0 B11R2.106 BrC1=C2C=CNC2=CC=C1 XJ5630 [0,0,0,0,0,0|4,0,0]=4 1 B11R2.106 BrC1=C2C=CNC2=NC=C1 YH56066 [0,0,0,0,0,0|3,0,0]=3 2 B11R2.106 BrC1=C2C=NNC2=CC=C1 HL3747 [0,0,0,0,0,0|3,0,0]=3 3 B11R2.106 BrC1=C2NN=CC2=NC=C1 CJ2767 [0,0,0,0,0,0|4,0,0]=4 4 B11R2.106 BrC1=NC=NC2=C1NC=N2 YH17959 [0,0,0,0,0,0|3,0,1]=4 5 B11R2.106 CC1=C2N=NNC2=CC=C1 RT8360 [0,0,0,0,0,0|4,0,0]=4 6 B11R2.106 CC1=CC=CC2=C1C=CN2 XJ4238 [0,0,0,0,0,0|4,0,0]=4 7 B11R2.106 CC1=CC=NC2=C1C=CN2 YH88199 [0,0,0,0,0,0|3,0,0]=3 8 B11R2.106 CC1=NC=CC2=C1C=CN2 YH65921 [0,0,0,0,0,0|3,0,0]=3 9 B11R2.106 CC1=NC=NC2=C1NC=N2 RT18045 [0,0,0,0,0,0|3,0,1]=4 10 B11R2.106 ClC1=C2C=CN=C2NC=N1 LT6047 [0,0,0,0,0,0|2,0,2]=4 11 B11R2.106 ClC1=C2C=CN=C2NC=N1 RT8689 [0,0,0,0,0,0|2,0,2]=4 12 B11R2.106 ClC1=C2C=CNC2=CC=C1 JZ5661 [0,0,0,0,0,0|4,0,0]=4 13 B11R2.106 ClC1=C2C=CNC2=NC=C1 XJ5739 [0,0,0,0,0,0|3,0,0]=3 14 B11R2.106 ClC1=C2C=CNC2=NC=N1 RT9427 [0,0,0,0,0,0|2,0,0]=2 15 B11R2.106 ClC1=C2C=NNC2=NC=N1 HL2930 [0,0,0,0,0,0|1,0,0]=1 16 B11R2.106 ClC1=C2N=CNC2=NC=N1 RT18246 [0,0,0,0,0,0|3,0,0]=3 17 B11R2.106 ClC1=C2NC=NC2=NC=N1 RT18137 [0,0,0,0,0,0|3,0,1]=4 18 B11R2.106 ClC1=NC=CC2=C1C=CN2 XJ5889 [0,0,0,0,0,0|3,0,0]=3 19 B11R2.106 ClC1=NC=CC2=C1N=CN2 YH51444 [0,0,0,0,0,0|4,0,0]=4 20 B11R2.106 ClC1=NC=NC2=C1CSC2 YH05990 [0,0,0,0,0,0|3,0,1]=4 21 B11R2.106 FC1=C2C=CNC2=CC=C1 HL1724 [0,0,0,0,0,0|4,0,0]=4 22 B11R2.106 IC1=C2C=CNC2=NC=C1 YH54153 [0,0,0,0,0,0|3,0,0]=3 23 B11R2.106 IC1=C2C=NNC2=NC=C1 YH65588 [0,0,0,0,0,0|2,0,0]=2 24 B11R2.106 NC1=C2C=CNC2=CC=C1 LT2400 [0,0,0,0,0,0|4,0,0]=4 25 B11R2.106 NC1=C2C=NNC2=NC=N1 LX2034 [0,0,0,0,0,0|1,0,0]=1 26 B11R2.106 NC1=C2C=NNC2=NC=N1 YH44629 [0,0,0,0,0,0|1,0,0]=1 27 B11R2.106 NC1=C2N=CNC2=NC=N1 RT4454 [0,0,0,0,0,0|3,0,0]=3 28 B11R2.106 NC1=CC=CC2=C1C=CN2 RT10654 [0,0,0,0,0,0|4,0,0]=4 29 B11R2.106 NC1=NC=CC2=C1C=CN2 YH09388 [0,0,0,0,0,0|3,0,0]=3 30 B11R2.106 NC1=NC=NC2=C1C=CN2 LQ1778 [0,0,0,0,0,0|2,0,0]=2 31 B11R2.106 NC1=NC=NC2=C1N=CN2 LT3233 [0,0,0,0,0,0|3,0,0]=3 32 B11R2.106 NC1=NC=NC2=C1N=NN2 JZ1213 [0,0,0,0,0,0|2,0,0]=2 33 B11R2.106 O=C1N=CNC2=C1C=CN2 XJ2548 [0,0,0,0,0,0|1,0,2]=3 34 B11R2.106 O=C1N=CNC2=C1NN=C2 YH33713 [0,0,0,0,0,0|2,0,2]=4 35 B11R2.106 O=C1NC=CC2=C1C=CN2 YH06382 [0,0,0,0,0,0|2,0,2]=4 36 B11R2.106 OC1=C2C=CNC2=CC=C1 RT14408 [0,0,0,0,0,0|3,0,0]=3 37 B11R2.106 OC1=C2C=CNC2=NC=C1 YH16699 [0,0,0,0,0,0|2,0,0]=2 38 B11R2.106 OC1=C2C=NNC2=NC=N1 XJ0639 [0,0,0,0,0,0|0,0,0]=0 39 B11R2.106 OC1=C2N=CNC2=CC=C1 YH13030 [0,0,0,0,0,0|4,0,0]=4 40 B11R2.106 SC1=C2N=CNC2=NC=N1 RT18294 [0,0,0,0,0,0|2,1,0]=3 41 B11R2.106 SC1=NC=NC2=C1NC=N2 RT15277 [0,0,0,0,0,0|2,1,1]=4 42 B10R2.7 C1=CC2=C(C=C1)NC=C2 SY0038 [1,0,0,0,0,0|3,0,0]=4 43 B10R2.7 C1=CC2=C(C=C1)NN=N2 LQ0258 [1,0,0,0,0,0|3,0,0]=4 44 B10R2.7 C1=CC2=CN=CC=C2N1 LL0598 [1,0,0,0,0,0|2,0,0]=3 45 B10R2.7 C1=CC2=CN=CC=C2S1 RT10481 [1,0,0,0,0,0|3,0,0]=4 46 B10R2.7 C1=CC=C2NN=CC2=C1 LT1127 [1,0,0,0,0,0|2,0,0]=3 47 B10R2.7 C1=CN=C2NC=CC2=C1 LT6084 [1,0,0,0,0,0|2,0,0]=3 48 B12R2.82 CC1=C2C=CNC2=NC=C1Br YH25908 [0,1,0,0,0,0|3,0,0]=4 49 B12R2.82 ClC1=CN=C2NC=CC2=C1Cl YH25592 [0,1,0,0,0,0|3,0,0]=4 50 B12R2.82 NC1=C(Br)C=NC2=C1C=CN2 YH27389 [0,1,0,0,0,0|3,0,0]=4 51 B12R2.202 CC1=CC2=C(C=CC=C2O)N1 LT5867 [0,1,0,0,0,0|3,0,0]=4 52 B12R2.202 CC1=CC2=C(C=CN=C2Cl)N1 YH89929 [0,1,0,0,0,0|3,0,0]=4 53 B12R2.202 ClC1=NC=NC2=C1C=C(Br)N2 YH65903 [0,1,0,0,0,0|2,0,0]=3 54 B12R2.202 ClC1=NC=NC2=C1C=C(I)N2 YH91720 [0,1,0,0,0,0|2,0,0]=3 55 B12R2.202 NC1=NC2=NC=NC(O)=C2N1 RT18086 [0,1,0,0,0,0|2,0,1]=4 56 B12R2.203 CC1=CC=NC2=C1C(I)=CN2 YH27366 [0,1,0,0,0,0|3,0,0]=4 57 B12R2.203 CC1=CNC2=NC=NC(Cl)=C12 YH38003 [0,1,0,0,0,0|2,0,0]=3 58 B12R2.203 ClC1=C2C(Br)=NNC2=NC=N1 HL4934 [0,1,0,0,0,0|1,0,0]=2 59 B12R2.203 ClC1=C2C(I)=CNC2=NC=N1 HL3343 [0,1,0,0,0,0|2,0,0]=3 60 B12R2.203 ClC1=NC=NC2=C1C(Br)=CS2 YH19910 [0,1,0,0,0,0|3,0,0]=4 61 B12R2.203 FC1=CNC2=NC=NC(Cl)=C12 YH08379 [0,1,0,0,0,0|2,0,0]=3 62 B12R2.203 NC1=C2C(Br)=NNC2=NC=N1 YH88489 [0,1,0,0,0,0|1,0,0]=2 63 B12R2.203 NC1=C2C(I)=NNC2=NC=N1 YH36190 [0,1,0,0,0,0|1,0,0]=2 64 B12R2.203 NC1=NNC2=C1C(Br)=CC=C2 YH95304 [0,1,0,0,0,0|3,0,0]=4 65 B12R2.203 NC1=NNC2=C1C(Cl)=CC=C2 YH65741 [0,1,0,0,0,0|3,0,0]=4 66 B12R2.203 NC1=NNC2=C1C(I)=CC=C2 YH65857 [0,1,0,0,0,0|3,0,0]=4 67 B12R2.246 BrC1=CC(Br)=NC2=C1C=CN2 YH20076 [0,1,0,0,0,0|3,0,0]=4 68 B12R2.246 BrC1=CC2=C(C=NN2)C(I)=C1 YH92587 [0,1,0,0,0,0|3,0,0]=4 69 B12R2.246 CC1=C2C=CNC2=NC(Cl)=C1 YH03224 [0,1,0,0,0,0|3,0,0]=4 70 B12R2.246 CC1=NC(Cl)=C2C=NNC2=N1 YH66616 [0,1,0,0,0,0|1,0,0]=2 71 B12R2.246 ClC1=C2C=NNC2=CC(Br)=C1 YH92580 [0,1,0,0,0,0|3,0,0]=4 72 B12R2.246 ClC1=NC(Cl)=C2C=NNC2=N1 LX2359 [0,1,0,0,0,0|1,0,0]=2 73 B12R2.246 ClC1=NC(Cl)=C2N=CNC2=N1 RT15238 [0,1,0,0,0,0|3,0,0]=4 74 B12R2.246 FC1=NC2=C(N=CN2)C(Cl)=N1 HL0958 [0,1,0,0,0,0|3,0,0]=4 75 B12R2.246 NC1=C2C=NNC2=CC(Br)=C1 YH92576 [0,1,0,0,0,0|3,0,0]=4 76 B12R2.246 NC1=CC(Cl)=CC2=C1C=NN2 YH92585 [0,1,0,0,0,0|3,0,0]=4 77 B12R2.246 NC1=NC(Cl)=NC2=C1N=CN2 RT15179 [0,1,0,0,0,0|3,0,0]=4 78 B12R2.246 NC1=NC(F)=NC2=C1N=CN2 JZ4101 [0,1,0,0,0,0|3,0,0]=4 79 B12R2.246 NC1=NC2=C(C=CN2)C(=O)N1 LQ3282 [0,1,0,0,0,0|1,0,2]=4 80 B12R2.246 NC1=NC2=C(N=CN2)C(N)=N1 LT0166 [0,1,0,0,0,0|3,0,0]=4 81 B12R2.246 NC1=NC2=C(N=CN2)C(O)=N1 RT18126 [0,1,0,0,0,0|2,0,0]=3 82 B12R2.246 O=C1NC(=O)C2=C(NN=C2)N1 HL2239 [0,1,0,0,0,0|0,0,3]=4 83 B12R2.246 OC1=C2N=CNC2=NC(S)=N1 YH49316 [0,1,0,0,0,0|2,0,0]=3 84 B12R2.246 OC1=NC(O)=C2C=CNC2=N1 RT18203 [0,1,0,0,0,0|1,0,0]=2 85 B12R2.246 OC1=NC(O)=C2N=CSC2=N1 YH66640 [0,1,0,0,0,0|3,0,0]=4 86 B12R2.315 COC1=C2C=CNC2=CC=C1 JZ2637 [0,1,0,0,0,0|3,0,0]=4 87 B12R2.315 COC1=C2C=CNC2=NC=C1 YH28988 [0,1,0,0,0,0|2,0,0]=3 88 B12R2.315 COC1=NC=NC2=C1NC=N2 HL3818 [0,1,0,0,0,0|2,0,1]=4 89 B12R2.315 OCC1=CC=CC2=C1C=CN2 JZ4371 [0,1,0,0,0,0|3,0,0]=4 90 B10R1.2 CCC1=C(F)C(O)=NC=N1 RT10144 [0,0,1,0,0,0|3,0,0]=4 91 B10R1.4 NC1=NC=CC=C1\C=N\O LT3306 [0,0,1,0,0,0|3,0,0]=4 92 B10R1.4 N\N=C\C1=CC=CC=C1O XJ2447 [0,0,1,0,0,0|2,0,0]=3 93 B10R1.4 O\N=C/C1=C(O)C=CC=C1 JZ1751 [0,0,1,0,0,0|3,0,0]=4 94 B10R1.245 COC1=C(Cl)N=CN=C1N LT2669 [0,0,1,0,0,0|3,0,0]=4 95 B10R1.245 O=CC1=C(Cl)N=CN=C1Cl SY0243 [0,0,1,0,0,0|3,0,0]=4 96 B12R2.1081 ClC1=C2C=CC=CC2=NC=N1 YH04906 [0,0,0,0,0,1|3,0,0]=4 97 B12R2.1081 OC1=C2CCCCC2=NC=N1 YH43125 [0,0,0,0,0,1|2,0,1]=4 98 B12R2.1081 OC1=CC=NC2=CC=CC=C12 LT0931 [0,0,0,0,0,1|3,0,0]=4 99 B12R2.1081 OC1=CC=NC2=CC=CN=C12 YH06261 [0,0,0,0,0,1|3,0,0]=4 100 B12R2.1081 OC1=NC=CC2=CC=CC=C21 LL0870 [0,0,0,0,0,1|3,0,0]=4 101 B12R2.1081 OC1=NC=CC2=CC=CN=C21 YH13515 [0,0,0,0,0,1|3,0,0]=4 102 B12R2.1081 OC1=NC=NC2=CC=CC=C21 LL0872 [0,0,0,0,0,1|2,0,0]=3 103 B9R1.2 NNC1=CC(Cl)=NC=N1 YH08071 [1,0,1,0,0,0|1,0,1]=4 104 B9R1.3 CC1=C(Cl)N=CN=C1N LX2300 [1,0,1,0,0,0|1,0,1]=4 105 B9R1.3 NC1=C(N)C(O)=NC=C1 LQ4779 [1,0,1,0,0,0|1,0,1]=4 106 B9R1.3 NC1=C(O)N=CN=C1O YH14299 [1,0,1,0,0,0|1,0,1]=4 107 B9R1.3 NC1=NC=NC(N)=C1N LT6876 [1,0,1,0,0,0|1,0,1]=4 108 B9R1.3 NC1=NC=NC(N)=C1N YH27154 [1,0,1,0,0,0|1,0,1]=4 109 B9R1.3 NC1=NC=NC(O)=C1N RT3389 [1,0,1,0,0,0|0,0,1]=3 110 B9R1.3 NC1=NC=NC(O)=C1N XJ5632 [1,0,1,0,0,0|0,0,1]=3 111 B9R1.3 OC1=NC=NC(O)=C1Br LQ3903 [1,0,1,0,0,0|2,0,0]=4 112 B9R1.3 OC1=NC=NC(O)=C1F YH23466 [1,0,1,0,0,0|2,0,0]=4 113 B9R1.15 COC1=CN=CN=C1N LQ1357 [1,0,1,0,0,0|2,0,0]=4 114 B9R1.15 N#CC1=CN=CN=C1O JZ2594 [1,0,1,0,0,0|0,0,2]=4 115 B9R1.15 NC1=C(C=O)C=NC=C1 YH01035 [1,0,1,0,0,0|2,0,0]=4 116 B9R1.15 NC1=NC=CC=C1C=O LX3234 [1,0,1,0,0,0|2,0,0]=4 117 B9R1.41 NC1=C(C(=O)O)C=NN1 LT6718 [1,0,1,0,0,0|1,0,1]=4 118 B11R1.222 COC(=O)C1=C(O)N=CN=C1 JZ2595 [0,1,1,0,0,0|2,0,0]=4 119 B11R2.1 BrC1=CNC2=NC=CC=C12 RT16007 [1,1,0,0,0,0|2,0,0]=4 120 B11R2.1 BrC1=NNC2=CC=CC=C21 LX3057 [1,1,0,0,0,0|2,0,0]=4 121 B11R2.1 BrC1=NNC2=NC=CC=C12 YH13914 [1,1,0,0,0,0|1,0,0]=3 122 B11R2.1 CN1N=CC2=C1C=CC=C2 XJ3909 [1,1,0,0,0,0|2,0,0]=4 123 B11R2.1 IC1=NNC2=CC=CC=C21 YH12813 [1,1,0,0,0,0|2,0,0]=4 124 B11R2.1 ON1N=NC2=CC=CN=C21 LT2988 [1,1,0,0,0,0|2,0,0]=4 125 B11R2.10 BrC1=CC2=CC=CN=C2N1 YH65631 [1,1,0,0,0,0|2,0,0]=4 126 B11R2.36 BrC1=CC2=C(C=C1)C=NN2 YH19296 [1,1,0,0,0,0|2,0,0]=4 127 B11R2.36 BrC1=CC=C2NN=CC2=C1 LQ5299 [1,1,0,0,0,0|2,0,0]=4 128 B11R2.36 BrC1=CN=C2NC=CC2=C1 LT3515 [1,1,0,0,0,0|2,0,0]=4 129 B11R2.36 CC1=CC2=C(C=CN2)C=N1 YH65721 [1,1,0,0,0,0|2,0,0]=4 130 B11R2.36 ClC1=CC2=C(C=CN2)C=N1 YH17029 [1,1,0,0,0,0|2,0,0]=4 131 B11R2.36 ClC1=CC2=C(N=C1)NC=C2 YH90753 [1,1,0,0,0,0|2,0,0]=4 132 B11R2.36 ClC1=CC=C2C=NNC2=N1 YH11442 [1,1,0,0,0,0|1,0,0]=3 133 B11R2.36 ClC1=CC=C2NN=CC2=C1 YH14553 [1,1,0,0,0,0|2,0,0]=4 134 B11R2.36 ClC1=NC=C2C=CNC2=N1 LX2555 [1,1,0,0,0,0|1,0,0]=3 135 B11R2.36 ClC1=NC=C2NN=CC2=N1 YH66321 [1,1,0,0,0,0|2,0,0]=4 136 B11R2.36 FC1=CC2=C(C=C1)NN=C2 LQ0710 [1,1,0,0,0,0|2,0,0]=4 137 B11R2.36 FC1=CC=C2C=CNC2=N1 YH94122 [1,1,0,0,0,0|2,0,0]=4 138 B11R2.36 IC1=CC2=C(C=C1)C=NN2 YH50414 [1,1,0,0,0,0|2,0,0]=4 139 B11R2.36 IC1=CC2=C(C=C1)NN=C2 YH07148 [1,1,0,0,0,0|2,0,0]=4 140 B11R2.36 NC1=CC=C2C=NNC2=C1 XJ3181 [1,1,0,0,0,0|2,0,0]=4 141 B11R2.36 NC1=CC=C2NN=CC2=C1 JZ5353 [1,1,0,0,0,0|2,0,0]=4 142 B11R2.36 NC1=NC=C2N=CNC2=N1 JZ1008 [1,1,0,0,0,0|2,0,0]=4 143 B11R2.36 OC1=CC=C2NN=CC2=C1 LQ3862 [1,1,0,0,0,0|2,0,0]=4 144 B13R2.162 ClC1=NC=C2N=CN=C(Cl)C2=C1 YH39567 [0,1,0,0,0,1|2,0,0]=4 145 B13R2.328 ClC1=NC2=C(C=CN=C2)C(Cl)=N1 YH94730 [0,1,0,0,0,1|2,0,0]=4 146 B13R2.4857 CN1C=C(Br)C2=C(Cl)N=CN=C21 RT8760 [0,2,0,0,0,0|2,0,0]=4 147 B13R2.4857 CN1C=C(Br)C2=C(N)N=CN=C21 RT2187 [0,2,0,0,0,0|2,0,0]=4 148 B13R2.2091 CCC1=CNC2=NC=NC(Cl)=C12 YH20481 [0,2,0,0,0,0|2,0,0]=4 149 B13R2.11642 CC1=CNC2=NC(Cl)=NC(Cl)=C12 YH23291 [0,2,0,0,0,0|2,0,0]=4 150 B13R2.623 COC1=C2C=CNC2=NC(Cl)=N1 RT18147 [0,2,0,0,0,0|1,0,0]=3 151 B13R2.623 COC1=C2C=NNC2=CC(Br)=C1 YH92583 [0,2,0,0,0,0|2,0,0]=4 152 B13R2.623 COC1=NC(=O)NC2=C1C=CN2 RT18140 [0,2,0,0,0,0|1,0,1]=4 153 B13R2.654 COC1=NC(Cl)=C2C=CNC2=N1 RT18144 [0,2,0,0,0,0|2,0,0]=4 154 B13R2.5569 O=C(O)C1=C2C=NNC2=CC=C1 LX3152 [0,2,0,0,0,0|2,0,0]=4