0 B10R1.22 CC1=C(C(=CC(=C1)F)N)N MCULE-3656509558 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.22 CC1=C(C(=CC(=O)N1)O)C MCULE-3546454146 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.22 CC1=C(C(=NC(=C1)Cl)N)N MCULE-2406237726 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.22 CC1=C(C(=NC(=N1)Cl)N)N MCULE-1970147902 [0,0,0,0,0,0|2,0,2]=4 4 B10R1.22 CC1=C(C(=O)NC(=N1)N)C MCULE-8017907361 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.22 CC1=C(C(=O)NC(=O)N1)Br MCULE-9555073495 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.22 CC1=C(C(=O)NC(=O)N1)Cl MCULE-3888854401 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.22 CC1=C(C(=O)NC(=O)N1)I MCULE-2631615338 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.22 CC1=C(C(=O)NC(=O)N1)N MCULE-1788753048 [0,0,0,0,0,0|1,0,0]=1 9 B10R1.22 CC1=C(C(=O)NC(=O)N1)O MCULE-7766529114 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.22 CC1=C(C(=O)NC(=S)N1)C MCULE-7620589455 [0,0,0,0,0,0|2,1,0]=3 11 B10R1.22 CC1=C(N=C(NC1=O)S)N MCULE-1772199181 [0,0,0,0,0,0|1,1,1]=3 12 B10R1.22 CC1=C(NC(=O)C=C1O)Cl MCULE-2948701525 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.22 CC1=C(NC(=O)N=C1N)F MCULE-7465786440 [0,0,0,0,0,0|2,0,1]=3 14 B10R1.22 CC1=C(NC(=O)NC1=O)Cl MCULE-9699231079 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.22 CC1=C(NC(=O)NC1=O)N MCULE-3180991385 [0,0,0,0,0,0|1,0,0]=1 16 B10R1.22 CC1=CC(=C(C(=C1)Cl)N)N MCULE-3957484994 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.22 CC1=CC(=C(C(=C1)N)N)Br MCULE-6138238117 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.22 CC1=CC(=C(C(=C1)N)N)C MCULE-2454661507 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.22 CC1=CC(=C(C(=C1)N)N)C MCULE-5084152265 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.22 CC1=CC(=C(C(=C1)N)N)F MCULE-3729523627 [0,0,0,0,0,0|4,0,0]=4 21 B10R1.22 CC1=CC(=C(C(=N1)Cl)N)N MCULE-4948684701 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.22 CC1=CC(=C(C(=N1)N)N)C MCULE-9614448315 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.22 CC1=CC(=C(C(=O)N1)C)O MCULE-2746434164 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.22 CC1=CC(=C(C(=O)N1)N)C MCULE-3042119773 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.22 CC1=CC(=C(C(=O)O1)N)O MCULE-3942877134 [0,0,0,0,0,0|4,0,0]=4 26 B10R1.22 CC1=CC(=CC(=C1N)N)Br MCULE-6047034893 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.22 CC1=CC(=CC(=C1N)N)Cl MCULE-5522407220 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.22 CC1=CC(=CC(=C1N)N)Cl MCULE-8506235307 [0,0,0,0,0,0|4,0,0]=4 29 B10R1.22 CC1=CC(=O)C(=C(N1)C)C MCULE-7141390274 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.22 CC1=CC(=O)N(C(=C1)N)N MCULE-3716493671 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.22 CC1=CC(=O)N(C(=N1)N)N MCULE-5331544959 [0,0,0,0,0,0|3,0,1]=4 32 B10R1.22 CC1=CC(=O)N(C(=S)N1)N MCULE-2856836834 [0,0,0,0,0,0|4,0,0]=4 33 B10R1.22 CC1=CC(=O)NC(=C1Br)C MCULE-3594651484 [0,0,0,0,0,0|4,0,0]=4 34 B10R1.22 CC1=CC(=O)NC(=O)N1C MCULE-4776814426 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.22 CC1=NC(=C(C(=N1)Cl)N)N MCULE-6643051755 [0,0,0,0,0,0|2,0,2]=4 36 B10R1.22 CC1=NC(=C(C(=N1)S)N)N MCULE-8723487637 [0,0,0,0,0,0|1,1,2]=4 37 B10R1.22 CC1=NC(=C(C(=O)N1)C)Cl MCULE-5900147720 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.22 CC1=NC(=C(C(=O)N1)C)O MCULE-6236682380 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.22 CC1=NC(=C(C(=O)N1)Cl)O MCULE-4468060310 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.22 CC1=NC(=O)C(=C(N1)C)F MCULE-5714738648 [0,0,0,0,0,0|3,0,1]=4 41 B10R1.22 CC1=NC(=O)C(=C(N1)Cl)F MCULE-4647805655 [0,0,0,0,0,0|3,0,1]=4 42 B10R1.22 CC1=NC(=O)C(=C(N1)N)N MCULE-1678971295 [0,0,0,0,0,0|1,0,1]=2 43 B10R1.22 CC1=NC(=O)C(=C(N1)O)F MCULE-5847090975 [0,0,0,0,0,0|3,0,1]=4 44 B10R1.22 CC1=NC(=O)NC(=C1Br)C MCULE-2601002419 [0,0,0,0,0,0|3,0,1]=4 45 B10R1.22 CC1C(=O)NC(=O)N=C1Cl MCULE-6395247321 [0,0,0,0,0,0|2,0,2]=4 46 B10R1.22 CC1C(=O)NC(=O)NC1=O MCULE-7961229332 [0,0,0,0,0,0|2,0,1]=3 47 B10R1.22 CN1C(=O)CC(=O)NC1=O MCULE-7478193411 [0,0,0,0,0,0|4,0,0]=4 48 B10R1.22 CN1C(=O)CC(=O)NC1=S MCULE-8355052023 [0,0,0,0,0,0|4,0,0]=4 49 B10R1.22 CN1C(=O)NC(=O)C=C1Cl MCULE-7825661987 [0,0,0,0,0,0|4,0,0]=4 50 B10R1.22 CN1C(=O)NC(=O)C=C1N MCULE-3639154142 [0,0,0,0,0,0|3,0,0]=3 51 B10R1.22 CN1C(=S)NC(=O)C=C1N MCULE-8244560952 [0,0,0,0,0,0|3,1,0]=4 52 B10R1.22 N=C1NC(=N)N(C(=S)N1)N MCULE-8716614218 [0,0,0,0,0,0|2,1,1]=4 53 B10R1.22 NC1=C(C(=CC(=C1)Br)Br)N MCULE-1056944427 [0,0,0,0,0,0|4,0,0]=4 54 B10R1.22 NC1=C(C(=CC(=C1)Br)Cl)N MCULE-3563459699 [0,0,0,0,0,0|4,0,0]=4 55 B10R1.22 NC1=C(C(=CC(=C1)Cl)Br)N MCULE-6197067625 [0,0,0,0,0,0|4,0,0]=4 56 B10R1.22 NC1=C(C(=CC(=C1)Cl)Cl)N MCULE-2278340689 [0,0,0,0,0,0|4,0,0]=4 57 B10R1.22 NC1=C(C(=CC(=C1)Cl)Cl)N MCULE-7671661730 [0,0,0,0,0,0|4,0,0]=4 58 B10R1.22 NC1=C(C(=CC(=C1)F)Cl)N MCULE-6236099171 [0,0,0,0,0,0|4,0,0]=4 59 B10R1.22 NC1=C(C(=CC(=C1)F)I)N MCULE-6022959719 [0,0,0,0,0,0|4,0,0]=4 60 B10R1.22 NC1=C(C(=CC(=N1)Cl)Cl)N MCULE-9278205458 [0,0,0,0,0,0|3,0,1]=4 61 B10R1.22 NC1=C(C(=NC(=C1)Cl)Cl)N MCULE-4608492084 [0,0,0,0,0,0|3,0,1]=4 62 B10R1.22 NC1=C(C(=NC(=C1)F)F)N MCULE-9302235214 [0,0,0,0,0,0|3,0,1]=4 63 B10R1.22 NC1=C(C(=NC(=N1)Cl)Cl)N MCULE-8961258967 [0,0,0,0,0,0|2,0,2]=4 64 B10R1.22 NC1=C(C(=O)NC(=O)N1)Br MCULE-8672880869 [0,0,0,0,0,0|1,0,0]=1 65 B10R1.22 NC1=C(C(=O)NC(=O)N1)I MCULE-7637696964 [0,0,0,0,0,0|1,0,0]=1 66 B10R1.22 NC1=C(C(=O)NC(=O)N1)N MCULE-4581359752 [0,0,0,0,0,0|0,0,0]=0 67 B10R1.22 NC1=C(C(=O)NC(=S)N1)N MCULE-2878751510 [0,0,0,0,0,0|0,1,0]=1 68 B10R1.22 NC1=C(C(=S)NC(=S)N1)N MCULE-1211544693 [0,0,0,0,0,0|0,2,0]=2 69 B10R1.22 NC1=CC(=CC(=C1N)Br)Br MCULE-7367162482 [0,0,0,0,0,0|4,0,0]=4 70 B10R1.22 NC1=CC(=CC(=C1N)Br)F MCULE-5128860705 [0,0,0,0,0,0|4,0,0]=4 71 B10R1.22 NC1=CC(=CC(=C1N)Br)I MCULE-4209961480 [0,0,0,0,0,0|4,0,0]=4 72 B10R1.22 NC1=CC(=CC(=C1N)F)Br MCULE-6365432546 [0,0,0,0,0,0|4,0,0]=4 73 B10R1.22 NC1=CC(=CC(=C1N)F)Cl MCULE-4601114627 [0,0,0,0,0,0|4,0,0]=4 74 B10R1.22 NC1=CC(=CC(=C1N)F)F MCULE-8651321060 [0,0,0,0,0,0|4,0,0]=4 75 B10R1.22 NC1=CC(=CC(=C1N)F)I MCULE-5051633595 [0,0,0,0,0,0|4,0,0]=4 76 B10R1.22 NC1=CC(=CC(=C1N)I)Br MCULE-1149840875 [0,0,0,0,0,0|4,0,0]=4 77 B10R1.22 NC1=CC(=NC(=C1N)Cl)Br MCULE-1406375506 [0,0,0,0,0,0|3,0,1]=4 78 B10R1.22 NC1=NC(=C(C(=N1)N)N)Cl MCULE-2653814243 [0,0,0,0,0,0|2,0,2]=4 79 B10R1.22 NC1=NC(=C(C(=N1)N)N)Cl MCULE-7909075035 [0,0,0,0,0,0|2,0,2]=4 80 B10R1.22 NC1=NC(=C(C(=N1)N)N)N MCULE-2700330502 [0,0,0,0,0,0|2,0,2]=4 81 B10R1.22 NC1=NC(=C(C(=N1)N)N)N MCULE-4325131370 [0,0,0,0,0,0|2,0,2]=4 82 B10R1.22 NC1=NC(=C(C(=N1)N)N)N MCULE-8036143333 [0,0,0,0,0,0|2,0,2]=4 83 B10R1.22 NC1=NC(=C(C(=N1)N)N)O MCULE-2702597516 [0,0,0,0,0,0|1,0,3]=4 84 B10R1.22 NC1=NC(=C(C(=N1)O)N)N MCULE-6459603853 [0,0,0,0,0,0|1,0,3]=4 85 B10R1.22 NC1=NC(=C(C(=N1)O)N)N MCULE-6489171241 [0,0,0,0,0,0|1,0,3]=4 86 B10R1.22 NC1=NC(=CC(=C1N)Cl)Br MCULE-7277254703 [0,0,0,0,0,0|3,0,1]=4 87 B10R1.22 NC1=NC(=NC(=C1N)O)O MCULE-2307916634 [0,0,0,0,0,0|0,0,4]=4 88 B10R1.22 NC1=NC(=NC(=C1N)O)O MCULE-6597707044 [0,0,0,0,0,0|0,0,4]=4 89 B10R1.22 NC1=NC(=NC(=C1N)O)O MCULE-8340517997 [0,0,0,0,0,0|0,0,4]=4 90 B10R1.22 NC1=NC(=O)C(=C(N1)Cl)Br MCULE-4614433472 [0,0,0,0,0,0|3,0,1]=4 91 B10R1.22 NC1=NC(=O)C(=C(N1)Cl)I MCULE-7938551164 [0,0,0,0,0,0|3,0,1]=4 92 B10R1.22 NC1C(=O)NC(=O)NC1=O MCULE-8127541765 [0,0,0,0,0,0|1,0,1]=2 93 B10R1.22 NC1C(=O)NC(=O)NC1=S MCULE-6414499413 [0,0,0,0,0,0|1,0,1]=2 94 B10R1.22 NC1NC(=O)NC(=O)C1I MCULE-7259635650 [0,0,0,0,0,0|1,0,2]=3 95 B10R1.22 O=C1NC(=O)C(=C(N1)Cl)Br MCULE-3569046173 [0,0,0,0,0,0|2,0,0]=2 96 B10R1.22 O=C1NC(=O)C(=C(N1)Cl)Cl MCULE-8068256823 [0,0,0,0,0,0|2,0,0]=2 97 B10R1.22 O=C1NC(=O)C(=C(N1)Cl)I MCULE-4077077518 [0,0,0,0,0,0|2,0,0]=2 98 B10R1.22 O=C1NC(=O)C(=O)C(=O)N1 MCULE-9690188027 [0,0,0,0,0,0|2,0,0]=2 99 B10R1.22 O=C1NC(=O)C(C(=O)N1)Br MCULE-2631970050 [0,0,0,0,0,0|2,0,1]=3 100 B10R1.22 O=C1NC(=O)C(C(N1)O)F MCULE-8372362265 [0,0,0,0,0,0|2,0,2]=4 101 B10R1.22 [NH3+]C1=C(NC(=S)NC1=O)[O-] MCULE-2685623938 [0,0,0,0,0,0|1,1,1]=3 102 B9R1.3 CC1=C(C(=CC=C1)N)N MCULE-6874836416 [1,0,0,0,0,0|3,0,0]=4 103 B9R1.3 CC1=C(C(=NC=C1)N)N MCULE-4341269986 [1,0,0,0,0,0|2,0,1]=4 104 B9R1.3 CC1=C(C(=O)C=CN1)C MCULE-5006486359 [1,0,0,0,0,0|3,0,0]=4 105 B9R1.3 CC1=C(C(=O)C=CN1)O MCULE-4746579757 [1,0,0,0,0,0|3,0,0]=4 106 B9R1.3 CC1=C(C(=O)N=CN1)I MCULE-5309428682 [1,0,0,0,0,0|2,0,1]=4 107 B9R1.3 CC1=C(C(=O)N=CN1)N MCULE-4173319628 [1,0,0,0,0,0|1,0,1]=3 108 B9R1.3 CC1=C(C(=O)NC=N1)C MCULE-9618860141 [1,0,0,0,0,0|2,0,1]=4 109 B9R1.3 CC1=C(C=CNC1=O)Br MCULE-3583219107 [1,0,0,0,0,0|3,0,0]=4 110 B9R1.3 CC1=C(C=CNC1=O)O MCULE-7417449946 [1,0,0,0,0,0|3,0,0]=4 111 B9R1.3 CC1=C(N=CNC1=O)O MCULE-7001719054 [1,0,0,0,0,0|2,0,1]=4 112 B9R1.3 CC1=C(NC=NC1=O)N MCULE-6689099936 [1,0,0,0,0,0|1,0,1]=3 113 B9R1.3 CC1=NC=CC(=C1N)N MCULE-3020696393 [1,0,0,0,0,0|2,0,1]=4 114 B9R1.3 NC1=C(C(=CC=C1)Br)N MCULE-9258567410 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.3 NC1=C(C(=CC=C1)Cl)N MCULE-9947522130 [1,0,0,0,0,0|3,0,0]=4 116 B9R1.3 NC1=C(C(=CC=C1)F)N MCULE-1179496473 [1,0,0,0,0,0|3,0,0]=4 117 B9R1.3 NC1=C(C(=CC=C1)F)N MCULE-9808797919 [1,0,0,0,0,0|3,0,0]=4 118 B9R1.3 NC1=C(C(=CC=C1)I)N MCULE-4851623449 [1,0,0,0,0,0|3,0,0]=4 119 B9R1.3 NC1=C(C(=NC=C1)Br)N MCULE-6310363994 [1,0,0,0,0,0|2,0,1]=4 120 B9R1.3 NC1=C(C(=NC=C1)Cl)N MCULE-4969297332 [1,0,0,0,0,0|2,0,1]=4 121 B9R1.3 NC1=C(C(=NC=C1)Cl)N MCULE-9045059570 [1,0,0,0,0,0|2,0,1]=4 122 B9R1.3 NC1=C(C(=NC=N1)O)N MCULE-2061178083 [1,0,0,0,0,0|0,0,3]=4 123 B9R1.3 NC1=C(C(=NC=N1)O)N MCULE-8577174420 [1,0,0,0,0,0|0,0,3]=4 124 B9R1.3 NC1=C(C(=NC=N1)O)N MCULE-9192422382 [1,0,0,0,0,0|0,0,3]=4 125 B9R1.3 NC1=C(C(=O)N=CN1)I MCULE-7919906444 [1,0,0,0,0,0|1,0,1]=3 126 B9R1.3 NC1=C(C(=O)NC=C1)I MCULE-3695102386 [1,0,0,0,0,0|2,0,0]=3 127 B9R1.3 NC1=C(C(=O)NC=C1)N MCULE-5013092941 [1,0,0,0,0,0|1,0,0]=2 128 B9R1.3 NC1=C(C(=O)NN=C1)Cl MCULE-2690467469 [1,0,0,0,0,0|3,0,0]=4 129 B9R1.3 NC1=C(C(=O)NN=C1)N MCULE-3648099859 [1,0,0,0,0,0|2,0,0]=3 130 B9R1.3 NC1=C(C=NNC1=O)Cl MCULE-4760531881 [1,0,0,0,0,0|3,0,0]=4 131 B9R1.3 NC1=C(NC=NC1=O)Cl MCULE-5234884240 [1,0,0,0,0,0|1,0,1]=3 132 B9R1.3 NC1=CC=CC(=C1N)Br MCULE-6658353674 [1,0,0,0,0,0|3,0,0]=4 133 B9R1.3 NC1=CC=CC(=C1N)Cl MCULE-3581540111 [1,0,0,0,0,0|3,0,0]=4 134 B9R1.3 NC1=CC=CC(=C1N)F MCULE-6964027107 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.3 NC1=CC=CC(=C1N)N MCULE-4038488938 [1,0,0,0,0,0|3,0,0]=4 136 B9R1.3 NC1=CC=CC(=C1N)N MCULE-4527922672 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.3 NC1=CC=CC(=C1N)N MCULE-7733888924 [1,0,0,0,0,0|3,0,0]=4 138 B9R1.3 NC1=CC=CC(=C1N)O MCULE-3421023104 [1,0,0,0,0,0|2,0,1]=4 139 B9R1.3 NC1=CC=CC(=C1N)O MCULE-5210081454 [1,0,0,0,0,0|2,0,1]=4 140 B9R1.3 NC1=NC=CC(=C1N)Br MCULE-1300842753 [1,0,0,0,0,0|2,0,1]=4 141 B9R1.3 NC1=NC=CC(=C1N)Cl MCULE-8315167717 [1,0,0,0,0,0|2,0,1]=4 142 B9R1.3 NC1=NC=CC(=C1N)N MCULE-4705671228 [1,0,0,0,0,0|2,0,1]=4 143 B9R1.3 NC1=NC=NC(=C1N)Cl MCULE-2995133306 [1,0,0,0,0,0|1,0,2]=4 144 B9R1.3 NC1=NC=NC(=C1N)N MCULE-5170787047 [1,0,0,0,0,0|1,0,2]=4 145 B9R1.3 NC1=NC=NC(=C1N)N MCULE-5490811619 [1,0,0,0,0,0|1,0,2]=4 146 B9R1.3 NC1=NC=NC(=C1N)S MCULE-5520711583 [1,0,0,0,0,0|0,1,2]=4 147 B9R1.3 O=C1N=CNC(=C1Cl)O MCULE-9849652466 [1,0,0,0,0,0|2,0,1]=4 148 B9R1.3 O=C1NC=CC(=C1Br)F MCULE-4137751133 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.3 O=C1NC=CC(=C1Br)O MCULE-3131067325 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.3 O=C1NC=CC(=C1Cl)O MCULE-5493350533 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.3 O=C1NC=CC(=C1F)I MCULE-5070253573 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.3 O=C1NC=NC(=C1Br)Cl MCULE-8110093089 [1,0,0,0,0,0|2,0,1]=4 153 B9R1.3 O=C1NC=NC(=C1Br)O MCULE-5733109066 [1,0,0,0,0,0|2,0,1]=4 154 B9R1.3 O=C1NC=NC(=C1Cl)Cl MCULE-3062125086 [1,0,0,0,0,0|2,0,1]=4 155 B9R1.3 O=C1NC=NC(=C1I)O MCULE-8276971392 [1,0,0,0,0,0|2,0,1]=4 156 B9R1.34 CC1=CC(=CC(=O)N1)Br MCULE-8208292456 [1,0,0,0,0,0|3,0,0]=4 157 B9R1.34 CC1=CC(=CC(=O)N1)Cl MCULE-9615445068 [1,0,0,0,0,0|3,0,0]=4 158 B9R1.34 CC1=CC(=CC(=O)N1)O MCULE-9810636783 [1,0,0,0,0,0|2,0,1]=4 159 B9R1.34 CC1=CC(=CC(=O)O1)N MCULE-7615332536 [1,0,0,0,0,0|3,0,0]=4 160 B9R1.34 CC1=CC(=CC(=O)O1)N MCULE-9405603947 [1,0,0,0,0,0|3,0,0]=4 161 B9R1.34 CC1=CC(=NC(=O)N1)C MCULE-6623341819 [1,0,0,0,0,0|2,0,1]=4 162 B9R1.34 CC1=CC(=O)C=C(N1)C MCULE-9549005978 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.34 CC1=CC(=O)CC(=O)O1 MCULE-2238720534 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.34 CC1=CC(=O)N=C(N1)Cl MCULE-3386184434 [1,0,0,0,0,0|2,0,1]=4 165 B9R1.34 CC1=CC(=O)NC(=C1)C MCULE-3175630656 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.34 CC1=CC(=O)NC(=C1)N MCULE-1738074769 [1,0,0,0,0,0|2,0,0]=3 167 B9R1.34 CC1=CC(=O)NC(=S)N1 MCULE-5250952546 [1,0,0,0,0,0|1,1,0]=3 168 B9R1.34 CC1=CC(=O)OC(=O)N1 MCULE-4319728701 [1,0,0,0,0,0|2,0,0]=3 169 B9R1.34 CC1=NC(=CC(=O)N1)N MCULE-8442084767 [1,0,0,0,0,0|1,0,1]=3 170 B9R1.34 CC1CC(=O)NC(=O)N1 MCULE-2066103800 [1,0,0,0,0,0|1,0,2]=4 171 B9R1.34 NC1=CC(=CC(=O)N1)O MCULE-5663243183 [1,0,0,0,0,0|1,0,1]=3 172 B9R1.34 NC1=CC(=O)NC(=C1)F MCULE-1710027350 [1,0,0,0,0,0|2,0,0]=3 173 B9R1.34 NC1=CC(=O)NC(=C1)O MCULE-3882042487 [1,0,0,0,0,0|1,0,1]=3 174 B9R1.34 NC1=CC(=O)NC(=N1)Cl MCULE-6120131493 [1,0,0,0,0,0|1,0,1]=3 175 B9R1.34 NC1=CC(=O)NC(=N1)N MCULE-5011664599 [1,0,0,0,0,0|1,0,1]=3 176 B9R1.34 NC1=NC(=CC(=O)N1)Cl MCULE-7901887440 [1,0,0,0,0,0|2,0,1]=4 177 B9R1.34 NC1=NC(=CC(=O)N1)F MCULE-6215319582 [1,0,0,0,0,0|2,0,1]=4 178 B9R1.34 NC1=NC(=O)CC(=O)N1 MCULE-4304162919 [1,0,0,0,0,0|2,0,0]=3 179 B9R1.34 NC1=NC(=O)NC(=C1)Cl MCULE-1890918637 [1,0,0,0,0,0|1,0,1]=3 180 B9R1.34 NC1=NC(=O)NC(=C1)Cl MCULE-3508827707 [1,0,0,0,0,0|1,0,1]=3 181 B9R1.34 NC1=NC(=O)NC(=C1)F MCULE-8549659767 [1,0,0,0,0,0|1,0,1]=3 182 B9R1.34 NC1=NC(=O)NC(=N1)S MCULE-7040117575 [1,0,0,0,0,0|1,1,1]=4 183 B9R1.34 NC1CC(=O)NC(=O)C1 MCULE-6382091482 [1,0,0,0,0,0|1,0,2]=4 184 B9R1.34 NC1CC(=O)NC(=O)C1 MCULE-9933185634 [1,0,0,0,0,0|1,0,2]=4 185 B9R1.34 O=C1C=C(C=C(N1)Cl)Br MCULE-8632612031 [1,0,0,0,0,0|3,0,0]=4 186 B9R1.34 O=C1C=C(C=C(N1)Cl)Cl MCULE-1887146487 [1,0,0,0,0,0|3,0,0]=4 187 B9R1.34 O=C1C=C(C=C(N1)O)I MCULE-8256519601 [1,0,0,0,0,0|2,0,1]=4 188 B9R1.34 O=C1C=C(NC(=O)N1)Br MCULE-3840650924 [1,0,0,0,0,0|1,0,0]=2 189 B9R1.34 O=C1C=C(NC(=O)N1)Cl MCULE-2281590199 [1,0,0,0,0,0|1,0,0]=2 190 B9R1.34 O=C1C=C(NC(=O)N1)F MCULE-4457115383 [1,0,0,0,0,0|1,0,0]=2 191 B9R1.34 O=C1C=C(NC(=O)N1)I MCULE-4986004483 [1,0,0,0,0,0|1,0,0]=2 192 B9R1.34 O=C1CC(=NC(=O)N1)[O-] MCULE-5852182390 [1,0,0,0,0,0|1,0,2]=4 193 B9R1.34 O=C1CC(=O)NC(=O)N1 MCULE-3947237773 [1,0,0,0,0,0|1,0,1]=3 194 B9R1.34 O=C1CC(=O)NC(=S)N1 MCULE-6314984434 [1,0,0,0,0,0|1,1,1]=4 195 B9R1.34 O=C1N=C(C=C(N1)Cl)Cl MCULE-4885987307 [1,0,0,0,0,0|2,0,1]=4 196 B9R1.34 O=C1N=C(NC(=O)N1)Cl MCULE-5015398867 [1,0,0,0,0,0|2,0,0]=3 197 B9R1.69 C=C1CCC(=O)NC1=O MCULE-9917847735 [1,0,0,0,0,0|2,0,1]=4 198 B9R1.69 CC1=C(C=CC(=O)N1)Br MCULE-4521117941 [1,0,0,0,0,0|3,0,0]=4 199 B9R1.69 CC1=C(C=CC(=O)N1)F MCULE-7194077740 [1,0,0,0,0,0|3,0,0]=4 200 B9R1.69 CC1=C(C=CC(=O)N1)I MCULE-5617997142 [1,0,0,0,0,0|3,0,0]=4 201 B9R1.69 CC1=C(C=NC(=O)N1)Br MCULE-4433615327 [1,0,0,0,0,0|2,0,1]=4 202 B9R1.69 CC1=C(C=NC(=O)N1)Br MCULE-9820279136 [1,0,0,0,0,0|2,0,1]=4 203 B9R1.69 CC1=C(NC(=O)C=C1)C MCULE-4420397888 [1,0,0,0,0,0|3,0,0]=4 204 B9R1.69 CC1=CC(=C(C=C1)N)N MCULE-4665726211 [1,0,0,0,0,0|3,0,0]=4 205 B9R1.69 CC1=CC(=C(C=N1)N)N MCULE-1520580944 [1,0,0,0,0,0|2,0,1]=4 206 B9R1.69 CC1=CC(=C(C=N1)N)N MCULE-3087299896 [1,0,0,0,0,0|2,0,1]=4 207 B9R1.69 CC1=CC(=O)C(=CN1)O MCULE-1538839877 [1,0,0,0,0,0|3,0,0]=4 208 B9R1.69 CC1=CC(=O)NC=C1Br MCULE-8891123753 [1,0,0,0,0,0|3,0,0]=4 209 B9R1.69 CC1=CC=C(C(=C1)N)N MCULE-2756247360 [1,0,0,0,0,0|3,0,0]=4 210 B9R1.69 CC1=CC=C(C(=N1)N)N MCULE-1952081988 [1,0,0,0,0,0|2,0,1]=4 211 B9R1.69 CC1=CC=C(C(=N1)N)N MCULE-6457530344 [1,0,0,0,0,0|2,0,1]=4 212 B9R1.69 CC1=CC=C(C(=O)N1)Cl MCULE-5441621395 [1,0,0,0,0,0|3,0,0]=4 213 B9R1.69 CC1=CC=C(C(=O)N1)N MCULE-6572218746 [1,0,0,0,0,0|2,0,0]=3 214 B9R1.69 CC1=CC=C(NC1=O)Br MCULE-2417679757 [1,0,0,0,0,0|3,0,0]=4 215 B9R1.69 CC1=CC=C(NC1=O)Cl MCULE-5412966214 [1,0,0,0,0,0|3,0,0]=4 216 B9R1.69 CC1=CN=C(C(=O)N1)N MCULE-1079946763 [1,0,0,0,0,0|3,0,0]=4 217 B9R1.69 CC1=CNC(=NC1=O)C MCULE-3546851335 [1,0,0,0,0,0|2,0,1]=4 218 B9R1.69 CC1=CNC(=O)C=C1C MCULE-7565124087 [1,0,0,0,0,0|3,0,0]=4 219 B9R1.69 CC1=CNC(=O)C=C1I MCULE-9234300230 [1,0,0,0,0,0|3,0,0]=4 220 B9R1.69 CC1=CNC(=O)N=C1Cl MCULE-8904096014 [1,0,0,0,0,0|2,0,1]=4 221 B9R1.69 CC1=CNC(=O)N=C1N MCULE-1653319899 [1,0,0,0,0,0|1,0,1]=3 222 B9R1.69 CC1=CNC(=O)N=C1N MCULE-3789550079 [1,0,0,0,0,0|1,0,1]=3 223 B9R1.69 CC1=CNC(=O)NC1=O MCULE-6356243926 [1,0,0,0,0,0|1,0,0]=2 224 B9R1.69 CC1=CNC(=O)NC1=S MCULE-2390616666 [1,0,0,0,0,0|1,1,0]=3 225 B9R1.69 CC1=CNC(=S)NC1=O MCULE-7685911178 [1,0,0,0,0,0|1,1,0]=3 226 B9R1.69 CC1=NC=C(C(=O)N1)F MCULE-6156802397 [1,0,0,0,0,0|2,0,1]=4 227 B9R1.69 CC1=NC=C(C(=O)N1)I MCULE-9280509199 [1,0,0,0,0,0|2,0,1]=4 228 B9R1.69 CC1=NNC(=O)N=C1N MCULE-5391002563 [1,0,0,0,0,0|2,0,1]=4 229 B9R1.69 CC1=NNC(=O)NC1=O MCULE-1502977032 [1,0,0,0,0,0|2,0,0]=3 230 B9R1.69 CC1=NNC(=O)NC1=O MCULE-1807973782 [1,0,0,0,0,0|2,0,0]=3 231 B9R1.69 CC1=NNC(=O)NC1=S MCULE-2580193457 [1,0,0,0,0,0|2,1,0]=4 232 B9R1.69 CC1NNC(=O)NC1=O MCULE-2982898824 [1,0,0,0,0,0|2,0,1]=4 233 B9R1.69 CN1C=CC(=O)NC1=O MCULE-4954410074 [1,0,0,0,0,0|3,0,0]=4 234 B9R1.69 N=C1N=C(NC=C1N)N MCULE-9072791437 [1,0,0,0,0,0|1,0,2]=4 235 B9R1.69 NC1=C(C=C(C=C1)Br)N MCULE-1768987078 [1,0,0,0,0,0|3,0,0]=4 236 B9R1.69 NC1=C(C=C(C=C1)Cl)N MCULE-6271163512 [1,0,0,0,0,0|3,0,0]=4 237 B9R1.69 NC1=C(C=C(C=C1)O)N MCULE-3982316164 [1,0,0,0,0,0|2,0,1]=4 238 B9R1.69 NC1=C(C=C(C=C1)O)N MCULE-4587255404 [1,0,0,0,0,0|2,0,1]=4 239 B9R1.69 NC1=C(C=C(N=C1)Br)N MCULE-8861873014 [1,0,0,0,0,0|2,0,1]=4 240 B9R1.69 NC1=C(C=C(N=C1)Cl)N MCULE-2411356312 [1,0,0,0,0,0|2,0,1]=4 241 B9R1.69 NC1=C(C=C(N=C1)Cl)N MCULE-4731506179 [1,0,0,0,0,0|2,0,1]=4 242 B9R1.69 NC1=C(C=C(N=C1)Cl)N MCULE-8842827965 [1,0,0,0,0,0|2,0,1]=4 243 B9R1.69 NC1=C(C=C(N=C1)F)N MCULE-5443460982 [1,0,0,0,0,0|2,0,1]=4 244 B9R1.69 NC1=C(N=C(C=C1)Br)N MCULE-5911040878 [1,0,0,0,0,0|2,0,1]=4 245 B9R1.69 NC1=C(N=C(C=C1)Cl)N MCULE-9987302372 [1,0,0,0,0,0|2,0,1]=4 246 B9R1.69 NC1=C(N=C(N=C1)O)N MCULE-8249413851 [1,0,0,0,0,0|0,0,3]=4 247 B9R1.69 NC1=C(NC(=O)C=C1)N MCULE-9610602391 [1,0,0,0,0,0|1,0,0]=2 248 B9R1.69 NC1=CC(=C(C=C1)N)N MCULE-8710153364 [1,0,0,0,0,0|3,0,0]=4 249 B9R1.69 NC1=CC(=O)C(=CN1)Cl MCULE-5330162128 [1,0,0,0,0,0|3,0,0]=4 250 B9R1.69 NC1=CC(=O)NN=C1Cl MCULE-4750782331 [1,0,0,0,0,0|3,0,0]=4 251 B9R1.69 NC1=CC=C(C(=C1)N)N MCULE-2405652825 [1,0,0,0,0,0|3,0,0]=4 252 B9R1.69 NC1=CC=C(C(=C1)N)N MCULE-2553171473 [1,0,0,0,0,0|3,0,0]=4 253 B9R1.69 NC1=CC=C(C=C1N)Br MCULE-9719581655 [1,0,0,0,0,0|3,0,0]=4 254 B9R1.69 NC1=CC=C(C=C1N)Cl MCULE-6641739557 [1,0,0,0,0,0|3,0,0]=4 255 B9R1.69 NC1=CC=C(C=C1N)F MCULE-4415320637 [1,0,0,0,0,0|3,0,0]=4 256 B9R1.69 NC1=CC=C(C=C1N)I MCULE-3693763843 [1,0,0,0,0,0|3,0,0]=4 257 B9R1.69 NC1=CC=C(N=C1N)F MCULE-1164698135 [1,0,0,0,0,0|2,0,1]=4 258 B9R1.69 NC1=CC=C(NC1=S)Cl MCULE-7529114591 [1,0,0,0,0,0|2,1,0]=4 259 B9R1.69 NC1=CN=C(C=C1N)N MCULE-7962808558 [1,0,0,0,0,0|2,0,1]=4 260 B9R1.69 NC1=CN=C(N=C1N)Cl MCULE-8345592573 [1,0,0,0,0,0|1,0,2]=4 261 B9R1.69 NC1=CN=C(N=C1N)N MCULE-9756079037 [1,0,0,0,0,0|1,0,2]=4 262 B9R1.69 NC1=CN=C(NC1=O)N MCULE-2464173889 [1,0,0,0,0,0|1,0,1]=3 263 B9R1.69 NC1=CNC(=O)NC1=O MCULE-8766220931 [1,0,0,0,0,0|0,0,0]=1 264 B9R1.69 NC1=NC(=C(C=C1)N)N MCULE-2957286849 [1,0,0,0,0,0|2,0,1]=4 265 B9R1.69 NC1=NC(=C(C=C1)N)N MCULE-7575706301 [1,0,0,0,0,0|2,0,1]=4 266 B9R1.69 NC1=NC(=O)C(=CN1)Cl MCULE-7454708722 [1,0,0,0,0,0|2,0,1]=4 267 B9R1.69 NC1=NC(=O)C(=CN1)F MCULE-9299173255 [1,0,0,0,0,0|2,0,1]=4 268 B9R1.69 NC1=NC(=O)C(=CN1)I MCULE-4150780086 [1,0,0,0,0,0|2,0,1]=4 269 B9R1.69 NC1=NC(=O)NC=C1Br MCULE-9918095021 [1,0,0,0,0,0|1,0,1]=3 270 B9R1.69 NC1=NC(=O)NC=C1Cl MCULE-2268188970 [1,0,0,0,0,0|1,0,1]=3 271 B9R1.69 NC1=NC(=O)NC=C1F MCULE-7094058995 [1,0,0,0,0,0|1,0,1]=3 272 B9R1.69 NC1=NC(=O)NC=C1I MCULE-7464214392 [1,0,0,0,0,0|1,0,1]=3 273 B9R1.69 NC1=NC(=O)NCC1=O MCULE-2660856699 [1,0,0,0,0,0|1,0,2]=4 274 B9R1.69 NC1=NC=C(NC1=O)Br MCULE-9847766852 [1,0,0,0,0,0|3,0,0]=4 275 B9R1.69 NC1=NNC(=O)NC1=O MCULE-3067333649 [1,0,0,0,0,0|1,0,0]=2 276 B9R1.69 NC1C=NC(=O)NC1=O MCULE-1490641488 [1,0,0,0,0,0|0,0,2]=3 277 B9R1.69 NC1CCC(=O)NC1=O MCULE-4373046338 [1,0,0,0,0,0|1,0,2]=4 278 B9R1.69 NC1CCC(=O)NC1=O MCULE-5761090335 [1,0,0,0,0,0|1,0,2]=4 279 B9R1.69 NC1CCC(=O)NC1=O MCULE-6512527532 [1,0,0,0,0,0|1,0,2]=4 280 B9R1.69 NC1NC(=O)NC=C1F MCULE-6799586428 [1,0,0,0,0,0|1,0,1]=3 281 B9R1.69 NN1C=CC(=O)NC1=O MCULE-6452806318 [1,0,0,0,0,0|2,0,0]=3 282 B9R1.69 N[C@@H]1CCC(=O)NC1=O MCULE-2259559652 [1,0,0,0,0,0|1,0,2]=4 283 B9R1.69 N[C@@H]1CCC(=O)NC1=O MCULE-5099911990 [1,0,0,0,0,0|1,0,2]=4 284 B9R1.69 N[C@@H]1CCC(=O)NC1=O MCULE-5834100164 [1,0,0,0,0,0|1,0,2]=4 285 B9R1.69 N[C@@H]1CCC(=O)NC1=O MCULE-9198243816 [1,0,0,0,0,0|1,0,2]=4 286 B9R1.69 N[C@H]1CCC(=O)NC1=O MCULE-2839925566 [1,0,0,0,0,0|1,0,2]=4 287 B9R1.69 N[C@H]1CCC(=O)NC1=O MCULE-4993857257 [1,0,0,0,0,0|1,0,2]=4 288 B9R1.69 N[C@H]1CCC(=O)NC1=O MCULE-5773933419 [1,0,0,0,0,0|1,0,2]=4 289 B9R1.69 N[C@H]1CCC(=O)NC1=O MCULE-7730306323 [1,0,0,0,0,0|1,0,2]=4 290 B9R1.69 O=C1C=C(C(=CN1)Br)Br MCULE-7608477571 [1,0,0,0,0,0|3,0,0]=4 291 B9R1.69 O=C1C=C(C(=CN1)Br)Cl MCULE-9807316455 [1,0,0,0,0,0|3,0,0]=4 292 B9R1.69 O=C1C=C(C(=CN1)Br)F MCULE-7030715609 [1,0,0,0,0,0|3,0,0]=4 293 B9R1.69 O=C1C=C(C(=CN1)Cl)Br MCULE-2131702864 [1,0,0,0,0,0|3,0,0]=4 294 B9R1.69 O=C1C=C(C(=CN1)Cl)Cl MCULE-6667509474 [1,0,0,0,0,0|3,0,0]=4 295 B9R1.69 O=C1C=C(C(=CN1)Cl)I MCULE-6044450800 [1,0,0,0,0,0|3,0,0]=4 296 B9R1.69 O=C1C=C(C(=CN1)Cl)O MCULE-3767139404 [1,0,0,0,0,0|2,0,1]=4 297 B9R1.69 O=C1C=C(C(=CN1)F)O MCULE-2590440873 [1,0,0,0,0,0|2,0,1]=4 298 B9R1.69 O=C1C=C(C(=CN1)I)Cl MCULE-2838518918 [1,0,0,0,0,0|3,0,0]=4 299 B9R1.69 O=C1C=C(NC=C1Br)Cl MCULE-5060506861 [1,0,0,0,0,0|3,0,0]=4 300 B9R1.69 O=C1C=CC(=C(N1)Br)Cl MCULE-2299972105 [1,0,0,0,0,0|3,0,0]=4 301 B9R1.69 O=C1C=CC(=C(N1)Br)F MCULE-7102970752 [1,0,0,0,0,0|3,0,0]=4 302 B9R1.69 O=C1C=CC(=C(N1)Cl)Cl MCULE-1681345436 [1,0,0,0,0,0|3,0,0]=4 303 B9R1.69 O=C1C=CC(=C(N1)I)Br MCULE-3011078994 [1,0,0,0,0,0|3,0,0]=4 304 B9R1.69 O=C1N=C(C(=CN1)Br)Br MCULE-2653404573 [1,0,0,0,0,0|2,0,1]=4 305 B9R1.69 O=C1NC(=CC=C1Cl)Br MCULE-7002386572 [1,0,0,0,0,0|3,0,0]=4 306 B9R1.69 O=C1NC(=CC=C1Cl)Cl MCULE-9076841848 [1,0,0,0,0,0|3,0,0]=4 307 B9R1.69 O=C1NC(=CC=C1I)Cl MCULE-6248898641 [1,0,0,0,0,0|3,0,0]=4 308 B9R1.69 O=C1NC(=CC=C1O)Cl MCULE-7098135447 [1,0,0,0,0,0|3,0,0]=4 309 B9R1.69 O=C1NC(=NC=C1Cl)Cl MCULE-6600443230 [1,0,0,0,0,0|2,0,1]=4 310 B9R1.69 O=C1NC(=NC=C1F)Cl MCULE-8340050328 [1,0,0,0,0,0|2,0,1]=4 311 B9R1.69 O=C1NC(=NC=C1I)Cl MCULE-3863853934 [1,0,0,0,0,0|2,0,1]=4 312 B9R1.69 O=C1NC(=S)NC=C1F MCULE-1640996146 [1,0,0,0,0,0|1,1,0]=3 313 B9R1.69 O=C1NC(=S)NC=C1I MCULE-9040932930 [1,0,0,0,0,0|1,1,0]=3 314 B9R1.69 O=C1NC=C(C(=O)N1)Br MCULE-6639028202 [1,0,0,0,0,0|1,0,0]=2 315 B9R1.69 O=C1NC=C(C(=O)N1)Cl MCULE-3005578323 [1,0,0,0,0,0|1,0,0]=2 316 B9R1.69 O=C1NC=C(C(=O)N1)F MCULE-6338086431 [1,0,0,0,0,0|1,0,0]=2 317 B9R1.69 O=C1NC=C(C(=O)N1)I MCULE-9099154084 [1,0,0,0,0,0|1,0,0]=2 318 B9R1.69 O=C1NC=C(C(=S)N1)F MCULE-5051283182 [1,0,0,0,0,0|1,1,0]=3 319 B9R1.69 O=C1NCC(=O)C(=O)N1 MCULE-3608761998 [1,0,0,0,0,0|1,0,1]=3 320 B9R1.69 O=C1NCC(C(=O)N1)Br MCULE-1399084699 [1,0,0,0,0,0|1,0,2]=4 321 B9R1.69 O=C1NCC(C(=O)N1)Cl MCULE-3522626760 [1,0,0,0,0,0|1,0,2]=4 322 B9R1.69 O=C1NCC(C(=O)N1)F MCULE-3119054190 [1,0,0,0,0,0|1,0,2]=4 323 B9R1.69 O=C1NN=C(C(=O)N1)Br MCULE-9793204387 [1,0,0,0,0,0|2,0,0]=3 324 B9R1.69 O=C1NN=C(C(=O)N1)F MCULE-5496474813 [1,0,0,0,0,0|2,0,0]=3 325 B9R1.69 O=C1NN=C(C(=S)N1)Br MCULE-1298950946 [1,0,0,0,0,0|2,1,0]=4 326 B11R1.8 CC1=C(NC(=O)NC1=O)CCl MCULE-8748721239 [0,1,0,0,0,0|2,0,0]=3 327 B11R1.8 CC1=C(NC(=O)NC1=O)CO MCULE-2105308817 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.8 CNC1=C(C(=NC(=O)N1)N)N MCULE-1980967343 [0,1,0,0,0,0|1,0,1]=3 329 B11R1.8 CNC1=C(C(=NC(=O)N1)N)N MCULE-9706980810 [0,1,0,0,0,0|1,0,1]=3 330 B11R1.8 CNC1=CC(=O)NC(=O)N1C MCULE-4926647996 [0,1,0,0,0,0|3,0,0]=4 331 B11R1.8 NC1=C(NC(=O)NC1=O)N=O MCULE-6121726165 [0,1,0,0,0,0|0,0,1]=2 332 B11R1.8 O=C1NC(=O)C(=C(N1)CCl)Cl MCULE-2767621981 [0,1,0,0,0,0|2,0,0]=3 333 B11R1.8 O=C1NC(=O)C(=C(N1)CO)O MCULE-8946189974 [0,1,0,0,0,0|2,0,0]=3 334 B11R1.14 COC1=NC(=C(C(=O)N1)C)N MCULE-6176192612 [0,1,0,0,0,0|1,0,2]=4 335 B11R1.32 CC1=C(C(=C(C(=O)N1)N)C)Br MCULE-5495812517 [0,1,0,0,0,0|3,0,0]=4 336 B11R1.32 CC1=C(N(C(=O)NC1=O)C)Br MCULE-6334969144 [0,1,0,0,0,0|2,0,0]=3 337 B11R1.32 CC1=C(N(C(=O)NC1=O)C)N MCULE-3130212976 [0,1,0,0,0,0|1,0,0]=2 338 B11R1.32 CC1=C(N(C(=O)NC1=O)C)N MCULE-7800528537 [0,1,0,0,0,0|1,0,0]=2 339 B11R1.32 CC1=CC(=C(C(=O)N1C)N)Cl MCULE-3522075789 [0,1,0,0,0,0|3,0,0]=4 340 B11R1.32 CC1=CC(=C(C(=O)N1C)N)N MCULE-9005633358 [0,1,0,0,0,0|2,0,0]=3 341 B11R1.32 CN1C(=O)C(=C(N=C1Cl)N)Br MCULE-8924751535 [0,1,0,0,0,0|2,0,1]=4 342 B11R1.32 CN1C(=O)C(=C(N=C1N)Cl)N MCULE-7905942532 [0,1,0,0,0,0|2,0,1]=4 343 B11R1.32 CN1C(=O)C=C(N(C1=O)C)N MCULE-8108343390 [0,1,0,0,0,0|3,0,0]=4 344 B11R1.32 CN1C(=O)NC(=C(C1=O)Cl)Cl MCULE-6608613468 [0,1,0,0,0,0|2,0,0]=3 345 B11R1.32 CN1C(=O)NC(=C(C1=O)N)N MCULE-6292306510 [0,1,0,0,0,0|0,0,0]=1 346 B11R1.32 CN1C(=O)NC(=O)C(=C1N)Br MCULE-9632547087 [0,1,0,0,0,0|1,0,0]=2 347 B11R1.32 CN1C(=O)NC(=O)C(=C1N)N MCULE-1843362847 [0,1,0,0,0,0|0,0,0]=1 348 B11R1.32 CN1C(=O)NC(=O)C(=C1[O-])[NH3+] MCULE-3669749545 [0,1,0,0,0,0|1,0,1]=3 349 B11R1.32 CN1C(=O)NC(=O)N(C1=O)C MCULE-6595211067 [0,1,0,0,0,0|3,0,0]=4 350 B11R1.32 CN1C(=S)NC(=O)C(=C1N)N MCULE-9863179419 [0,1,0,0,0,0|0,1,0]=2 351 B11R1.32 NC1=C(C(=O)NC(=C1Cl)F)Cl MCULE-9277746626 [0,1,0,0,0,0|3,0,0]=4 352 B11R1.32 O=C1NC(=O)N(C(=O)N1Br)Br MCULE-3230631991 [0,1,0,0,0,0|3,0,0]=4 353 B11R1.32 O=C1NC(=O)N(C(=O)N1Cl)Cl MCULE-1506706385 [0,1,0,0,0,0|3,0,0]=4 354 B11R1.325 O=C1NC(=O)C(=O)C(N1)(O)O MCULE-4768389690 [0,1,0,0,0,0|2,0,1]=4 355 B11R1.464 CC1=C(C(=O)NC(=O)N1)C#N MCULE-7141137597 [0,1,0,0,0,0|1,0,1]=3 356 B11R1.464 CC1=C(C(=O)NC(=O)N1)C=O MCULE-8837004520 [0,1,0,0,0,0|2,0,0]=3 357 B11R1.464 CC1=C(C(=O)NC(=O)N1)CBr MCULE-8120864612 [0,1,0,0,0,0|2,0,0]=3 358 B11R1.464 CC1=C(C(=O)NC(=O)N1)CN MCULE-3036586197 [0,1,0,0,0,0|1,0,0]=2 359 B11R1.464 CC1=C(C(=O)NC(=O)N1)CN MCULE-9277898866 [0,1,0,0,0,0|1,0,0]=2 360 B11R1.464 CC1=CC(=C(C(=O)N1)CN)C MCULE-1373808929 [0,1,0,0,0,0|3,0,0]=4 361 B11R1.464 CC1=CC(=C(C(=O)N1)CN)C MCULE-3681074903 [0,1,0,0,0,0|3,0,0]=4 362 B11R1.464 CC1=CC(=C(C(=O)N1)CN)C MCULE-4643535724 [0,1,0,0,0,0|3,0,0]=4 363 B11R1.464 CC1=NC(=C(C(=O)N1)N=O)N MCULE-7686405598 [0,1,0,0,0,0|1,0,2]=4 364 B11R1.464 CCC1=C(NC(=O)NC1=O)Cl MCULE-4326893586 [0,1,0,0,0,0|2,0,0]=3 365 B11R1.464 CCC1C(=O)NC(=O)NC1=O MCULE-8814164989 [0,1,0,0,0,0|2,0,1]=4 366 B11R1.464 CCN1C(=O)NC(=O)C=C1N MCULE-1912257453 [0,1,0,0,0,0|3,0,0]=4 367 B11R1.464 N#CC1=C(NC(=O)C=C1N)Cl MCULE-5472677963 [0,1,0,0,0,0|2,0,1]=4 368 B11R1.464 NC1=C(C(=O)NC(=O)N1)C=O MCULE-1496612859 [0,1,0,0,0,0|1,0,0]=2 369 B11R1.464 NC1=NC(=C(C(=O)N1)C=O)N MCULE-7327608541 [0,1,0,0,0,0|2,0,1]=4 370 B11R1.464 NC=C1C(=O)NC(=O)NC1=O MCULE-1330083153 [0,1,0,0,0,0|1,0,0]=2 371 B11R1.464 O=C1NC(=O)C(=NO)C(=O)N1 MCULE-7138709364 [0,1,0,0,0,0|1,0,1]=3 372 B11R1.464 O=C1NC(=S)NC(=O)C1=NO MCULE-4474864402 [0,1,0,0,0,0|1,1,1]=4 373 B11R1.464 O=CC1C(=O)NC(=O)NC1=O MCULE-3411679664 [0,1,0,0,0,0|2,0,1]=4 374 B11R1.553 CC1(C(=O)NC(=O)NC1=O)C MCULE-6485766357 [0,1,0,0,0,0|2,0,1]=4 375 B11R1.553 O=C1NC(=O)C(C(=O)N1)(Br)Br MCULE-8346351406 [0,1,0,0,0,0|2,0,1]=4 376 B11R1.553 O=C1NC(=O)C(C(=O)N1)(F)F MCULE-6947611615 [0,1,0,0,0,0|2,0,1]=4 377 B11R1.553 O=C1NC(=O)C(C(=O)N1)(O)O MCULE-6660159645 [0,1,0,0,0,0|2,0,1]=4 378 B9R1.37 CC1=C(C(=O)OC1=O)Br MCULE-4236448899 [0,0,0,0,1,0|3,0,0]=4 379 B9R1.37 CC1=C(C(=O)OC1=O)C MCULE-9372782914 [0,0,0,0,1,0|3,0,0]=4 380 B9R1.37 CN1C(=O)NC(=O)C1=O MCULE-3910177119 [0,0,0,0,1,0|3,0,0]=4 381 B9R1.37 NN1C(=O)NC(=O)C1=O MCULE-8303778577 [0,0,0,0,1,0|2,0,0]=3 382 B9R1.37 O=C1CC(=O)C(=C1Cl)Cl MCULE-2441107407 [0,0,0,0,1,0|3,0,0]=4 383 B9R1.37 O=C1NC(=O)C(=C1Br)Br MCULE-9909317409 [0,0,0,0,1,0|2,0,0]=3 384 B9R1.37 O=C1NC(=O)C(=C1Cl)Cl MCULE-3248050786 [0,0,0,0,1,0|2,0,0]=3 385 B9R1.37 O=C1OC(=O)C(=C1Br)Br MCULE-7801791381 [0,0,0,0,1,0|3,0,0]=4 386 B9R1.37 O=C1OC(=O)C(=C1Cl)Cl MCULE-3675808148 [0,0,0,0,1,0|3,0,0]=4 387 B9R1.37 O=C1OC(=O)C(=C1F)F MCULE-6538599714 [0,0,0,0,1,0|3,0,0]=4 388 B9R1.37 O=C1SC(=O)C(=C1Cl)Cl MCULE-4755150756 [0,0,0,0,1,0|3,0,0]=4 389 B8R0.23 CC(=O)NC(=O)C(=O)N MCULE-2486343722 [1,0,1,0,0,0|2,0,0]=4 390 B8R0.23 NC(=O)C=C(N)C(=O)N MCULE-1435081726 [1,0,1,0,0,0|1,0,0]=3 391 B8R0.23 NC(=O)C[C@@H](N)C(=O)N MCULE-7126009795 [1,0,1,0,0,0|1,0,1]=4 392 B8R0.23 NC(=O)C[C@H](N)C(=O)N MCULE-3049784970 [1,0,1,0,0,0|1,0,1]=4 393 B8R0.23 NC(=O)C[C@H](N)C(=O)N MCULE-6209092318 [1,0,1,0,0,0|1,0,1]=4 394 B8R0.23 NC(=O)C[C@H](N)C(=O)N MCULE-7482170747 [1,0,1,0,0,0|1,0,1]=4 395 B8R0.23 NC(=O)C[C@H](N)C(=O)N MCULE-8939291995 [1,0,1,0,0,0|1,0,1]=4 396 B8R0.19 C=CC(=O)NC(=O)NC MCULE-7491775676 [1,0,1,0,0,0|1,0,1]=4 397 B8R0.19 NNC(=O)CC(=O)NN MCULE-3735369273 [1,0,1,0,0,0|2,0,0]=4 398 B8R1.4 CC1=CC(=O)NC=N1 MCULE-4546584000 [2,0,0,0,0,0|1,0,1]=4 399 B8R1.4 CC1=CC(=O)NON1 MCULE-9289039883 [2,0,0,0,0,0|2,0,0]=4 400 B8R1.4 CC1=CC=CC(=O)N1 MCULE-2763977381 [2,0,0,0,0,0|2,0,0]=4 401 B8R1.4 CC1=CC=NC(=O)N1 MCULE-6541642341 [2,0,0,0,0,0|1,0,1]=4 402 B8R1.4 CC1=NC(=O)C=CN1 MCULE-5044952802 [2,0,0,0,0,0|1,0,1]=4 403 B8R1.4 CC1=NC(=O)NC=C1 MCULE-2973571138 [2,0,0,0,0,0|1,0,1]=4 404 B8R1.4 NC1=CC(=O)NN=C1 MCULE-1959597477 [2,0,0,0,0,0|2,0,0]=4 405 B8R1.4 NC1=CN=CC(=O)N1 MCULE-3785264411 [2,0,0,0,0,0|2,0,0]=4 406 B8R1.4 NC1=NC(=O)NC=C1 MCULE-4426252594 [2,0,0,0,0,0|0,0,1]=3 407 B8R1.4 NC1=NC(=O)NC=C1 MCULE-5444602171 [2,0,0,0,0,0|0,0,1]=3 408 B8R1.4 NC1=NC(=O)NN=C1 MCULE-5047415100 [2,0,0,0,0,0|1,0,1]=4 409 B8R1.4 NC1=NC=CC(=O)N1 MCULE-7474139826 [2,0,0,0,0,0|1,0,1]=4 410 B8R1.4 NC1=NC=NC(=O)N1 MCULE-2741288744 [2,0,0,0,0,0|1,0,1]=4 411 B8R1.4 O=C1C=C(C=CN1)F MCULE-3668200526 [2,0,0,0,0,0|2,0,0]=4 412 B8R1.4 O=C1C=C(C=CN1)I MCULE-3087331274 [2,0,0,0,0,0|2,0,0]=4 413 B8R1.4 O=C1C=C(NC=N1)Br MCULE-2673426547 [2,0,0,0,0,0|1,0,1]=4 414 B8R1.4 O=C1C=CC=C(N1)Cl MCULE-5990074384 [2,0,0,0,0,0|2,0,0]=4 415 B8R1.4 O=C1C=CC=C(N1)I MCULE-7962501587 [2,0,0,0,0,0|2,0,0]=4 416 B8R1.4 O=C1C=CNC(=O)C1 MCULE-7422070219 [2,0,0,0,0,0|1,0,0]=3 417 B8R1.4 O=C1C=CNC(=O)O1 MCULE-3791093466 [2,0,0,0,0,0|1,0,0]=3 418 B8R1.4 O=C1C=CNC(=[Se])N1 MCULE-7954757005 [2,0,0,0,0,0|0,1,0]=3 419 B8R1.4 O=C1C=COC(=O)C1 MCULE-9289887221 [2,0,0,0,0,0|2,0,0]=4 420 B8R1.4 O=C1CC(=O)NC=N1 MCULE-1818472509 [2,0,0,0,0,0|2,0,0]=4 421 B8R1.4 O=C1CCNC(=O)N1 MCULE-8986910982 [2,0,0,0,0,0|0,0,2]=4 422 B8R1.4 O=C1N=C(C=CN1)Cl MCULE-6239849546 [2,0,0,0,0,0|1,0,1]=4 423 B8R1.4 O=C1N=CNC(=O)N1 MCULE-2256730820 [2,0,0,0,0,0|1,0,0]=3 424 B8R1.4 O=C1NCNC(=O)N1 MCULE-7478557250 [2,0,0,0,0,0|1,0,1]=4 425 B8R1.4 O=C1NN=CC(=S)N1 MCULE-8520073366 [2,0,0,0,0,0|1,1,0]=4 426 B8R1.5 CC1=CC=CNC1=O MCULE-8735614074 [2,0,0,0,0,0|2,0,0]=4 427 B8R1.5 NC1=C(C=CC=C1)N MCULE-9134155552 [2,0,0,0,0,0|2,0,0]=4 428 B8R1.5 NC1=C(C=NC=C1)N MCULE-5478459845 [2,0,0,0,0,0|1,0,1]=4 429 B8R1.5 NC1=C(N=CN=C1)N MCULE-4783422414 [2,0,0,0,0,0|0,0,2]=4 430 B8R1.5 NC1=C(N=CN=C1)N MCULE-9035668313 [2,0,0,0,0,0|0,0,2]=4 431 B8R1.5 NC1=CC=CC=C1N MCULE-4525715302 [2,0,0,0,0,0|2,0,0]=4 432 B8R1.5 NC1=CC=CC=C1N MCULE-6086072969 [2,0,0,0,0,0|2,0,0]=4 433 B8R1.5 NC1=CC=CN=C1N MCULE-3047996423 [2,0,0,0,0,0|1,0,1]=4 434 B8R1.5 NC1=CC=CNC1=O MCULE-2705834056 [2,0,0,0,0,0|1,0,0]=3 435 B8R1.5 NC1=CC=NC=C1N MCULE-4487058988 [2,0,0,0,0,0|1,0,1]=4 436 B8R1.5 NC1=CC=NNC1=O MCULE-8399809124 [2,0,0,0,0,0|2,0,0]=4 437 B8R1.5 NC1=CN=CNC1=O MCULE-3512580009 [2,0,0,0,0,0|0,0,1]=3 438 B8R1.5 NC1=CN=CNC1=S MCULE-8218091036 [2,0,0,0,0,0|0,1,1]=4 439 B8R1.5 NC1=CNC=NC1=O MCULE-8037468633 [2,0,0,0,0,0|0,0,1]=3 440 B8R1.5 NC1=NC=CNC1=O MCULE-6254794637 [2,0,0,0,0,0|2,0,0]=4 441 B8R1.5 O=C1N=CNC=C1O MCULE-7853986404 [2,0,0,0,0,0|1,0,1]=4 442 B8R1.5 O=C1NC=NC=C1Br MCULE-1914932585 [2,0,0,0,0,0|1,0,1]=4 443 B8R1.5 O=C1NC=NC=C1Br MCULE-4797439815 [2,0,0,0,0,0|1,0,1]=4 444 B8R1.5 O=C1NC=NC=C1Br MCULE-8279175534 [2,0,0,0,0,0|1,0,1]=4 445 B8R1.5 O=C1NC=NC=C1O MCULE-6640057101 [2,0,0,0,0,0|1,0,1]=4 446 B8R1.3 NC1=CNC(=O)N=C1 MCULE-2442673142 [2,0,0,0,0,0|0,0,1]=3 447 B8R1.3 O=C1C=CC(=CN1)Br MCULE-5174732595 [2,0,0,0,0,0|2,0,0]=4 448 B8R1.3 O=C1N=CC(=CN1)Br MCULE-9370622613 [2,0,0,0,0,0|1,0,1]=4 449 B8R1.3 O=C1N=CC(=CN1)F MCULE-6016921664 [2,0,0,0,0,0|1,0,1]=4 450 B8R1.3 O=C1N=CC(=CN1)O MCULE-9708220927 [2,0,0,0,0,0|1,0,1]=4 451 B10R0.144 C(=C(CC)C(=O)NC(=O)N)C MCULE-4660531154 [0,1,1,0,0,0|2,0,0]=4 452 B10R1.119 CC1=C(C(=O)NC=C1Cl)N MCULE-1151489999 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.119 CC1=NNC(=O)C(=C1N)N MCULE-9021748635 [1,1,0,0,0,0|2,0,0]=4 454 B10R1.119 CN1C=CC(=C(C1=O)N)O MCULE-3580421459 [1,1,0,0,0,0|2,0,0]=4 455 B10R1.119 CN1C=CC(=C(C1=O)N)O MCULE-8712131211 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.119 CN1C=NC(=C(C1=O)N)Cl MCULE-8027934861 [1,1,0,0,0,0|1,0,1]=4 457 B10R1.119 CN1N=CC(=C(C1=O)N)N MCULE-6999627521 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.245 CC1=C(C(=O)NC=C1)CN MCULE-4432996647 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.245 N#CC1=C(N=CNC1=O)N MCULE-6559198740 [1,1,0,0,0,0|0,0,2]=4 460 B10R1.8 C=CC1=CC(=O)NC(=O)N1 MCULE-7194319105 [1,1,0,0,0,0|1,0,0]=3 461 B10R1.8 CC1=CC(=CC(=O)N1)CN MCULE-2284099896 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.8 CC1=CC(=CC(=O)N1)CN MCULE-4829375140 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.8 CCC1=CC(=O)NC(=O)N1 MCULE-1656089601 [1,1,0,0,0,0|1,0,0]=3 464 B10R1.8 CCC1=CC(=O)NC(=S)N1 MCULE-6071312738 [1,1,0,0,0,0|1,1,0]=4 465 B10R1.8 CNC1=CC(=O)NC(=O)N1 MCULE-5972679940 [1,1,0,0,0,0|0,0,0]=2 466 B10R1.8 COC1=CC(=O)NC(=O)N1 MCULE-5375145256 [1,1,0,0,0,0|1,0,0]=3 467 B10R1.8 COC1=NC(=CC(=O)N1)N MCULE-2072235471 [1,1,0,0,0,0|0,0,2]=4 468 B10R1.8 CSC1=NC(=CC(=O)N1)N MCULE-4414653199 [1,1,0,0,0,0|0,1,1]=4 469 B10R1.8 CSC1NC(=O)C=C(N1)N MCULE-9417952446 [1,1,0,0,0,0|0,1,1]=4 470 B10R1.8 NC1=NC(=O)NC(=C1)CO MCULE-6855905544 [1,1,0,0,0,0|0,0,2]=4 471 B10R1.8 NCC1=CC(=O)NC(=N1)S MCULE-3429535295 [1,1,0,0,0,0|0,1,1]=4 472 B10R1.8 NCC1=CC(=O)NC(=N1)S MCULE-7445446284 [1,1,0,0,0,0|0,1,1]=4 473 B10R1.8 NCC1=CC(=O)NC(=O)N1 MCULE-3879084303 [1,1,0,0,0,0|0,0,0]=2 474 B10R1.8 NCC1=CC(=O)NC(=O)N1 MCULE-8158860012 [1,1,0,0,0,0|0,0,0]=2 475 B10R1.8 NNC1=CC(=O)NC(=O)N1 MCULE-1469229530 [1,1,0,0,0,0|0,0,0]=2 476 B10R1.8 NNC1=NC(=CC(=O)N1)N MCULE-9228411728 [1,1,0,0,0,0|1,0,1]=4 477 B10R1.8 O=C1C/C(=N\O)/NC(=O)N1 MCULE-3947010417 [1,1,0,0,0,0|0,0,2]=4 478 B10R1.8 O=C1C=C(NC(=O)N1)CBr MCULE-1615723991 [1,1,0,0,0,0|1,0,0]=3 479 B10R1.8 O=C1C=C(NC(=O)N1)CCl MCULE-8212962530 [1,1,0,0,0,0|1,0,0]=3 480 B10R1.8 O=C1C=C(NC(=O)N1)CO MCULE-5458955186 [1,1,0,0,0,0|1,0,0]=3 481 B10R1.8 O=C1C=C(NC(=S)N1)CO MCULE-6688543299 [1,1,0,0,0,0|1,1,0]=4 482 B10R1.8 O=CC1=CC(=O)NC(=O)N1 MCULE-5989318185 [1,1,0,0,0,0|1,0,0]=3 483 B10R1.8 O=CC1=CC(=O)NC(=S)N1 MCULE-9142470762 [1,1,0,0,0,0|1,1,0]=4 484 B10R1.25 C#CC1=CNC(=O)N=C1N MCULE-5447625605 [1,1,0,0,0,0|1,0,1]=4 485 B10R1.25 C=CC1=C(NC(=O)N=C1)N MCULE-5652210899 [1,1,0,0,0,0|1,0,1]=4 486 B10R1.25 C=CC1=CNC(=O)NC1=O MCULE-6275433808 [1,1,0,0,0,0|1,0,0]=3 487 B10R1.25 CC1=CC=C(C(=O)N1)CN MCULE-1957647342 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.25 CC1=CC=C(C(=O)N1)CN MCULE-2336990661 [1,1,0,0,0,0|2,0,0]=4 489 B10R1.25 CC1=CC=C(C(=O)N1)CN MCULE-3359434666 [1,1,0,0,0,0|2,0,0]=4 490 B10R1.25 CCC1=CNC(=O)NC1=O MCULE-1403338036 [1,1,0,0,0,0|1,0,0]=3 491 B10R1.25 CCC1=CNC(=S)NC1=O MCULE-5198506906 [1,1,0,0,0,0|1,1,0]=4 492 B10R1.25 CCC1=NNC(=O)NC1=O MCULE-9997971509 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.25 CNC1=CNC(=O)NC1=O MCULE-7197367879 [1,1,0,0,0,0|0,0,0]=2 494 B10R1.25 CNC1=NNC(=O)NC1=O MCULE-1745121001 [1,1,0,0,0,0|1,0,0]=3 495 B10R1.25 CNC1=NNC(=O)NC1=O MCULE-5399825497 [1,1,0,0,0,0|1,0,0]=3 496 B10R1.25 CSC1=NNC(=O)NC1=O MCULE-9991928243 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.25 C[Se]C1=CNC(=O)NC1=O MCULE-7379851342 [1,1,0,0,0,0|1,0,0]=3 498 B10R1.25 N#CC1=CNC(=O)N=C1N MCULE-6407322719 [1,1,0,0,0,0|0,0,2]=4 499 B10R1.25 N#CC1=CNC(=O)NC1=O MCULE-9074750047 [1,1,0,0,0,0|0,0,1]=3 500 B10R1.25 NC1=C(C=NC(=O)N1)C=O MCULE-6459384186 [1,1,0,0,0,0|1,0,1]=4 501 B10R1.25 NCC1=CNC(=O)NC1=O MCULE-3166341604 [1,1,0,0,0,0|0,0,0]=2 502 B10R1.25 NCC1=CNC(=O)NC1=O MCULE-7365523007 [1,1,0,0,0,0|0,0,0]=2 503 B10R1.25 NNC1=NNC(=O)NC1=O MCULE-1748748455 [1,1,0,0,0,0|1,0,0]=3 504 B10R1.25 O=C1NC=C(C(=O)N1)CCl MCULE-8124898362 [1,1,0,0,0,0|1,0,0]=3 505 B10R1.25 O=C1NC=C(C(=O)N1)CO MCULE-2866555326 [1,1,0,0,0,0|1,0,0]=3 506 B10R1.25 O=C1NC=C(C(=O)N1)CS MCULE-1412623155 [1,1,0,0,0,0|1,0,0]=3 507 B10R1.25 O=C1NN=C(C(=O)N1)CCl MCULE-9818168516 [1,1,0,0,0,0|2,0,0]=4 508 B10R1.30 CNC1=C(C=NC(=O)N1)F MCULE-6418967238 [1,1,0,0,0,0|1,0,1]=4 509 B10R1.118 CC1=C(NC(=O)C(=C1)N)C MCULE-8346394760 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.118 CC1=CC(=O)N(C=C1N)C MCULE-3475563427 [1,1,0,0,0,0|2,0,0]=4 511 B10R1.118 CC1=CN(C(=O)NC1=O)C MCULE-2359700701 [1,1,0,0,0,0|1,0,0]=3 512 B10R1.118 CC1=NN(C(=O)NC1=O)C MCULE-2065520759 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.118 CN1C=C(C(=CC1=O)N)Br MCULE-7538545149 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.118 CN1C=C(C(=CC1=O)N)Br MCULE-9385943306 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.118 CN1C=C(C(=O)NC1=O)Br MCULE-9797104008 [1,1,0,0,0,0|1,0,0]=3 516 B10R1.118 CN1C=C(C(=O)NC1=O)F MCULE-3423067623 [1,1,0,0,0,0|1,0,0]=3 517 B10R1.118 CN1C=C(C(=O)NC1=O)I MCULE-4446207931 [1,1,0,0,0,0|1,0,0]=3 518 B10R1.118 CN1C=C(C(=O)NC1=O)N MCULE-1839355087 [1,1,0,0,0,0|0,0,0]=2 519 B10R1.118 NC1=C(C=C(C(=O)N1)Br)Br MCULE-1214298892 [1,1,0,0,0,0|2,0,0]=4 520 B10R1.176 NC1=CN=C(C=C1N)C=O MCULE-3804134847 [1,1,0,0,0,0|1,0,1]=4 521 B10R1.176 O=CC1=CC(=O)C(=CN1)O MCULE-9904953554 [1,1,0,0,0,0|2,0,0]=4 522 B10R1.176 O=CC1=CC(=O)C(=CN1)O MCULE-9987658826 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.191 CN1C(=O)C(=C(C1=O)Br)Br MCULE-8078817718 [0,1,0,0,1,0|2,0,0]=4 524 B10R1.191 CN1C(=O)C(=C(C1=O)Cl)Cl MCULE-4304184494 [0,1,0,0,1,0|2,0,0]=4 525 B10R1.256 CC1=C(C(=O)NC1=O)CBr MCULE-5451248513 [0,1,0,0,1,0|2,0,0]=4 526 B10R1.256 CCC1=C(C(=O)NC1=O)C MCULE-8166231468 [0,1,0,0,1,0|2,0,0]=4 527 B12R1.14 CSC1=NC(=C(C(=O)N1C)N)N MCULE-6404578642 [0,2,0,0,0,0|0,1,1]=4 528 B12R1.234 CCC1=C(C(=O)NC(=O)N1)C#N MCULE-6130075375 [0,2,0,0,0,0|1,0,1]=4 529 B12R1.234 CSC1=C(C(=O)NC(=O)N1)C#N MCULE-8865372446 [0,2,0,0,0,0|1,0,1]=4 530 B12R1.300 CNC1=C(C(=O)N=C(N1)SC)N MCULE-8056138337 [0,2,0,0,0,0|0,1,1]=4 531 B12R1.511 CC1=C(NC(=O)NC1=O)C(=O)O MCULE-3566351709 [0,2,0,0,0,0|2,0,0]=4 532 B12R1.511 NC1=C(NC(=O)NC1=O)C(=O)O MCULE-8801103464 [0,2,0,0,0,0|1,0,0]=3 533 B12R1.511 O=C1NC(=O)C(=C(N1)C(=O)O)F MCULE-2856865842 [0,2,0,0,0,0|2,0,0]=4 534 B12R1.98 CC1=C(C(=O)NC(=O)N1C)C#N MCULE-8095702213 [0,2,0,0,0,0|1,0,1]=4 535 B12R1.98 CCC1=C(N(C(=O)NC1=O)C)N MCULE-8066013683 [0,2,0,0,0,0|1,0,0]=3 536 B12R1.98 CCN1C(=O)NC(=O)C(=C1N)Br MCULE-4981022781 [0,2,0,0,0,0|1,0,0]=3 537 B12R1.98 CN1C(=O)NC(=C(C1=O)C#N)Cl MCULE-3014908422 [0,2,0,0,0,0|1,0,1]=4 538 B12R1.98 CN1C(=O)NC(=C(C1=O)N=O)N MCULE-6305355795 [0,2,0,0,0,0|0,0,1]=3 539 B12R1.98 CN1C(=O)NC(=O)C(=C1N)N=O MCULE-7429670928 [0,2,0,0,0,0|0,0,1]=3 540 B12R1.98 CNC1=C(N(C(=O)NC1=O)C)N MCULE-4827899462 [0,2,0,0,0,0|0,0,0]=2 541 B12R1.3795 CC1=C(C(=O)N(C(=O)N1C)C)Br MCULE-3424332418 [0,2,0,0,0,0|2,0,0]=4 542 B12R1.3795 CC1=C(C(=O)N(C(=O)N1C)C)I MCULE-5332487235 [0,2,0,0,0,0|2,0,0]=4 543 B12R1.3795 CC1=C(C(=O)N(C(=O)N1C)C)N MCULE-8713902873 [0,2,0,0,0,0|1,0,0]=3 544 B12R1.3795 CC1=C(N(C(=O)N(C1=O)C)C)N MCULE-1961562707 [0,2,0,0,0,0|1,0,0]=3 545 B12R1.3795 CN1C(=O)C(=C(N(C1=O)C)N)Br MCULE-7639646545 [0,2,0,0,0,0|1,0,0]=3 546 B12R1.3795 CN1C(=O)C(=C(N(C1=O)C)N)N MCULE-8755086060 [0,2,0,0,0,0|0,0,0]=2 547 B12R1.3795 [NH3+]C1=C(C(=O)N(C(=O)N1C)C)N MCULE-6497272915 [0,2,0,0,0,0|0,0,1]=3 548 B12R1.1000 CC(=C1C(=O)NC(=O)NC1=O)O MCULE-8423064884 [0,2,0,0,0,0|2,0,0]=4 549 B12R1.1000 CC(=O)C1=C(NC(=O)NC1=O)C MCULE-8104235546 [0,2,0,0,0,0|2,0,0]=4 550 B12R1.1000 CC(=O)C1=C(NC(=O)NC1=O)O MCULE-7054297946 [0,2,0,0,0,0|2,0,0]=4 551 B12R1.1000 CC(C)C1=C(NC(=O)NC1=O)Cl MCULE-3603882440 [0,2,0,0,0,0|2,0,0]=4 552 B12R1.1000 CN(C)N1C(=O)NC(=O)C=C1N MCULE-9783184568 [0,2,0,0,0,0|2,0,0]=4 553 B12R1.1000 NC(=O)C1=C(C=C(NC1=O)O)N MCULE-8310805262 [0,2,0,0,0,0|1,0,1]=4 554 B12R1.1000 NC(=O)C1=C(NC(=O)NC1=O)O MCULE-8984409751 [0,2,0,0,0,0|1,0,0]=3 555 B12R1.1000 NC1=C(C(=O)NC(=S)N1)N(=O)=O MCULE-1408499398 [0,2,0,0,0,0|0,1,1]=4 556 B12R1.1000 O=C1NC(=O)C(=C(N1)Cl)N(=O)=O MCULE-9349511299 [0,2,0,0,0,0|1,0,1]=4 557 B12R1.1000 O=C1NC(=O)C(=C(N1)O)N(=O)=O MCULE-9050792789 [0,2,0,0,0,0|1,0,1]=4 558 B12R1.1095 CC1=C(C(=O)NC(=O)N1)C=NO MCULE-4506830201 [0,2,0,0,0,0|1,0,1]=4 559 B12R1.1095 CC1=C(C(=O)NC(=O)N1)CCO MCULE-3952304372 [0,2,0,0,0,0|2,0,0]=4 560 B12R1.1095 CCCC1=C(NC(=O)NC1=O)N MCULE-5269842283 [0,2,0,0,0,0|1,0,0]=3 561 B12R1.1095 CN=CC1=C(NC(=O)NC1=O)O MCULE-2337206303 [0,2,0,0,0,0|1,0,1]=4 562 B12R1.1095 CNC=C1C(=O)NC(=S)NC1=O MCULE-7780743077 [0,2,0,0,0,0|1,1,0]=4 563 B12R1.1095 NC1=NC(=O)NC(=C1NC=O)N MCULE-4021260181 [0,2,0,0,0,0|1,0,1]=4 564 B12R1.1095 O=C1NC(=S)NC(=O)C1=CNO MCULE-1063724733 [0,2,0,0,0,0|1,1,0]=4 565 B10R1.59 CC(=C1NC(=O)NC1=O)C MCULE-7822860475 [0,0,1,1,0,0|2,0,0]=4 566 B10R1.59 CC(=O)C1=C(NC(=O)N1)C MCULE-7841084710 [0,0,1,1,0,0|2,0,0]=4 567 B10R1.59 CC1=C(NC(=O)N1)C(=O)O MCULE-4489172846 [0,0,1,1,0,0|2,0,0]=4 568 B10R1.59 CC1=NC(=C(N1)N)C(=O)N MCULE-2256523336 [0,0,1,1,0,0|1,0,1]=4 569 B10R1.59 NC(=O)C1=C(NC(=S)N1)N MCULE-6506690817 [0,0,1,1,0,0|0,1,0]=3 570 B10R1.59 NC(=O)C1=C(SC(=S)N1)N MCULE-2569610340 [0,0,1,1,0,0|1,1,0]=4 571 B12R2.246 N1C=NC2=C1NC(=N)NC2=O MCULE-9402241731 [0,1,0,1,0,0|1,0,1]=4 572 B12R2.246 N=C1NC(=O)C2=C(N1)NN=N2 MCULE-1863790805 [0,1,0,1,0,0|1,0,1]=4 573 B12R2.246 NC1=C2C=CN=C2NC(=O)N1 MCULE-1073458055 [0,1,0,1,0,0|2,0,0]=4 574 B12R2.246 NC1=C2NC=NC2=NC(=O)N1 MCULE-1203928835 [0,1,0,1,0,0|1,0,1]=4 575 B12R2.246 O=C1NC(=O)C2=C(N1)C=CN2 MCULE-6069519505 [0,1,0,1,0,0|1,0,0]=3 576 B12R2.246 O=C1NC(=O)C2=C(N1)C=NN2 MCULE-5322834843 [0,1,0,1,0,0|0,0,1]=3 577 B12R2.246 O=C1NC(=O)C2=C(N1)CCC2 MCULE-2036882434 [0,1,0,1,0,0|2,0,0]=4 578 B12R2.246 O=C1NC(=O)C2=C(N1)CCS2 MCULE-5307345388 [0,1,0,1,0,0|2,0,0]=4 579 B12R2.246 O=C1NC(=O)C2=C(N1)CNC2 MCULE-7586984034 [0,1,0,1,0,0|1,0,0]=3 580 B12R2.246 O=C1NC(=O)C2=C(N1)CNC2 MCULE-8653470026 [0,1,0,1,0,0|1,0,0]=3 581 B12R2.246 O=C1NC(=O)C2=C(N1)COC2 MCULE-7021590045 [0,1,0,1,0,0|2,0,0]=4 582 B12R2.246 O=C1NC(=O)C2=C(N1)N=CS2 MCULE-7384114601 [0,1,0,1,0,0|1,0,1]=4 583 B12R2.246 O=C1NC(=O)C2=C(N1)NC=N2 MCULE-6687728468 [0,1,0,1,0,0|0,0,1]=3 584 B12R2.246 O=C1NC(=O)C2=C(N1)NCC2 MCULE-9531793708 [0,1,0,1,0,0|1,0,0]=3 585 B12R2.246 O=C1NC(=O)C2=C(N1)NC[N-]2 MCULE-2209168754 [0,1,0,1,0,0|0,0,1]=3 586 B12R2.246 O=C1NC(=O)C2=C(N1)NC[N-]2 MCULE-5827542960 [0,1,0,1,0,0|0,0,1]=3 587 B12R2.246 O=C1NC(=O)C2=C(N1)SC=C2 MCULE-4550777126 [0,1,0,1,0,0|2,0,0]=4 588 B12R2.246 O=C1NC(=O)C2=CSC=C2N1 MCULE-7402113035 [0,1,0,1,0,0|2,0,0]=4 589 B12R2.246 O=C1NC(=O)C2=NSN=C2N1 MCULE-5332384136 [0,1,0,1,0,0|0,0,2]=4 590 B12R2.246 O=C1NC(=S)NC2=C1CCN2 MCULE-2419018258 [0,1,0,1,0,0|1,1,0]=4 591 B12R2.246 O=C1NC(=S)NC2=C1NC=N2 MCULE-3793470910 [0,1,0,1,0,0|0,1,1]=4 592 B8R1.50 CC1=C(C(=O)NN1)Br MCULE-1547416734 [1,0,0,0,1,0|2,0,0]=4 593 B8R1.50 CC1=C(C(=O)NN1)N MCULE-2893871378 [1,0,0,0,1,0|1,0,0]=3 594 B8R1.50 CC1=C(C(=O)NN1)N MCULE-8633976044 [1,0,0,0,1,0|1,0,0]=3 595 B8R1.50 CC1=NNC(=C1N)N MCULE-5572064442 [1,0,0,0,1,0|1,0,1]=4 596 B8R1.50 CC1=NNC(=C1N)N MCULE-6900057368 [1,0,0,0,1,0|1,0,1]=4 597 B8R1.50 NC1=NNC(=C1N)O MCULE-8953815081 [1,0,0,0,1,0|0,0,2]=4 598 B8R1.50 NN1C(=O)NNC1=O MCULE-6234762498 [1,0,0,0,1,0|2,0,0]=4 599 B8R1.50 [NH3+]C1=C(C(=O)NN1)N MCULE-6101059606 [1,0,0,0,1,0|0,0,1]=3 600 B8R1.18 CC1=C(NC(=O)N1)C MCULE-1459949338 [1,0,0,0,1,0|2,0,0]=4 601 B8R1.18 CC1=CC(=O)NC1=O MCULE-3109096484 [1,0,0,0,1,0|1,0,0]=3 602 B8R1.18 CC1=CC(=O)OC1=O MCULE-1735822163 [1,0,0,0,1,0|2,0,0]=4 603 B8R1.18 CC1NC(=O)NC1=O MCULE-4619149186 [1,0,0,0,1,0|1,0,1]=4 604 B8R1.18 CN1NC(=CC1=O)N MCULE-9402016986 [1,0,0,0,1,0|2,0,0]=4 605 B8R1.18 CN1NC(=O)C=C1N MCULE-9124998543 [1,0,0,0,1,0|2,0,0]=4 606 B8R1.18 C[C@@H]1NC(=O)NC1=O MCULE-1126054848 [1,0,0,0,1,0|1,0,1]=4 607 B8R1.18 C[C@H]1NC(=O)NC1=O MCULE-5443325319 [1,0,0,0,1,0|1,0,1]=4 608 B8R1.18 NC1CC(=O)NC1=O MCULE-6692452440 [1,0,0,0,1,0|0,0,2]=4 609 B8R1.18 NC1CC(=O)NC1=O MCULE-8447671567 [1,0,0,0,1,0|0,0,2]=4 610 B8R1.18 NC1SC(=O)NC1=O MCULE-8460816262 [1,0,0,0,1,0|1,0,1]=4 611 B8R1.18 NN1CC(=O)NC1=O MCULE-6319474334 [1,0,0,0,1,0|1,0,1]=4 612 B8R1.18 NN1CC(=O)NC1=O MCULE-7370713803 [1,0,0,0,1,0|1,0,1]=4 613 B8R1.18 N[C@@H]1CC(=O)NC1=O MCULE-1292090753 [1,0,0,0,1,0|0,0,2]=4 614 B8R1.18 N[C@@H]1CC(=O)NC1=O MCULE-9676397018 [1,0,0,0,1,0|0,0,2]=4 615 B8R1.18 N[C@H]1CC(=O)NC1=O MCULE-1052396743 [1,0,0,0,1,0|0,0,2]=4 616 B8R1.18 N[C@H]1CC(=O)NC1=O MCULE-1965803095 [1,0,0,0,1,0|0,0,2]=4 617 B8R1.18 O=C1C=C(C(=O)N1)Br MCULE-6173415556 [1,0,0,0,1,0|1,0,0]=3 618 B8R1.18 O=C1C=C(C(=O)O1)Br MCULE-2984870530 [1,0,0,0,1,0|2,0,0]=4 619 B8R1.18 O=C1N=C(NC1=O)S MCULE-9704398967 [1,0,0,0,1,0|2,0,0]=4 620 B8R1.18 O=C1NC(=O)C(=O)N1 MCULE-1683872231 [1,0,0,0,1,0|1,0,0]=3 621 B8R1.18 O=C1NC(=O)C(N1)Br MCULE-9177153028 [1,0,0,0,1,0|1,0,1]=4 622 B8R1.25 NC1=C(C(=O)C1=O)N MCULE-4129663118 [0,0,0,0,2,0|0,0,0]=2 623 B8R1.25 NC1=C(C(=O)C1=O)O MCULE-8486046042 [0,0,0,0,2,0|1,0,0]=3 624 B8R1.25 O=C1C(=O)C(=C1Cl)Cl MCULE-4179567999 [0,0,0,0,2,0|2,0,0]=4 625 B8R1.25 O=C1C(=O)C(=C1O)O MCULE-1517845681 [0,0,0,0,2,0|2,0,0]=4