0 B12R2.246 CC1=CC2=C(NC=C2)C(=O)N1 Z1255368377 [0,0,0,0,0,0|4,0,0]=4 1 B12R2.246 CC1=CN2N=CC=C2C(=O)N1 Z3301681831 [0,0,0,0,0,0|3,0,1]=4 2 B12R2.246 CC1=NC2=C(C=NN2)C(=O)N1 Z732618066 [0,0,0,0,0,0|2,0,2]=4 3 B12R2.246 ClC1=NC2=C(NC=N2)C(=N1)Cl Z1198147229 [0,0,0,0,0,0|3,0,1]=4 4 B12R2.246 NC1=C2NC=NC2=NC(=N1)Cl Z1741971500 [0,0,0,0,0,0|3,0,1]=4 5 B12R2.246 NC1=C2NC=NC2=NC(=N1)F Z1198269560 [0,0,0,0,0,0|3,0,1]=4 6 B12R2.246 NC1=NC(=C2CCCC2=N1)O Z2492774551 [0,0,0,0,0,0|1,0,3]=4 7 B12R2.246 NC1=NC(=C2CNCC2=N1)O Z4131026384 [0,0,0,0,0,0|2,0,2]=4 8 B12R2.246 NC1=NC(=O)C2=C(N1)N=CN2 Z256709612 [0,0,0,0,0,0|1,0,2]=3 9 B12R2.246 NC1=NC(=S)C2=C(N1)N=CN2 Z2299468139 [0,0,0,0,0,0|1,1,2]=4 10 B12R2.246 NC1=NC2=C(C=CN2)C(=C1)Br Z1269201323 [0,0,0,0,0,0|2,0,2]=4 11 B12R2.246 NC1=NC2=C(C=CN2)C(=N1)N Z3211701771 [0,0,0,0,0,0|1,0,3]=4 12 B12R2.246 NC1=NC2=C(C=CN2)C(=N1)O Z1198150171 [0,0,0,0,0,0|0,0,4]=4 13 B12R2.246 NC1=NC2=C(NC=N2)C(=N1)Cl Z2472857685 [0,0,0,0,0,0|2,0,1]=3 14 B12R2.246 O=C1CC2=C(C=CN2)C(=O)N1 Z1201626909 [0,0,0,0,0,0|2,0,2]=4 15 B12R2.246 O=C1CN2N=CC=C2C(=O)N1 Z4286165160 [0,0,0,0,0,0|3,0,1]=4 16 B12R2.246 O=C1NC(=NC2=C1C=CS2)S Z126620918 [0,0,0,0,0,0|2,0,1]=3 17 B12R2.246 O=C1NC(=NC2=C1C=NN2)Cl Z1587294678 [0,0,0,0,0,0|2,0,2]=4 18 B12R2.246 O=C1NC(=NC2=C1C=NN2)S Z198750874 [0,0,0,0,0,0|2,0,2]=4 19 B12R2.246 O=C1NC(=NC2=C1SC=C2)S Z315923754 [0,0,0,0,0,0|3,0,0]=3 20 B12R2.246 O=C1NC(=O)C2=C(N1)C=CN2 Z1198175553 [0,0,0,0,0,0|3,0,1]=4 21 B12R2.246 O=C1NC(=O)C2=C(N1)C=CS2 Z287017748 [0,0,0,0,0,0|3,0,1]=4 22 B12R2.246 O=C1NC(=O)C2=C(N1)CCC2 Z56871938 [0,0,0,0,0,0|2,0,2]=4 23 B12R2.246 O=C1NC(=O)C2=C(N1)NC=N2 Z57825360 [0,0,0,0,0,0|2,0,2]=4 24 B12R2.246 O=C1NC(=O)C2=C(N1)SC=N2 Z3241252485 [0,0,0,0,0,0|3,0,1]=4 25 B12R2.246 OC1=NC2=C(SC=N2)C(=N1)O Z1198729803 [0,0,0,0,0,0|2,0,2]=4 26 B11R2.36 ClC1=NC2=C(C=N1)NC=N2 Z2895166358 [1,0,0,0,0,0|2,0,1]=4 27 B11R2.36 NC1=CC2=C(C=C1)NC=N2 Z1741960823 [1,0,0,0,0,0|3,0,0]=4 28 B11R2.36 NC1=CC2=C(C=C1)SC=N2 Z425486860 [1,0,0,0,0,0|3,0,0]=4 29 B11R2.36 NC1=NC2=C(C=C1)CCC2 Z1198183883 [1,0,0,0,0,0|2,0,1]=4 30 B11R2.36 NC1=NC2=C(C=C1)NC=C2 Z1198224605 [1,0,0,0,0,0|3,0,0]=4 31 B11R2.36 NC1=NC2=C(C=CN2)C=C1 Z1198176781 [1,0,0,0,0,0|1,0,2]=4 32 B11R2.36 NC1=NC2=C(C=N1)CCC2 Z1137168278 [1,0,0,0,0,0|1,0,2]=4 33 B11R2.36 NC1=NC2=C(C=N1)NC=N2 Z2786042704 [1,0,0,0,0,0|1,0,1]=3 34 B11R2.36 NC1=NC2=C(C=N1)NN=N2 Z3004423562 [1,0,0,0,0,0|2,0,1]=4 35 B11R2.36 NC1=NC2=NC=CN2C=N1 Z4792440622 [1,0,0,0,0,0|1,0,2]=4 36 B11R2.106 ClC1=C2NC=NC2=NC=N1 Z295458158 [1,0,0,0,0,0|2,0,1]=4 37 B11R2.106 ClC1=C2OC=NC2=NC=N1 Z2732470170 [1,0,0,0,0,0|2,0,1]=4 38 B11R2.106 O=C1C=CN=C2N1NC=N2 Z1198279685 [1,0,0,0,0,0|3,0,0]=4 39 B11R2.106 O=C1NC=CC2=C1NC=C2 Z1065582766 [1,0,0,0,0,0|3,0,0]=4 40 B11R2.106 O=C1NC=CC2=C1SC=C2 Z1216812547 [1,0,0,0,0,0|3,0,0]=4 41 B11R2.106 O=C1NC=CC2=NC=CN12 Z1198149460 [1,0,0,0,0,0|2,0,1]=4 42 B11R2.106 O=C1NC=NC2=C1C=CS2 Z56761824 [1,0,0,0,0,0|1,0,1]=3 43 B11R2.106 O=C1NC=NC2=C1C=NN2 Z104486670 [1,0,0,0,0,0|1,0,2]=4 44 B11R2.106 O=C1NC=NC2=C1CCC2 Z813020070 [1,0,0,0,0,0|1,0,1]=3 45 B11R2.106 O=C1NC=NC2=C1N=CN2 Z1954805546 [1,0,0,0,0,0|1,0,1]=3 46 B11R2.106 O=C1NC=NC2=C1N=CS2 Z2757095244 [1,0,0,0,0,0|2,0,0]=3 47 B11R2.106 O=C1NC=NC2=C1SC=C2 Z166665672 [1,0,0,0,0,0|2,0,0]=3 48 B11R2.106 O=C1NC=NC2=CSC=C12 Z1198317463 [1,0,0,0,0,0|2,0,1]=4 49 B11R2.106 O=C1NC=NN2C1=CC=C2 Z1201626890 [1,0,0,0,0,0|2,0,1]=4 50 B11R2.106 O=C1NCCC2=C1NC=N2 Z1416161289 [1,0,0,0,0,0|2,0,1]=4 51 B11R2.106 O=C1NN=CC2=C1SC=N2 Z2871986826 [1,0,0,0,0,0|3,0,0]=4 52 B11R2.106 O=C1NN=NC2=C1N=CN2 Z1203731027 [1,0,0,0,0,0|2,0,1]=4 53 B13R2.654 CCC1=NC2=C(C=CS2)C(=O)N1 Z56761917 [0,1,0,0,0,0|2,0,1]=4 54 B13R2.654 NNC1=NC2=C(C=NN2)C(=O)N1 Z1154245615 [0,1,0,0,0,0|1,0,2]=4 55 B13R2.654 O=C1NC(=NC2=C1C=CS2)CCl Z55164290 [0,1,0,0,0,0|2,0,1]=4 56 B13R2.654 O=C1NC(=NC2=C1SC=C2)CCl Z56943370 [0,1,0,0,0,0|3,0,0]=4 57 B13R2.3742 CC1=NC2=C(NC=C2Br)C(=O)N1 Z1269222567 [0,1,0,0,0,0|3,0,0]=4 58 B13R2.4899 CC1=NC2=C(C=CS2)C(=O)N1N Z85934644 [0,1,0,0,0,0|2,0,1]=4 59 B13R2.4899 CN1C(=O)C2=C(C=CS2)N=C1S Z168818402 [0,1,0,0,0,0|3,0,0]=4 60 B13R2.4899 CN1C(=O)C2=C(N=C1S)SC=C2 Z56907624 [0,1,0,0,0,0|2,0,1]=4 61 B13R2.4899 CN1C(=O)NC2=C(C1=O)NC=N2 Z1741978160 [0,1,0,0,0,0|2,0,1]=4 62 B13R2.5393 CN1C(=O)NC(=O)C2=C1N=CN2 Z1741977122 [0,1,0,0,0,0|2,0,1]=4 63 B13R2.5397 CC1=NC2=C(N1)C(=NC(=N2)N)N Z2900189094 [0,1,0,0,0,0|2,0,1]=4 64 B13R2.5397 NC1=NC2=C(N=C(N2)Br)C(=O)N1 Z5116562035 [0,1,0,0,0,0|1,0,1]=3 65 B13R2.5397 NC1=NC2=C(NC(=N2)S)C(=N1)O Z1198147829 [0,1,0,0,0,0|1,0,2]=4 66 B13R2.5397 O=C1NC(=NC2=C1N=C(N2)S)S Z56846778 [0,1,0,0,0,0|2,0,1]=4 67 B13R2.11642 CC1=CSC2=C1C(=O)NC(=N2)C Z57011380 [0,1,0,0,0,0|2,0,1]=4 68 B11R1.34 CCCC1=CC(=O)NC(=N1)S Z56922173 [0,0,1,0,0,0|2,0,1]=4 69 B11R2.202 O=C1NC(=O)C2=C1CCC2 Z1255428736 [0,0,0,0,1,0|2,0,1]=4 70 B13R2.328 CC1=NC2=C(C=CC=C2)C(=O)N1 Z56895688 [0,0,0,0,0,1|2,0,1]=4 71 B13R2.328 CC1=NC2=C(C=CN=C2)C(=O)N1 Z1216862026 [0,0,0,0,0,1|1,0,1]=3 72 B13R2.328 CC1=NC2=C(CCCC2)C(=O)N1 Z57604142 [0,0,0,0,0,1|2,0,1]=4 73 B13R2.328 CC1=NC2=C(CCNC2)C(=O)N1 Z3244745140 [0,0,0,0,0,1|1,0,2]=4 74 B13R2.328 CC1=NC2=C(CNCC2)C(=O)N1 Z4881514263 [0,0,0,0,0,1|2,0,1]=4 75 B13R2.328 NC1=CC2=C(C=CC=C2)C(=O)N1 Z278202458 [0,0,0,0,0,1|2,0,1]=4 76 B13R2.328 NC1=NC2=C(C=CC=C2)C(=O)N1 Z840267872 [0,0,0,0,0,1|1,0,1]=3 77 B13R2.328 NC1=NC2=C(C=CC=C2)C(=O)O1 Z1198176566 [0,0,0,0,0,1|2,0,1]=4 78 B13R2.328 NC1=NC2=C(C=CC=N2)C(=N1)N Z1198159476 [0,0,0,0,0,1|1,0,2]=4 79 B13R2.328 NC1=NC2=C(CCCC2)C(=O)N1 Z813021734 [0,0,0,0,0,1|1,0,1]=3 80 B13R2.328 NC1=NC2=C(N=CC=N2)C(=N1)N Z1198148845 [0,0,0,0,0,1|1,0,2]=4 81 B13R2.328 O=C1N=C2N=CNC=C2C(=O)N1 Z2732088541 [0,0,0,0,0,1|1,0,1]=3 82 B13R2.328 O=C1N=C2NC=CN=C2C(=O)N1 Z104494912 [0,0,0,0,0,1|1,0,2]=4 83 B13R2.328 O=C1NC(=NC2=C1C=CC=C2)S Z56998592 [0,0,0,0,0,1|2,0,1]=4 84 B13R2.328 O=C1NC(=NC2=C1N=CC=N2)S Z3300501458 [0,0,0,0,0,1|1,0,1]=3 85 B13R2.328 O=C1NC(=O)C2=C(N1)C=NC=C2 Z1198173337 [0,0,0,0,0,1|1,0,2]=4 86 B10R1.8 CCC1=CC(=O)NC(=N1)S Z1742055054 [1,0,1,0,0,0|1,0,1]=4 87 B10R1.8 NC1=NC(=CC(=O)N1)CO Z1201625770 [1,0,1,0,0,0|1,0,1]=4 88 B10R1.22 CC1=C(C(=O)NC(=N1)S)C Z1603778708 [1,0,1,0,0,0|1,0,1]=4 89 B10R1.22 CC1=NC(=N)C(=C(N1)C)C Z1333043523 [1,0,1,0,0,0|2,0,0]=4 90 B10R2.7 C1=NC=NC2=C1NC=N2 Z1203730725 [2,0,0,0,0,0|1,0,1]=4 91 B12R1.103 N=C(N)NC(=O)C1=CC=C(O1)Cl Z3271809964 [0,1,1,0,0,0|2,0,0]=4 92 B12R1.233 NC1=NC=C(C(=O)N1)CC(=O)O Z5087129668 [0,1,1,0,0,0|1,0,0]=3 93 B12R1.1095 CC1=C(C(=O)NC(=N1)N)CCO Z1250132730 [0,1,1,0,0,0|1,0,1]=4 94 B12R2.606 NC1=NC2=C(C=C1)SC(=N2)N Z56761871 [1,1,0,0,0,0|2,0,0]=4 95 B12R2.196 CC1=CSC2=C1N=CNC2=O Z1198152024 [1,1,0,0,0,0|2,0,0]=4 96 B12R2.196 O=C1NC=NC2=C1NC=C2Br Z1269131065 [1,1,0,0,0,0|2,0,0]=4 97 B12R2.202 CC1=CC2=C(N1)C(=O)NC=N2 Z1203733729 [1,1,0,0,0,0|2,0,0]=4 98 B12R2.202 CC1=NC2=C(O1)N=CNC2=O Z1198181245 [1,1,0,0,0,0|2,0,0]=4 99 B12R2.202 CN1C=C2C(=O)NC=NC2=N1 Z1509146244 [1,1,0,0,0,0|1,0,1]=4 100 B12R2.202 O=C1NC=NC2=C1C=C(S2)Br Z1269129141 [1,1,0,0,0,0|1,0,1]=4 101 B12R2.203 CC1=CSC2=C1C(=O)NC=N2 Z1198152023 [1,1,0,0,0,0|1,0,1]=4 102 B12R2.203 CN1C=NC2=C1C(=O)NC=N2 Z1694636463 [1,1,0,0,0,0|1,0,0]=3 103 B12R2.315 CNC1=C2N=CN=C2N=CN1 Z1267881683 [1,1,0,0,0,0|2,0,0]=4 104 B14R2.1019 NCC1=NC2=C(COCC2)C(=O)N1 Z2739891522 [0,1,0,0,0,1|1,0,1]=4 105 B14R2.8235 NC1=CC2=C(N=C1)N=C(NC2=O)N Z2732088553 [0,1,0,0,0,1|0,0,1]=3 106 B14R2.587 CCNC1=NC2=C(NC=N2)C(=O)N1 Z2757407117 [0,2,0,0,0,0|1,0,0]=3 107 B14R2.587 CNCC1=NC2=C(SC=C2)C(=O)N1 Z44508065 [0,2,0,0,0,0|2,0,0]=4 108 B14R2.27750 CC1=C(C2=C(S1)N=C(NC2=O)N)C Z740300838 [0,2,0,0,0,0|1,0,1]=4 109 B12R1.107 N=C(N)NC(=O)C1=CC=CC=C1 Z1198149259 [0,0,1,0,0,1|1,0,1]=4 110 B12R1.107 N=C(N)NC(=O)C1=NC=CN=C1 Z1740753750 [0,0,1,0,0,1|0,0,1]=3 111 B12R2.1081 O=C1NC=CC2=C1C=CC=N2 Z3227107005 [1,0,0,0,0,1|1,0,1]=4 112 B12R2.1081 O=C1NC=CC2=C1C=NC=N2 Z1203746699 [1,0,0,0,0,1|1,0,1]=4 113 B12R2.1081 O=C1NC=CC2=C1N=CC=N2 Z1203732948 [1,0,0,0,0,1|1,0,1]=4 114 B12R2.1081 O=C1NC=NC2=C1C=CC=C2 Z56862715 [1,0,0,0,0,1|1,0,1]=4 115 B12R2.1081 O=C1NC=NC2=C1C=CC=N2 Z227832770 [1,0,0,0,0,1|0,0,1]=3 116 B12R2.1081 O=C1NC=NC2=C1C=CN=C2 Z1198269947 [1,0,0,0,0,1|0,0,1]=3 117 B12R2.1081 O=C1NC=NC2=C1CCCN2 Z1139192314 [1,0,0,0,0,1|0,0,2]=4 118 B12R2.1081 O=C1NC=NC2=C1CNCC2 Z1834265872 [1,0,0,0,0,1|1,0,1]=4 119 B12R2.1081 O=C1NC=NC2=C1COCC2 Z2418193688 [1,0,0,0,0,1|1,0,1]=4 120 B12R2.1081 O=C1NC=NC2=C1N=CC=N2 Z303761220 [1,0,0,0,0,1|0,0,1]=3 121 B12R2.1081 O=C1NC=NC2=C1SCCC2 Z1509209656 [1,0,0,0,0,1|1,0,1]=4