0 B12R2.1081 BrC1=C2C=NC=CC2=CC=C1 4108305 [0,0,0,0,0,0|3,0,0]=3 1 B12R2.1081 BrC1=NC=CC2=NC=CC=C12 4065156 [0,0,0,0,0,0|4,0,0]=4 2 B12R2.1081 NC1=C2C=CC=CC2=NC=N1 4031515 [0,0,0,0,0,0|4,0,0]=4 3 B12R2.1081 OC1=C2OCCOC2=CC=C1 4001963 [0,0,0,0,0,0|2,0,2]=4 4 B12R2.1081 OC1=CC=CC2=CN=CC=C12 4034700 [0,0,0,0,0,0|2,0,0]=2 5 B13R2.32 CC1=C(O)C2=NC=CC=C2C=C1 5175128 [0,1,0,0,0,0|0,0,0]=1 6 B13R2.32 CC1=C(O)C=CC2=CC=CC=C21 4021629 [0,1,0,0,0,0|2,0,0]=3 7 B13R2.32 ClC1=C2C=CC=CC2=NC=C1Br 4031465 [0,1,0,0,0,0|3,0,0]=4 8 B13R2.32 OC1=C2N=CC=CC2=CC=C1F 4102020 [0,1,0,0,0,0|0,0,0]=1 9 B13R2.162 CC1=CC=C2N=CC=C(O)C2=C1 4040203 [0,1,0,0,0,0|2,0,0]=3 10 B13R2.162 ClC1=CC=C2N=CC=C(Cl)C2=C1 4029008 [0,1,0,0,0,0|3,0,0]=4 11 B13R2.162 ClC1=CC=NC2=CC=C(Br)C=C12 4043700 [0,1,0,0,0,0|3,0,0]=4 12 B13R2.162 NC1=CC=C2OC=CC(=O)C2=C1 4041500 [0,1,0,0,0,0|2,0,1]=4 13 B13R2.162 NC1=CC=NC2=C1C=C(Cl)C=C2 4014445 [0,1,0,0,0,0|3,0,0]=4 14 B13R2.162 NC1=CC=NC2=CC=C(F)C=C12 4029606 [0,1,0,0,0,0|3,0,0]=4 15 B13R2.328 CC1=CC(Br)=NC2=CC=CC=C12 4049766 [0,1,0,0,0,0|3,0,0]=4 16 B13R2.328 ClC1=CC(Br)=C2N=CC=CC2=C1 4108967 [0,1,0,0,0,0|1,0,0]=2 17 B13R2.328 ClC1=CC(Cl)=NC2=CC=CC=C12 4043546 [0,1,0,0,0,0|3,0,0]=4 18 B13R2.328 O=C1C=C(Cl)C2=CC=CC=C2N1 4001693 [0,1,0,0,0,0|3,0,0]=4 19 B13R2.328 OC1=CC2=CC=CC=C2C(Br)=C1 4038940 [0,1,0,0,0,0|2,0,0]=3 20 B13R2.342 NC1=C2C=CC=C(Br)C2=NC=C1 4031865 [0,1,0,0,0,0|1,0,0]=2 21 B13R2.342 NC1=CC=NC2=C(Cl)C=CC=C12 4027613 [0,1,0,0,0,0|1,0,0]=2 22 B13R2.342 NC1=CC=NC2=C(F)C=CC=C12 4030186 [0,1,0,0,0,0|1,0,0]=2 23 B13R2.371 CC1=CC=C(N)C2=CC=CN=C12 4041467 [0,1,0,0,0,0|1,0,0]=2 24 B13R2.371 CC1=CC=C(O)C2=C1C=CC=N2 5511450 [0,1,0,0,0,0|0,0,0]=1 25 B13R2.371 NC1=C2C=CC=NC2=C(Cl)C=C1 4029311 [0,1,0,0,0,0|1,0,0]=2 26 B13R2.371 NC1=CC=C(N)C2=CC=CC=C12 4041066 [0,1,0,0,0,0|2,0,0]=3 27 B13R2.371 NC1=CC=C(N)C2=CC=CC=C12 4088282 [0,1,0,0,0,0|2,0,0]=3 28 B13R2.371 OC1=NN=C(Cl)C2=CC=CC=C21 4027407 [0,1,0,0,0,0|3,0,0]=4 29 B13R2.1613 C(=O)C1=CC=CC2=C1C=CC=N2 4300479 [0,1,0,0,0,0|2,0,1]=4 30 B13R2.1613 C(=O)C1=CC=CC2=C1N=CC=C2 4300502 [0,1,0,0,0,0|0,0,1]=2 31 B13R2.1613 NNC1=CC=CC2=C1N=CC=C2 4100060 [0,1,0,0,0,0|1,0,0]=2 32 B13R2.1613 NNC1=NC=CC2=CC=CC=C21 4033979 [0,1,0,0,0,0|3,0,0]=4 33 B13R2.1613 NNC1=NC=CC2=CC=CC=C21 4090099 [0,1,0,0,0,0|3,0,0]=4 34 B13R2.1613 O=CC1=C2C=CN=CC2=CC=C1 4301909 [0,1,0,0,0,0|2,0,1]=4 35 B13R2.1613 OCC1=C2C=CC=NC2=CC=C1 4900508 [0,1,0,0,0,0|2,0,0]=3 36 B13R2.1613 OCC1=C2N=CC=CC2=CC=C1 4001998 [0,1,0,0,0,0|0,0,0]=1 37 B13R2.5179 CC1=CC=C2C(N)=CC=CC2=N1 4100117 [0,1,0,0,0,0|3,0,0]=4 38 B13R2.5179 O=C1C=CC2=C(Cl)C=CC=C2N1 4037741 [0,1,0,0,0,0|3,0,0]=4 39 B13R2.5179 O=C1C=COC2=CC(Br)=CC=C12 4045139 [0,1,0,0,0,0|2,0,1]=4 40 B11R1.17 C=CCOC1=CC=CC=C1N 4023578 [0,0,1,0,0,0|2,0,1]=4 41 B11R2.1 BrC1=C2N=CC=CN2N=C1 4045097 [0,0,0,0,1,0|3,0,0]=4 42 B11R2.1 IC1=C2N=CC=CN2N=C1 4086693 [0,0,0,0,1,0|3,0,0]=4 43 B11R2.1 O=C1NCC2=CC=CN=C12 4037457 [0,0,0,0,1,0|1,0,2]=4 44 B11R2.106 BrC1=C2SC=CC2=CC=C1 4029546 [0,0,0,0,1,0|2,0,0]=3 45 B11R2.106 BrC1=CC=CC2=CC=NN12 4037793 [0,0,0,0,1,0|2,0,0]=3 46 B11R2.106 BrC1=CC=CN2C=CN=C12 4108270 [0,0,0,0,1,0|2,0,0]=3 47 B11R2.106 CC1=C2C=CNC2=CC=C1 4036770 [0,0,0,0,1,0|2,0,0]=3 48 B11R2.106 CC1=C2C=NNC2=CC=C1 4028681 [0,0,0,0,1,0|3,0,0]=4 49 B11R2.106 CC1=C2NN=CC2=CC=C1 4026959 [0,0,0,0,1,0|2,0,1]=4 50 B11R2.106 CC1=CC=CC2=C1C=CN2 3020087 [0,0,0,0,1,0|2,0,0]=3 51 B11R2.106 ClC1=C2C=NNC2=CC=C1 4027063 [0,0,0,0,1,0|3,0,0]=4 52 B11R2.106 NC1=C2N=NNC2=CC=C1 4035802 [0,0,0,0,1,0|3,0,0]=4 53 B11R2.106 NC1=C2N=NNC2=CC=C1 4090246 [0,0,0,0,1,0|3,0,0]=4 54 B11R2.106 NC1=CC=CC2=C1C=NN2 4029340 [0,0,0,0,1,0|3,0,0]=4 55 B11R2.106 NC1=CC=CC2=C1NN=C2 4028875 [0,0,0,0,1,0|2,0,1]=4 56 B11R2.106 NC1=CC=CC2=NC=NN12 4038923 [0,0,0,0,1,0|3,0,0]=4 57 B11R2.106 NC1=CC=CN2C=NN=C12 4041518 [0,0,0,0,1,0|3,0,0]=4 58 B11R2.106 NC1=CC=CN2N=CN=C12 4031194 [0,0,0,0,1,0|3,0,0]=4 59 B11R2.106 OC1=C2N=COC2=CC=C1 4032023 [0,0,0,0,1,0|1,0,0]=2 60 B11R2.106 OC1=CC=CN2N=CN=C12 4038681 [0,0,0,0,1,0|2,0,0]=3 61 B10R1.17 C=CCCC1=CC=CN=C1 4073007 [1,0,1,0,0,0|0,0,2]=4 62 B10R1.17 NC\C=C\C1=CC=CC=C1 4027604 [1,0,1,0,0,0|0,0,2]=4 63 B12R1.121 C=CCOC1=CC=CC=C1CO 9071818 [0,1,1,0,0,0|1,0,1]=4 64 B12R1.226 NC1=CC=CC(\C=C\C(=O)O)=C1 5139503 [0,1,1,0,0,0|2,0,0]=4 65 B12R2.24 BrC1=CC2=C(C=C1)C=NC=N2 4108282 [1,1,0,0,0,0|1,0,0]=3 66 B12R2.24 BrC1=CC=C2C=NC=CC2=C1 4108320 [1,1,0,0,0,0|2,0,0]=4 67 B12R2.24 BrC1=CN=C2N=CC=NC2=C1 4029583 [1,1,0,0,0,0|2,0,0]=4 68 B12R2.24 NC1=CC=C2C=CC=NC2=C1 4018528 [1,1,0,0,0,0|0,0,0]=2 69 B12R2.24 NC1=CC=C2N=CC=NC2=C1 4100080 [1,1,0,0,0,0|1,0,0]=3 70 B12R2.196 CN1C=CC2=C(Cl)C=CN=C21 4038240 [0,1,0,0,1,0|2,0,0]=4 71 B12R2.202 CC1=C2N=C(N)NC2=CC=C1 4036205 [0,1,0,0,1,0|2,0,0]=4 72 B12R2.202 CC1=C2N=C(N)OC2=CC=C1 4036192 [0,1,0,0,1,0|2,0,0]=4 73 B12R2.202 CC1=CC2=C(O1)C(N)=CC=C2 4013734 [0,1,0,0,1,0|2,0,0]=4 74 B12R2.202 CC1=NC2=C(C=CC=C2N)N1 4041591 [0,1,0,0,1,0|2,0,0]=4 75 B12R2.202 CC1=NC2=C(C=CC=C2O)N1 4072824 [0,1,0,0,1,0|1,0,0]=3 76 B12R2.202 NC1=NC2=C(F)C=CC=C2S1 4012611 [0,1,0,0,1,0|2,0,0]=4 77 B12R2.246 CC1=CC(Br)=CN2C=CN=C12 4029826 [0,1,0,0,1,0|2,0,0]=4 78 B12R2.315 COC1=C2C=CNC2=CC=C1 4036775 [0,1,0,0,1,0|1,0,0]=3 79 B12R2.315 NCC1=C2C=CNC2=CC=C1 4003293 [0,1,0,0,1,0|2,0,0]=4 80 B12R2.315 O=CC1=CC=CC2=CC=NN12 4036813 [0,1,0,0,1,0|1,0,1]=4 81 B12R2.315 OCC1=CC=CC2=CC=NN21 4038083 [0,1,0,0,1,0|1,0,0]=3 82 B12R2.315 OCC1=CC=CC2=NC=NN12 4037237 [0,1,0,0,1,0|2,0,0]=4 83 B14R2.8038 CC1=CC=C2C(N)=CC=NC2=C1C 4043802 [0,2,0,0,0,0|1,0,0]=3 84 B14R2.28523 CC1=[N+]([O-])C2=C(C=CC=C2O)C=C1 5175127 [0,2,0,0,0,0|0,0,1]=3 85 B14R2.142 CNC1=NC2=C(C=CC=C2O)C=C1 5175081 [0,2,0,0,0,0|0,0,0]=2 86 B14R2.142 COC1=NC2=C(C=CC=C2O)C=C1 5175101 [0,2,0,0,0,0|0,0,0]=2 87 B14R2.142 O=CC1=NC2=C(Cl)C=CC=C2C=C1 4003793 [0,2,0,0,0,0|1,0,0]=3 88 B14R2.142 O=CC1=NC2=C(F)C=CC=C2C=C1 4003787 [0,2,0,0,0,0|1,0,0]=3 89 B14R2.8045 CC1=C2N=CC=C(Cl)C2=CC(Cl)=C1 4040697 [0,2,0,0,0,0|1,0,0]=3 90 B14R2.8045 CC1=C2NC(=O)C=C(O)C2=CC=C1 6631006 [0,2,0,0,0,0|1,0,1]=4 91 B14R2.8045 CC1=CC(C)=C2N=CC=C(Cl)C2=C1 4040722 [0,2,0,0,0,0|1,0,0]=3 92 B14R2.8045 CC1=CC(C)=C2N=CC=C(N)C2=C1 4027926 [0,2,0,0,0,0|1,0,0]=3 93 B14R2.8045 CC1=CC(C)=NC2=[N+]1C=CC=C2O 5110232 [0,2,0,0,0,0|1,0,0]=3 94 B14R2.8045 CC1=NC2=C(C=CC=C2Br)C(O)=C1 4031944 [0,2,0,0,0,0|1,0,0]=3 95 B14R2.8045 CC1=NC2=C(F)C=CC=C2C(N)=C1 4029892 [0,2,0,0,0,0|1,0,0]=3 96 B14R2.8045 FC1=CC(F)=C2N=CC=C(Cl)C2=C1 4043655 [0,2,0,0,0,0|1,0,0]=3 97 B14R2.8235 CC1=NC2=C(C=C(Br)C=C2)C(O)=C1 4031252 [0,2,0,0,0,0|2,0,0]=4 98 B14R2.8751 CC1=CC=C(O)C2=C1C=CC(C)=N2 5175124 [0,2,0,0,0,0|0,0,0]=2 99 B14R2.11684 COC1=C2N=C(Cl)C=CC2=CC=C1 4902078 [0,2,0,0,0,0|0,0,0]=2 100 B14R2.1019 O=CC1=NC2=CC=CC=C2C(O)=C1 4014212 [0,2,0,0,0,0|2,0,0]=4 101 B14R2.1078 CC1=C2N=CC=C(NN)C2=CC=C1 4043548 [0,2,0,0,0,0|1,0,0]=3 102 B14R2.1131 CC1=C2N=CC=CC2=C(C=O)C=C1 4003229 [0,2,0,0,0,0|1,0,0]=3 103 B14R2.1131 COC1=C2N=CC=CC2=C(Br)C=C1 4031227 [0,2,0,0,0,0|0,0,0]=2 104 B14R2.1131 COC1=C2N=CC=CC2=C(Br)C=C1 4087919 [0,2,0,0,0,0|0,0,0]=2 105 B14R2.1131 OCC1=C2C=CC=NC2=C(O)C=C1 3002351 [0,2,0,0,0,0|0,0,0]=2 106 B14R2.7150 CNCC1=C2N=CC=CC2=CC=C1 4087974 [0,2,0,0,0,0|1,0,0]=3 107 B14R2.7150 CNCC1=C2N=CC=CC2=CC=C1 4102205 [0,2,0,0,0,0|1,0,0]=3 108 B14R2.31359 OB(O)C1=C2C=CN=CC2=CC=C1 4002849 [0,2,0,0,0,0|2,0,0]=4 109 B14R2.31359 OB(O)C1=C2N=CC=CC2=CC=C1 4202094 [0,2,0,0,0,0|0,0,0]=2 110 B12R2.2 C1=CN=C(C2=NC=CN2)C=C1 4029641 [0,0,1,1,0,0|2,0,0]=4 111 B12R2.32 C=CC1=NC2=C(C=CC=C2)N1 4025542 [0,0,1,1,0,0|1,0,0]=3 112 B12R2.32 NCC1=NC2=CC=CC=C2O1 4101049 [0,0,1,1,0,0|1,0,1]=4 113 B12R2.32 NNC1=NC2=C(C=CC=C2)O1 4100001 [0,0,1,1,0,0|2,0,0]=4 114 B12R2.32 O=CC1=NC2=C(C=CC=C2)N1 4300303 [0,0,1,1,0,0|2,0,0]=4 115 B10R2.7 C1=CC2=CC=NC=C2N1 4108319 [1,0,0,0,1,0|1,0,1]=4 116 B10R2.7 C1=CN=C2NN=CC2=C1 4031574 [1,0,0,0,1,0|2,0,0]=4