 B12R2.246 ClC1=NC2=C(NC=N2)C(=N1)Cl Z1198147229 [0,0,0,0,0,0|1,1,1]=3 9 B12R2.246 FC1=C2NN=NC2=CC(=C1)Br Z3300761258 [0,0,0,0,0,0|4,0,0]=4 10 B12R2.246 FC1=C2OC=NC2=CC(=C1)Br Z1269201723 [0,0,0,0,0,0|4,0,0]=4 11 B12R2.246 NC1=C2NC=NC2=NC(=N1)Cl Z1741971500 [0,0,0,0,0,0|1,1,1]=3 12 B12R2.246 NC1=C2NC=NC2=NC(=N1)F Z1198269560 [0,0,0,0,0,0|1,1,1]=3 13 B12R2.246 NC1=NC(=O)C2=C(N1)N=CN2 Z256709612 [0,0,0,0,0,0|1,0,2]=3 14 B12R2.246 NC1=NC(=S)C2=C(N1)N=CN2 Z2299468139 [0,0,0,0,0,0|1,1,2]=4 15 B12R2.246 NC1=NC2=C(NC=N2)C(=N1)Cl Z2472857685 [0,0,0,0,0,0|2,0,1]=3 16 B12R2.246 O=C1CC2=C(C=CN2)C(=O)N1 Z1201626909 [0,0,0,0,0,0|3,0,1]=4 17 B12R2.246 O=C1CN2N=CC=C2C(=O)N1 Z4286165160 [0,0,0,0,0,0|4,0,0]=4 18 B12R2.246 O=C1NC(=NC2=C1C=CS2)S Z126620918 [0,0,0,0,0,0|3,0,0]=3 19 B12R2.246 O=C1NC(=NC2=C1C=NN2)Cl Z1587294678 [0,0,0,0,0,0|2,1,1]=4 20 B12R2.246 O=C1NC(=NC2=C1C=NN2)S Z198750874 [0,0,0,0,0,0|3,0,1]=4 21 B12R2.246 O=C1NC(=NC2=C1SC=C2)S Z315923754 [0,0,0,0,0,0|3,0,0]=3 22 B12R2.246 O=C1NC(=O)C2=C(N1)C=CN2 Z1198175553 [0,0,0,0,0,0|2,0,1]=3 23 B12R2.246 O=C1NC(=O)C2=C(N1)C=CS2 Z287017748 [0,0,0,0,0,0|3,0,1]=4 24 B12R2.246 O=C1NC(=O)C2=C(N1)NC=N2 Z57825360 [0,0,0,0,0,0|1,0,3]=4 25 B12R2.246 O=C1NC(=O)C2=C(N1)SC=N2 Z3241252485 [0,0,0,0,0,0|2,0,2]=4 26 B12R2.246 OC1=NC2=C(SC=N2)C(=N1)O Z1198729803 [0,0,0,0,0,0|2,0,2]=4 27 B11R2.36 BrC1=CC2=C(C=C1)NC=C2 Z104489174 [1,0,0,0,0,0|3,0,0]=4 28 B11R2.36 BrC1=CC2=C(C=C1)NC=N2 Z382822766 [1,0,0,0,0,0|2,0,0]=3 29 B11R2.36 BrC1=CC2=C(C=C1)NN=N2 Z1198153729 [1,0,0,0,0,0|3,0,0]=4 30 B11R2.36 BrC1=CC2=C(C=C1)SC=N2 Z1269222968 [1,0,0,0,0,0|3,0,0]=4 31 B11R2.36 BrC1=NC2=C(N=C1)NC=C2 Z1198233192 [1,0,0,0,0,0|3,0,0]=4 32 B11R2.36 BrC1=NC2=C(N=C1)NC=N2 Z1198272469 [1,0,0,0,0,0|2,0,0]=3 33 B11R2.36 BrC1=NC2=NC=CN2C=C1 Z1255426128 [1,0,0,0,0,0|3,0,0]=4 34 B11R2.36 ClC1=NC2=C(C=C1)NN=N2 Z951303230 [1,0,0,0,0,0|2,1,0]=4 35 B11R2.36 ClC1=NC2=C(C=N1)NC=N2 Z2895166358 [1,0,0,0,0,0|0,1,1]=3 36 B11R2.36 NC1=CC2=C(C=C1)NC=N2 Z1741960823 [1,0,0,0,0,0|3,0,0]=4 37 B11R2.36 NC1=NC2=C(C=C1)NC=C2 Z1198224605 [1,0,0,0,0,0|3,0,0]=4 38 B11R2.36 NC1=NC2=C(C=N1)NC=N2 Z2786042704 [1,0,0,0,0,0|1,0,1]=3 39 B11R2.36 NC1=NC2=C(C=N1)NN=N2 Z3004423562 [1,0,0,0,0,0|2,0,1]=4 40 B11R2.36 OC1=CC2=C(C=C1)NC=N2 Z1042386518 [1,0,0,0,0,0|3,0,0]=4 41 B11R2.36 OC1=NC2=C(C=C1)NC=C2 Z1198317461 [1,0,0,0,0,0|3,0,0]=4 42 B11R2.106 ClC1=C2NC=CC2=NC=N1 Z1198169463 [1,0,0,0,0,0|2,0,1]=4 43 B11R2.106 ClC1=C2NC=NC2=NC=N1 Z295458158 [1,0,0,0,0,0|1,0,1]=3 44 B11R2.106 ClC1=C2OC=NC2=NC=N1 Z2732470170 [1,0,0,0,0,0|2,0,1]=4 45 B11R2.106 O=C1C=CN=C2N1NC=N2 Z1198279685 [1,0,0,0,0,0|2,0,0]=3 46 B11R2.106 O=C1N=CNC2=C1NC=C2 Z1198184375 [1,0,0,0,0,0|1,0,2]=4 47 B11R2.106 O=C1NC=CC2=C1NC=C2 Z1065582766 [1,0,0,0,0,0|2,0,0]=3 48 B11R2.106 O=C1NC=CC2=C1NN=C2 Z1203746870 [1,0,0,0,0,0|3,0,0]=4 49 B11R2.106 O=C1NC=CC2=C1SC=C2 Z1216812547 [1,0,0,0,0,0|3,0,0]=4 50 B11R2.106 O=C1NC=CC2=NC=CN12 Z1198149460 [1,0,0,0,0,0|3,0,0]=4 51 B11R2.106 O=C1NC=NC2=C1C=CS2 Z56761824 [1,0,0,0,0,0|2,0,0]=3 52 B11R2.106 O=C1NC=NC2=C1C=NN2 Z104486670 [1,0,0,0,0,0|2,0,1]=4 53 B11R2.106 O=C1NC=NC2=C1CCC2 Z813020070 [1,0,0,0,0,0|2,0,1]=4 54 B11R2.106 O=C1NC=NC2=C1N=CN2 Z1954805546 [1,0,0,0,0,0|0,0,2]=3 55 B11R2.106 O=C1NC=NC2=C1N=CS2 Z2757095244 [1,0,0,0,0,0|1,0,1]=3 56 B11R2.106 O=C1NC=NC2=C1SC=C2 Z166665672 [1,0,0,0,0,0|2,0,0]=3 57 B11R2.106 O=C1NC=NC2=CSC=C12 Z1198317463 [1,0,0,0,0,0|3,0,0]=4 58 B11R2.106 O=C1NC=NN2C1=CC=C2 Z1201626890 [1,0,0,0,0,0|3,0,0]=4 59 B11R2.106 O=C1NCCC2=C1NC=N2 Z1416161289 [1,0,0,0,0,0|1,0,1]=3 60 B11R2.106 O=C1NN=CC2=C1NC=C2 Z2732447311 [1,0,0,0,0,0|3,0,0]=4 61 B11R2.106 O=C1NN=CC2=C1SC=N2 Z2871986826 [1,0,0,0,0,0|3,0,0]=4 62 B11R2.106 O=C1NN=NC2=C1N=CN2 Z1203731027 [1,0,0,0,0,0|1,0,2]=4 63 B11R2.106 OC1=C2NC=CC2=NC=C1 Z1255400430 [1,0,0,0,0,0|2,0,1]=4 64 B11R2.106 OC1=C2NC=NC2=CC=N1 Z2692093689 [1,0,0,0,0,0|1,0,2]=4 65 B11R2.106 S=C1N=CNC2=C1NC=N2 Z2569252111 [1,0,0,0,0,0|0,1,2]=4 66 B13R2.654 CCC1=NC2=C(C=CS2)C(=O)N1 Z56761917 [0,1,0,0,0,0|3,0,0]=4 67 B13R2.654 O=C1NC(=NC2=C1C=CS2)CCl Z55164290 [0,1,0,0,0,0|2,1,0]=4 68 B13R2.654 O=C1NC(=NC2=C1SC=C2)CCl Z56943370 [0,1,0,0,0,0|2,1,0]=4 69 B13R2.3742 CC1=NC2=C(NC=C2Br)C(=O)N1 Z1269222567 [0,1,0,0,0,0|2,0,0]=3 70 B13R2.4899 CC1=NC2=C(C=CS2)C(=O)N1N Z85934644 [0,1,0,0,0,0|3,0,0]=4 71 B13R2.4899 CN1C(=O)C2=C(C=CS2)N=C1S Z168818402 [0,1,0,0,0,0|3,0,0]=4 72 B13R2.4899 CN1C(=O)C2=C(N=C1S)SC=C2 Z56907624 [0,1,0,0,0,0|3,0,0]=4 73 B13R2.4899 CN1C(=O)NC2=C(C1=O)NC=N2 Z1741978160 [0,1,0,0,0,0|1,0,1]=3 74 B13R2.5393 CN1C(=O)NC(=O)C2=C1N=CN2 Z1741977122 [0,1,0,0,0,0|1,0,1]=3 75 B13R2.5397 CC1=CC(=CC2=C1NC(=N2)C)Br Z1269190684 [0,1,0,0,0,0|3,0,0]=4 76 B13R2.5397 CC1=NC2=C(N1)C(=NC(=N2)N)N Z2900189094 [0,1,0,0,0,0|2,0,1]=4 77 B13R2.5397 NC1=NC2=C(N=C(N2)Br)C(=O)N1 Z5116562035 [0,1,0,0,0,0|1,0,2]=4 78 B13R2.5397 NC1=NC2=C(NC(=N2)S)C(=N1)O Z1198147829 [0,1,0,0,0,0|1,0,2]=4 79 B13R2.5397 O=C1NC(=NC2=C1N=C(N2)S)S Z56846778 [0,1,0,0,0,0|1,0,2]=4 80 B13R2.5397 O=C1NC(=O)C2=C(N1)NC(=O)N2 Z104473370 [0,1,0,0,0,0|1,0,2]=4 81 B13R2.5397 OC1=NC2=C(N1)C(=NC(=N2)Cl)Cl Z1269153052 [0,1,0,0,0,0|1,1,1]=4 82 B13R2.11642 CC1=CC2=C(C(=O)N1)N(C=C2)C Z1268632942 [0,1,0,0,0,0|3,0,0]=4 83 B13R2.11642 CC1=CSC2=C1C(=O)NC(=N2)C Z57011380 [0,1,0,0,0,0|3,0,0]=4 84 B13R2.11642 CC1=NC2=C(C(=N1)N)N(C=N2)C Z1262647585 [0,1,0,0,0,0|2,0,1]=4 85 B13R2.11642 CN1C=NC2=C1C(=CC(=N2)O)N Z5385693544 [0,1,0,0,0,0|3,0,0]=4 86 B13R2.11642 CN1C=NC2=C1C(=NC(=N2)Cl)Cl Z1269213709 [0,1,0,0,0,0|1,1,1]=4 87 B13R2.328 CC1=NC2=C(C=CC=C2)C(=O)N1 Z56895688 [0,0,0,0,0,1|3,0,0]=4 88 B13R2.328 CC1=NC2=C(C=CN=C2)C(=O)N1 Z1216862026 [0,0,0,0,0,1|2,0,0]=3 89 B13R2.328 CC1=NC2=C(CNCC2)C(=O)N1 Z4881514263 [0,0,0,0,0,1|2,0,1]=4 90 B13R2.328 NC1=NC2=C(C=CC=C2)C(=O)N1 Z840267872 [0,0,0,0,0,1|3,0,0]=4 91 B13R2.328 O=C1N=C2N=CNC=C2C(=O)N1 Z2732088541 [0,0,0,0,0,1|1,0,0]=2 92 B13R2.328 O=C1N=C2NC=CN=C2C(=O)N1 Z104494912 [0,0,0,0,0,1|1,0,2]=4 93 B13R2.328 O=C1NC(=NC2=C1C=CC=C2)S Z56998592 [0,0,0,0,0,1|3,0,0]=4 94 B13R2.328 O=C1NC(=NC2=C1N=CC=N2)S Z3300501458 [0,0,0,0,0,1|1,0,1]=3 95 B13R2.328 O=C1NC(=O)C2=C(N1)C=NC=C2 Z1198173337 [0,0,0,0,0,1|2,0,1]=4 96 B10R1.8 NCC1=CC(=O)NC(=N1)S Z2432667353 [1,0,1,0,0,0|1,0,1]=4 97 B10R1.39 O=CC1=C(NC=N1)C(=O)O Z2936387970 [1,0,1,0,0,0|2,0,0]=4 98 B10R2.7 C1=CC2=C(C=C1)NC=N2 Z57069879 [2,0,0,0,0,0|2,0,0]=4 99 B10R2.7 C1=CC2=C(C=N1)NC=N2 Z1117890443 [2,0,0,0,0,0|1,0,1]=4 100 B10R2.7 C1=NC2=C(N=C1)NC=N2 Z1198180623 [2,0,0,0,0,0|2,0,0]=4 101 B10R2.7 C1=NC=NC2=C1NC=N2 Z1203730725 [2,0,0,0,0,0|0,0,1]=3 102 B12R2.82 FC1=C2N=CNC2=CC=C1Br Z1509334088 [1,1,0,0,0,0|2,0,0]=4 103 B12R2.100 BrC1=C(C=C2NC=NC2=C1)Br Z3234801863 [1,1,0,0,0,0|2,0,0]=4 104 B12R2.606 CC1=NC2=C(N1)C=CC(=C2)Br Z382823070 [1,1,0,0,0,0|2,0,0]=4 105 B12R2.606 CC1=NC2=C(O1)C=CC(=N2)Br Z1269241013 [1,1,0,0,0,0|2,0,0]=4 106 B12R2.606 ClC1=NC2=C(C=N1)NC(=N2)Cl Z4358475013 [1,1,0,0,0,0|0,1,1]=4 107 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)Br Z1270207960 [1,1,0,0,0,0|2,0,0]=4 108 B12R2.612 CN1C=NC2=C1C=CC(=C2)Br Z1269186274 [1,1,0,0,0,0|2,0,0]=4 109 B12R2.612 CN1C=NC2=C1C=NC(=N2)Cl Z1486021884 [1,1,0,0,0,0|0,1,1]=4 110 B12R2.196 CC1=CSC2=C1N=CNC2=O Z1198152024 [1,1,0,0,0,0|2,0,0]=4 111 B12R2.196 O=C1NC=NC2=C1NC=C2Br Z1269131065 [1,1,0,0,0,0|1,0,0]=3 112 B12R2.202 CC1=C2NC(=NC2=NC=C1)S Z1255421050 [1,1,0,0,0,0|2,0,0]=4 113 B12R2.202 CC1=CC2=C(N1)C(=O)NC=N2 Z1203733729 [1,1,0,0,0,0|1,0,0]=3 114 B12R2.202 CC1=NC2=C(N1)C(=NC=N2)N Z3227156635 [1,1,0,0,0,0|1,0,1]=4 115 B12R2.202 CC1=NC2=C(O1)N=CNC2=O Z1198181245 [1,1,0,0,0,0|1,0,1]=4 116 B12R2.202 CN1C=C2C(=O)NC=NC2=N1 Z1509146244 [1,1,0,0,0,0|2,0,0]=4 117 B12R2.202 O=C1NC=NC2=C1C=C(S2)Br Z1269129141 [1,1,0,0,0,0|2,0,0]=4 118 B12R2.203 CC1=CSC2=C1C(=O)NC=N2 Z1198152023 [1,1,0,0,0,0|2,0,0]=4 119 B12R2.203 CN1C=CC2=C1C(=O)NC=C2 Z1170358515 [1,1,0,0,0,0|2,0,0]=4 120 B12R2.203 CN1C=NC2=C1C(=NC=N2)Cl Z1198159264 [1,1,0,0,0,0|1,0,1]=4 121 B12R2.203 CN1C=NC2=C1C(=NC=N2)N Z1203578068 [1,1,0,0,0,0|1,0,1]=4 122 B12R2.203 CN1C=NC2=C1C(=O)NC=N2 Z1694636463 [1,1,0,0,0,0|0,0,0]=2 123 B12R2.203 CN1C=NC2=C1C(=O)NCC2 Z1416186979 [1,1,0,0,0,0|1,0,1]=4 124 B12R2.315 CNC1=C2N=CN=C2N=CN1 Z1267881683 [1,1,0,0,0,0|1,0,1]=4 125 B12R2.315 NNC1=C2NC=NC2=NC=N1 Z295458316 [1,1,0,0,0,0|1,0,1]=4 126 B14R2.8235 NC1=CC2=C(N=C1)N=C(NC2=O)N Z2732088553 [0,1,0,0,0,1|2,0,0]=4 127 B14R2.587 CCNC1=NC2=C(NC=N2)C(=O)N1 Z2757407117 [0,2,0,0,0,0|1,0,0]=3 128 B14R2.2925 CN1C(=O)NC2=C(C1=O)NC(=N2)Cl Z1278925156 [0,2,0,0,0,0|1,0,1]=4 129 B14R2.5591 CN1C(=O)C2=C(N=CN2)N(C1=O)C Z203045518 [0,2,0,0,0,0|1,0,1]=4 130 B14R2.24376 CN1C=NC2=C1C(=O)N(C(=O)N2)C Z1255430986 [0,2,0,0,0,0|1,0,1]=4 131 B14R2.3994 CCN1C(=O)NC(=O)C2=C1N=CN2 Z1238571221 [0,2,0,0,0,0|1,0,1]=4 132 B14R2.5745 CN1C=NC2=C1C(=O)NC(=O)N2C Z56347209 [0,2,0,0,0,0|1,0,1]=4 133 B14R2.9026 CC1=NC2=C(N1)C(=O)NC(=O)N2C Z1255450597 [0,2,0,0,0,0|1,0,1]=4 134 B14R2.9026 CN1C(=O)NC(=O)C2=C1N=C(N2)N Z1262626804 [0,2,0,0,0,0|1,0,1]=4 135 B12R1.107 N=C(N)NC(=O)C1=NC=CN=C1 Z1740753750 [0,0,1,0,0,1|1,0,1]=4 136 B12R2.1081 O=C1NC=CC2=C1C=CC=N2 Z3227107005 [1,0,0,0,0,1|2,0,0]=4 137 B12R2.1081 O=C1NC=CC2=C1C=NC=N2 Z1203746699 [1,0,0,0,0,1|1,0,1]=4 138 B12R2.1081 O=C1NC=CC2=C1N=CC=N2 Z1203732948 [1,0,0,0,0,1|1,0,1]=4 139 B12R2.1081 O=C1NC=NC2=C1C=CC=C2 Z56862715 [1,0,0,0,0,1|2,0,0]=4 140 B12R2.1081 O=C1NC=NC2=C1C=CC=N2 Z227832770 [1,0,0,0,0,1|1,0,0]=3 141 B12R2.1081 O=C1NC=NC2=C1C=CN=C2 Z1198269947 [1,0,0,0,0,1|1,0,0]=3 142 B12R2.1081 O=C1NC=NC2=C1CNCC2 Z1834265872 [1,0,0,0,0,1|1,0,1]=4 143 B12R2.1081 O=C1NC=NC2=C1N=CC=N2 Z303761220 [1,0,0,0,0,1|0,0,1]=3