0 B11R1.22 CNC(=O)C1=NC=C(Br)C=C1 AM11488 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 AM10066 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.22 COC(=O)C1=CN=C(Cl)C=C1 AM11430 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.22 COC(=O)C1=CN=C(I)C=C1 AM11471 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.22 COC(=O)C1=CN=C(N)C=C1 AM11427 [0,0,0,0,0,0|2,0,0]=2 5 B11R1.22 COC(=O)C1=CN=C(O)C=C1 AM11431 [0,0,0,0,0,0|1,0,0]=1 6 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 AM10311 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.22 COC(=O)C1=NC=C(N)C=C1 AM11583 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.13 CC(=O)C1=CC=C(Br)C=N1 AM10561 [1,0,0,0,0,0|2,0,0]=3 9 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 AM11101 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.13 CC(=O)C1=CN=C(C)C=C1 AM10774 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.13 CC(=O)C1=NC=C(C)C=C1 AM10819 [1,0,0,0,0,0|2,0,0]=3 12 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 AM10818 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.13 CC(C)C1=CC=C(O)C=N1 AM11537 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.13 CC1=CN=C(C(=O)O)C=C1 AM11347 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.13 CC1=NC=C(C(N)=O)C=C1 AM10338 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.13 NC(=O)C1=CN=C(Br)C=C1 AM11365 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 AM11375 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 AM10978 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.13 NC(=O)C1=NC=C(N)C=C1 AM11545 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.13 NC(=O)C1=NC=C(O)C=C1 AM11776 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.13 NC1=CN=C(C(=O)O)C=C1 AM11266 [1,0,0,0,0,0|2,0,0]=3 22 B10R1.13 NC1=CN=C(C(=O)O)C=C1 AM11510 [1,0,0,0,0,0|2,0,0]=3 23 B10R1.13 NC1=NC=C(C(=O)O)C=C1 AM11360 [1,0,0,0,0,0|2,0,0]=3 24 B10R1.13 O=C(Cl)C1=CN=C(Cl)C=C1 AM11376 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.13 O=C(O)C1=CC=C(Br)N=C1 AM10062 [1,0,0,0,0,0|2,0,0]=3 26 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 AM10442 [1,0,0,0,0,0|2,0,0]=3 27 B10R1.13 O=C(O)C1=CN=C(F)C=C1 AM10117 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.13 O=C(O)C1=CN=C(O)C=C1 AM10755 [1,0,0,0,0,0|1,0,0]=2 29 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 AM10459 [1,0,0,0,0,0|2,0,0]=3 30 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 AM11322 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.13 O=C(O)C1=NC=C(F)C=C1 AM11332 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.13 O=C(O)C1=NC=C(O)C=C1 AM11340 [1,0,0,0,0,0|1,0,0]=2 33 B10R1.13 O=[N+]([O-])C1=CN=C(O)C=C1 AM10145 [1,0,0,0,0,0|2,0,1]=4 34 B10R1.15 O=NC(=O)C1=CN=CC=C1 AM10407 [1,0,0,0,0,0|3,0,0]=4 35 B12R1.5 COC(=O)C1=NC=C(C#N)C=C1 AM11764 [0,1,0,0,0,0|2,0,0]=3 36 B12R1.16 CCNC(=O)C1=NC=C(Br)C=C1 AM11489 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.16 CCOC(=O)C1=CN=C(N)C=C1 AM11399 [0,1,0,0,0,0|2,0,0]=3 38 B12R1.16 CCOC(=O)C1=NC=C(Br)C=C1 AM11392 [0,1,0,0,0,0|2,0,0]=3 39 B12R1.16 CCOC(=O)C1=NC=C(Cl)C=C1 AM11397 [0,1,0,0,0,0|2,0,0]=3 40 B12R1.20 CN(C)C(=O)C1=NC=C(Br)C=C1 AM11486 [0,1,0,0,0,0|3,0,0]=4 41 B12R1.367 COC(=O)C1=CC(Br)=C(Cl)N=C1 AM11423 [0,1,0,0,0,0|2,0,0]=3 42 B12R1.367 COC(=O)C1=CC(N)=C(Cl)N=C1 AM11514 [0,1,0,0,0,0|2,0,0]=3 43 B12R1.367 COC(=O)C1=CN=C(Br)C(Br)=C1 AM10401 [0,1,0,0,0,0|2,0,0]=3 44 B12R1.367 COC(=O)C1=CN=C(N)C(Br)=C1 AM11426 [0,1,0,0,0,0|2,0,0]=3 45 B12R1.367 COC(=O)C1=NC(N)=C(Br)C=C1 AM11529 [0,1,0,0,0,0|2,0,0]=3 46 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1Cl AM11410 [0,1,0,0,0,0|2,0,0]=3 47 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1C AM11546 [0,1,0,0,0,0|2,0,0]=3 48 B12R1.49 COC(=O)NC1=NC=C(Br)C=C1 AM11653 [0,0,0,0,0,1|2,0,0]=3 49 B9R1.1 COC1=CC=[N+]([O-])C=C1 AM10731 [2,0,0,0,0,0|1,0,1]=4 50 B9R1.1 COC1=CN=C(Br)C=C1 AM10285 [2,0,0,0,0,0|2,0,0]=4 51 B9R1.1 COC1=CN=C(C)C=C1 AM11346 [2,0,0,0,0,0|2,0,0]=4 52 B9R1.1 COC1=CN=C(Cl)C=C1 AM10601 [2,0,0,0,0,0|2,0,0]=4 53 B9R1.1 COC1=NC=C(Br)C=C1 AM10295 [2,0,0,0,0,0|2,0,0]=4 54 B9R1.1 COC1=NC=C(Cl)C=C1 AM10670 [2,0,0,0,0,0|2,0,0]=4 55 B9R1.1 COC1=NC=C(F)C=C1 AM10027 [2,0,0,0,0,0|2,0,0]=4 56 B9R1.1 COC1=NC=C(I)C=C1 AM10673 [2,0,0,0,0,0|2,0,0]=4 57 B9R1.1 COC1=NC=C(N)C=C1 AM10030 [2,0,0,0,0,0|2,0,0]=4 58 B9R1.1 COC1=NC=C(O)C=C1 AM11337 [2,0,0,0,0,0|1,0,0]=3 59 B9R1.1 O=CC1=NC=C(Br)C=C1 AM11306 [2,0,0,0,0,0|2,0,0]=4 60 B9R1.6 CC(=O)C1=CC=CN=C1 AM10949 [2,0,0,0,0,0|1,0,0]=3 61 B9R1.6 CC(=O)C1=CC=NC=C1 AM10950 [2,0,0,0,0,0|1,0,0]=3 62 B9R1.6 CC(=O)C1=NC=CC=C1 AM10450 [2,0,0,0,0,0|1,0,0]=3 63 B9R1.6 O=C(Cl)C1=CN=CC=C1 AM10464 [2,0,0,0,0,0|2,0,0]=4 64 B9R1.6 O=C(O)C1=CC=CN=C1 AM11050 [2,0,0,0,0,0|1,0,0]=3 65 B9R1.6 O=C(O)C1=NC=CC=C1 AM11049 [2,0,0,0,0,0|1,0,0]=3 66 B11R1.3 COC1=CN=C(C(=O)O)C=C1 AM11345 [1,1,0,0,0,0|1,0,0]=3 67 B11R1.3 COC1=NC=C(C(=O)O)C=C1 AM11437 [1,1,0,0,0,0|1,0,0]=3 68 B11R1.3 COC1=NC=C(C(C)=O)C=C1 AM11442 [1,1,0,0,0,0|1,0,0]=3 69 B11R1.3 N#CC1=CN=C(C(=O)O)C=C1 AM11763 [1,1,0,0,0,0|2,0,0]=4 70 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 AM10738 [1,1,0,0,0,0|2,0,0]=4 71 B11R1.19 O=S(=O)(O)C1=CC=C(O)N=C1 AM11381 [1,1,0,0,0,0|2,0,0]=4 72 B11R1.19 O=S(=O)(O)C1=NC=C(O)C=C1 AM11341 [1,1,0,0,0,0|2,0,0]=4 73 B11R1.21 CC(=O)C1=CN=C(Br)C(C)=C1 AM11258 [1,1,0,0,0,0|2,0,0]=4 74 B11R1.21 CC(=O)C1=CN=C(Cl)C(Cl)=C1 AM11257 [1,1,0,0,0,0|2,0,0]=4 75 B11R1.21 CC1=CC(C(=O)O)=CN=C1F AM10515 [1,1,0,0,0,0|2,0,0]=4 76 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=N1 AM11758 [1,1,0,0,0,0|2,0,0]=4 77 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=N1 AM10212 [1,1,0,0,0,0|2,0,0]=4 78 B11R1.21 O=C(O)C1=CN=C(Cl)C(Br)=C1 AM11299 [1,1,0,0,0,0|2,0,0]=4 79 B11R1.21 O=C(O)C1=CN=C(Cl)C(Cl)=C1 AM10025 [1,1,0,0,0,0|2,0,0]=4 80 B11R1.21 O=C(O)C1=CN=C(O)C(Br)=C1 AM11302 [1,1,0,0,0,0|1,0,0]=3 81 B11R1.21 O=C(O)C1=CN=C(O)C(Cl)=C1 AM10754 [1,1,0,0,0,0|1,0,0]=3 82 B11R1.21 O=C(O)C1=NC=C(F)C(Cl)=C1 AM11770 [1,1,0,0,0,0|2,0,0]=4 83 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 AM11752 [1,1,0,0,0,0|1,0,0]=3 84 B11R1.166 CC1=C(C(=O)O)C=CC(N)=N1 AM11356 [1,1,0,0,0,0|2,0,0]=4 85 B11R1.166 CC1=CC(Br)=CN=C1C(=O)O AM11550 [1,1,0,0,0,0|2,0,0]=4 86 B11R1.166 CC1=CC(F)=NC=C1C(=O)O AM10482 [1,1,0,0,0,0|2,0,0]=4 87 B11R1.166 CC1=CC(N)=NC=C1C(=O)O AM10531 [1,1,0,0,0,0|2,0,0]=4 88 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 AM10519 [1,1,0,0,0,0|2,0,0]=4 89 B11R1.166 CC1=NC(O)=C(C(=O)O)C=C1 AM10385 [1,1,0,0,0,0|2,0,0]=4 90 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O AM11576 [1,1,0,0,0,0|2,0,0]=4 91 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)N=C1 AM11480 [1,1,0,0,0,0|2,0,0]=4 92 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 AM10154 [1,1,0,0,0,0|2,0,0]=4 93 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Br AM11094 [1,1,0,0,0,0|2,0,0]=4 94 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl AM11445 [1,1,0,0,0,0|2,0,0]=4 95 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Br AM11444 [1,1,0,0,0,0|2,0,0]=4 96 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Cl AM11096 [1,1,0,0,0,0|2,0,0]=4 97 B11R1.16 CCOC(=O)C1=CC=NC=C1 AM11023 [1,1,0,0,0,0|1,0,0]=3 98 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 AM10452 [1,1,0,0,0,0|2,0,0]=4 99 B11R1.23 COC(=O)C1=CC(Br)=NC=C1 AM10076 [1,1,0,0,0,0|1,0,0]=3 100 B11R1.23 COC(=O)C1=CC(Cl)=CN=C1 AM11608 [1,1,0,0,0,0|1,0,0]=3 101 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 AM11403 [1,1,0,0,0,0|1,0,0]=3 102 B11R1.23 COC(=O)C1=CC(N)=NC=C1 AM10842 [1,1,0,0,0,0|1,0,0]=3 103 B11R1.23 COC(=O)C1=CN=CC(Br)=C1 AM10383 [1,1,0,0,0,0|1,0,0]=3 104 B11R1.23 COC(=O)C1=CN=CC(O)=C1 AM11424 [1,1,0,0,0,0|1,0,0]=3 105 B11R1.23 COC(=O)C1=NC(Br)=CC=C1 AM11429 [1,1,0,0,0,0|1,0,0]=3 106 B11R1.23 COC(=O)C1=NC(Cl)=CC=C1 AM11370 [1,1,0,0,0,0|1,0,0]=3 107 B11R1.23 COC(=O)C1=NC(N)=CC=C1 AM11428 [1,1,0,0,0,0|1,0,0]=3 108 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 AM11411 [1,1,0,0,0,0|1,0,0]=3 109 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 AM11227 [1,1,0,0,0,0|1,0,0]=3 110 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 AM11413 [1,1,0,0,0,0|1,0,0]=3 111 B11R1.23 COC(=O)C1=NC=CC(I)=C1 AM11414 [1,1,0,0,0,0|1,0,0]=3 112 B11R1.23 COC(=O)C1=NC=CC(N)=C1 AM11582 [1,1,0,0,0,0|1,0,0]=3 113 B11R1.23 COC(=O)c1cccc(I)n1 AM10563 [1,1,0,0,0,0|1,0,0]=3 114 B11R1.222 COC(=O)C1=C(Br)C=CN=C1 AM11771 [1,1,0,0,0,0|1,0,0]=3 115 B11R1.222 COC(=O)C1=C(Br)C=NC=C1 AM11032 [1,1,0,0,0,0|1,0,0]=3 116 B11R1.222 COC(=O)C1=C(I)N=CC=C1 AM11405 [1,1,0,0,0,0|1,0,0]=3 117 B11R1.222 COC(=O)C1=C(N)C=NC=C1 AM11127 [1,1,0,0,0,0|1,0,0]=3 118 B11R1.222 COC(=O)C1=CC=CN=C1Cl AM11034 [1,1,0,0,0,0|1,0,0]=3 119 B11R1.222 COC(=O)C1=CC=CN=C1O AM11589 [1,1,0,0,0,0|1,0,0]=3 120 B11R1.222 COC(=O)C1=CN=CC=C1Cl AM11412 [1,1,0,0,0,0|1,0,0]=3 121 B11R1.222 COC(=O)C1=NC=CC=C1Br AM11031 [1,1,0,0,0,0|1,0,0]=3 122 B11R1.222 COC(=O)C1=NC=CC=C1Cl AM11409 [1,1,0,0,0,0|1,0,0]=3 123 B11R1.222 COC(=O)C1=NC=CC=C1N AM11599 [1,1,0,0,0,0|1,0,0]=3 124 B13R1.19 CCOC(=O)CC1=CN=C(Cl)C=C1 AM11623 [0,1,0,0,0,1|2,0,0]=4 125 B13R1.537 COC(=O)C1=NC=C([N+](=O)[O-])C=C1 AM11581 [0,2,0,0,0,0|1,0,1]=4 126 B13R1.3088 COC(=O)C1=NC(Cl)=C(C#N)C=C1 AM11754 [0,2,0,0,0,0|2,0,0]=4 127 B13R1.466 CCOC(=O)C1=CN=C(N)C(Br)=C1 AM11398 [0,2,0,0,0,0|2,0,0]=4