0 B11R1.35 CC(=CC1=CC=CO1)C(=O)O MCULE-2925151764 [0,0,0,0,0,0|1,1,2]=4 1 B11R1.35 CC(=CC1=CC=CS1)C(=O)O MCULE-9297953193 [0,0,0,0,0,0|1,0,2]=3 2 B11R1.35 CC(=O)C(N)CC1=CN=CN1 MCULE-6260192166 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.35 CC(=O)C(N)CC1=CN=CN1 MCULE-9245260061 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.35 CC(CC1=CC=CN1)C(=O)O MCULE-7927079223 [0,0,0,0,0,0|2,0,0]=2 5 B11R1.35 CC(CC1=CC=CO1)C(=O)O MCULE-4967866488 [0,0,0,0,0,0|1,1,0]=2 6 B11R1.35 CC(CC1=CC=CS1)C(=O)O MCULE-1903423673 [0,0,0,0,0,0|1,0,0]=1 7 B11R1.35 CC(CC1=CN=CN1)C(=O)O MCULE-2039778007 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.35 CC(CC1=CN=CN1)C(=O)O MCULE-8694921132 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.35 CC(CC1=CSC=C1)C(=O)O MCULE-9064961209 [0,0,0,0,0,0|3,0,0]=3 10 B11R1.35 CC(CN1C=CC=N1)C(=O)O MCULE-5293945141 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.35 CC(CN1C=CN=C1)C(=O)O MCULE-3369493356 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.35 CC(CN1C=CN=C1)C(=O)O MCULE-8150283325 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.35 CC(CN1C=NC=N1)C(=O)O MCULE-5941102084 [0,0,0,0,0,0|4,0,0]=4 14 B11R1.35 CC(SC1=CC=CS1)C(=O)O MCULE-5785755939 [0,0,0,0,0,0|2,0,0]=2 15 B11R1.35 CN(CC1=CC=CS1)C(=S)[S-] MCULE-5149895371 [0,0,0,0,0,0|2,2,0]=4 16 B11R1.35 CN(CC1=CC=CS1)C(=S)[S-] MCULE-8862403304 [0,0,0,0,0,0|2,2,0]=4 17 B11R1.35 C[C@H](NC1=CC=CO1)C(=O)O MCULE-9956836124 [0,0,0,0,0,0|2,1,0]=3 18 B11R1.35 C[C@H](NC1=CSC=C1)C(=O)O MCULE-2855153207 [0,0,0,0,0,0|4,0,0]=4 19 B11R1.35 C[C@H](NC1=CSC=N1)C(=O)O MCULE-5434211661 [0,0,0,0,0,0|4,0,0]=4 20 B11R1.35 C[C@H](NC1=NC=CS1)C(=O)O MCULE-5633842724 [0,0,0,0,0,0|3,0,0]=3 21 B11R1.35 NC(=O)C(N)CC1=CN=CN1 MCULE-3271168780 [0,0,0,0,0,0|3,0,0]=3 22 B11R1.35 NC(=O)C(N)CC1=CN=CN1 MCULE-8656151994 [0,0,0,0,0,0|3,0,0]=3 23 B11R1.35 NC(=O)C(N)CN1C=CC=N1 MCULE-8350079593 [0,0,0,0,0,0|3,0,0]=3 24 B11R1.35 NC(=O)C(N)CN1C=CN=C1 MCULE-5591969646 [0,0,0,0,0,0|4,0,0]=4 25 B11R1.35 NC(=O)[C@@H](N)CC1=CN=CN1 MCULE-6359300232 [0,0,0,0,0,0|3,0,0]=3 26 B11R1.35 NC(=O)[C@@H](N)CC1=CN=CN1 MCULE-8961824149 [0,0,0,0,0,0|3,0,0]=3 27 B11R1.35 NC(=O)[C@@H](N)CC1=CNC=N1 MCULE-4694791114 [0,0,0,0,0,0|3,0,0]=3 28 B11R1.35 NC(=O)[C@@H](N)CC1=CNC=N1 MCULE-8086406127 [0,0,0,0,0,0|3,0,0]=3 29 B11R1.35 NC(CC1=CC=CN1)C(=O)O MCULE-2621735129 [0,0,0,0,0,0|1,0,0]=1 30 B11R1.35 NC(CC1=CC=CO1)C(=O)O MCULE-2615027072 [0,0,0,0,0,0|0,1,0]=1 31 B11R1.35 NC(CC1=CC=CO1)C(=O)O MCULE-5961212744 [0,0,0,0,0,0|0,1,0]=1 32 B11R1.35 NC(CC1=CC=CS1)C(=O)O MCULE-3785172886 [0,0,0,0,0,0|0,0,0]=0 33 B11R1.35 NC(CC1=CC=CS1)C(=O)O MCULE-8923550765 [0,0,0,0,0,0|0,0,0]=0 34 B11R1.35 NC(CC1=CCCC1)C(=O)O MCULE-1666440268 [0,0,0,0,0,0|1,0,2]=3 35 B11R1.35 NC(CC1=CN=CN1)C(=O)O MCULE-2221977105 [0,0,0,0,0,0|2,0,0]=2 36 B11R1.35 NC(CC1=CN=CN1)C(=O)O MCULE-4252889481 [0,0,0,0,0,0|2,0,0]=2 37 B11R1.35 NC(CC1=CN=CS1)C(=O)O MCULE-3561723067 [0,0,0,0,0,0|1,0,0]=1 38 B11R1.35 NC(CC1=CN=CS1)C(=O)O MCULE-7849285080 [0,0,0,0,0,0|1,0,0]=1 39 B11R1.35 NC(CC1=CN=CS1)C(=O)O MCULE-8240594688 [0,0,0,0,0,0|1,0,0]=1 40 B11R1.35 NC(CC1=CNC=C1)C(=O)O MCULE-9864992308 [0,0,0,0,0,0|2,0,0]=2 41 B11R1.35 NC(CC1=CNC=N1)C(=O)O MCULE-2923626784 [0,0,0,0,0,0|2,0,0]=2 42 B11R1.35 NC(CC1=CNC=N1)C(=O)O MCULE-6787534916 [0,0,0,0,0,0|2,0,0]=2 43 B11R1.35 NC(CC1=CNC=N1)C(=O)O MCULE-7525765487 [0,0,0,0,0,0|2,0,0]=2 44 B11R1.35 NC(CC1=COC=C1)C(=O)O MCULE-9216668765 [0,0,0,0,0,0|2,0,0]=2 45 B11R1.35 NC(CC1=CSC=C1)C(=O)O MCULE-9320828043 [0,0,0,0,0,0|2,0,0]=2 46 B11R1.35 NC(CC1=CSC=C1)C(=O)O MCULE-9372566296 [0,0,0,0,0,0|2,0,0]=2 47 B11R1.35 NC(CC1=CSC=N1)C(=O)O MCULE-2390356050 [0,0,0,0,0,0|2,0,0]=2 48 B11R1.35 NC(CC1=CSC=N1)C(=O)O MCULE-6340376441 [0,0,0,0,0,0|2,0,0]=2 49 B11R1.35 NC(CC1=CSC=N1)C(=O)O MCULE-7084475028 [0,0,0,0,0,0|2,0,0]=2 50 B11R1.35 NC(CC1=NC=CS1)C(=O)O MCULE-2355445124 [0,0,0,0,0,0|1,0,0]=1 51 B11R1.35 NC(CC1=NC=CS1)C(=O)O MCULE-8413492225 [0,0,0,0,0,0|1,0,0]=1 52 B11R1.35 NC(CC1=NN=CN1)C(=O)O MCULE-9972656521 [0,0,0,0,0,0|3,0,0]=3 53 B11R1.35 NC(CC1=NNC=C1)C(=O)O MCULE-8341443044 [0,0,0,0,0,0|2,0,0]=2 54 B11R1.35 NC(CC1=NNC=C1)C(=O)O MCULE-9363176690 [0,0,0,0,0,0|2,0,0]=2 55 B11R1.35 NC(CC1=NNC=N1)C(=O)O MCULE-8826640392 [0,0,0,0,0,0|3,0,0]=3 56 B11R1.35 NC(CN1C=CC=C1)C(=O)O MCULE-6420960159 [0,0,0,0,0,0|2,0,0]=2 57 B11R1.35 NC(CN1C=CC=N1)C(=O)O MCULE-3059611601 [0,0,0,0,0,0|2,0,0]=2 58 B11R1.35 NC(CN1C=CC=N1)C(=O)O MCULE-9483519317 [0,0,0,0,0,0|2,0,0]=2 59 B11R1.35 NC(CN1C=CN=C1)C(=O)O MCULE-2613680512 [0,0,0,0,0,0|3,0,0]=3 60 B11R1.35 NC(CN1C=NC=N1)C(=O)O MCULE-4430137430 [0,0,0,0,0,0|3,0,0]=3 61 B11R1.35 NC(CN1C=NC=N1)C(=O)O MCULE-7109186760 [0,0,0,0,0,0|3,0,0]=3 62 B11R1.35 NC(CN1N=CN=N1)C(=O)O MCULE-1580681279 [0,0,0,0,0,0|4,0,0]=4 63 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O MCULE-2369724288 [0,0,0,0,0,0|0,1,0]=1 64 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O MCULE-5803182238 [0,0,0,0,0,0|0,1,0]=1 65 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O MCULE-5920888333 [0,0,0,0,0,0|0,1,0]=1 66 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O MCULE-9717464601 [0,0,0,0,0,0|0,1,0]=1 67 B11R1.35 N[C@@H](CC1=CC=CS1)C(=O)O MCULE-3425714606 [0,0,0,0,0,0|0,0,0]=0 68 B11R1.35 N[C@@H](CC1=CC=CS1)C(=O)O MCULE-7666246740 [0,0,0,0,0,0|0,0,0]=0 69 B11R1.35 N[C@@H](CC1=CC=CS1)C(=O)O MCULE-8908733986 [0,0,0,0,0,0|0,0,0]=0 70 B11R1.35 N[C@@H](CC1=CCCC1)C(=O)O MCULE-1528714518 [0,0,0,0,0,0|1,0,2]=3 71 B11R1.35 N[C@@H](CC1=CCCC1)C(=O)O MCULE-5537876142 [0,0,0,0,0,0|1,0,2]=3 72 B11R1.35 N[C@@H](CC1=CN=CN1)C(=O)O MCULE-2087791673 [0,0,0,0,0,0|2,0,0]=2 73 B11R1.35 N[C@@H](CC1=CNC=C1)C(=O)O MCULE-7031820503 [0,0,0,0,0,0|2,0,0]=2 74 B11R1.35 N[C@@H](CC1=CNC=N1)C(=O)O MCULE-1155454458 [0,0,0,0,0,0|2,0,0]=2 75 B11R1.35 N[C@@H](CC1=CNC=N1)C(=O)O MCULE-4083000888 [0,0,0,0,0,0|2,0,0]=2 76 B11R1.35 N[C@@H](CC1=CNC=N1)C(=O)O MCULE-5599456266 [0,0,0,0,0,0|2,0,0]=2 77 B11R1.35 N[C@@H](CC1=CNC=N1)C(=O)O MCULE-7458236044 [0,0,0,0,0,0|2,0,0]=2 78 B11R1.35 N[C@@H](CC1=CNC=N1)C(=O)O MCULE-9282849595 [0,0,0,0,0,0|2,0,0]=2 79 B11R1.35 N[C@@H](CC1=CNC=N1)C(=O)O MCULE-9753735240 [0,0,0,0,0,0|2,0,0]=2 80 B11R1.35 N[C@@H](CC1=COC=C1)C(=O)O MCULE-1840395119 [0,0,0,0,0,0|2,0,0]=2 81 B11R1.35 N[C@@H](CC1=COC=C1)C(=O)O MCULE-2068883490 [0,0,0,0,0,0|2,0,0]=2 82 B11R1.35 N[C@@H](CC1=COC=C1)C(=O)O MCULE-2075437924 [0,0,0,0,0,0|2,0,0]=2 83 B11R1.35 N[C@@H](CC1=COC=C1)C(=O)O MCULE-5577531277 [0,0,0,0,0,0|2,0,0]=2 84 B11R1.35 N[C@@H](CC1=CSC=C1)C(=O)O MCULE-1834983933 [0,0,0,0,0,0|2,0,0]=2 85 B11R1.35 N[C@@H](CC1=CSC=N1)C(=O)O MCULE-2668036247 [0,0,0,0,0,0|2,0,0]=2 86 B11R1.35 N[C@@H](CC1=CSC=N1)C(=O)O MCULE-5714524091 [0,0,0,0,0,0|2,0,0]=2 87 B11R1.35 N[C@@H](CN1C=CC=N1)C(=O)O MCULE-1297692188 [0,0,0,0,0,0|2,0,0]=2 88 B11R1.35 N[C@@H](CN1C=CC=N1)C(=O)O MCULE-1796607981 [0,0,0,0,0,0|2,0,0]=2 89 B11R1.35 N[C@@H](CN1C=CC=N1)C(=O)O MCULE-3328462551 [0,0,0,0,0,0|2,0,0]=2 90 B11R1.35 N[C@@H](CN1C=CC=N1)C(=O)O MCULE-6620872920 [0,0,0,0,0,0|2,0,0]=2 91 B11R1.35 N[C@@H](CN1C=CN=C1)C(=O)O MCULE-9858220492 [0,0,0,0,0,0|3,0,0]=3 92 B11R1.35 N[C@@H](CN1C=NN=N1)C(=O)O MCULE-4182756652 [0,0,0,0,0,0|4,0,0]=4 93 B11R1.35 N[C@H](CC1=CC=CN1)C(=O)O MCULE-8757725265 [0,0,0,0,0,0|1,0,0]=1 94 B11R1.35 N[C@H](CC1=CC=CO1)C(=O)O MCULE-2460207628 [0,0,0,0,0,0|0,1,0]=1 95 B11R1.35 N[C@H](CC1=CC=CO1)C(=O)O MCULE-6984530934 [0,0,0,0,0,0|0,1,0]=1 96 B11R1.35 N[C@H](CC1=CC=CS1)C(=O)O MCULE-6753547229 [0,0,0,0,0,0|0,0,0]=0 97 B11R1.35 N[C@H](CC1=CC=CS1)C(=O)O MCULE-9975284076 [0,0,0,0,0,0|0,0,0]=0 98 B11R1.35 N[C@H](CC1=CN=CS1)C(=O)O MCULE-8243476757 [0,0,0,0,0,0|1,0,0]=1 99 B11R1.35 N[C@H](CC1=CNC=C1)C(=O)O MCULE-9800775235 [0,0,0,0,0,0|2,0,0]=2 100 B11R1.35 N[C@H](CC1=CNC=N1)C(=O)O MCULE-2877373266 [0,0,0,0,0,0|2,0,0]=2 101 B11R1.35 N[C@H](CC1=CNC=N1)C(=O)O MCULE-4994851602 [0,0,0,0,0,0|2,0,0]=2 102 B11R1.35 N[C@H](CC1=CNC=N1)C(=O)O MCULE-9609124805 [0,0,0,0,0,0|2,0,0]=2 103 B11R1.35 N[C@H](CC1=COC=C1)C(=O)O MCULE-2930337657 [0,0,0,0,0,0|2,0,0]=2 104 B11R1.35 N[C@H](CC1=COC=C1)C(=O)O MCULE-3084219342 [0,0,0,0,0,0|2,0,0]=2 105 B11R1.35 N[C@H](CC1=COC=C1)C(=O)O MCULE-4905195149 [0,0,0,0,0,0|2,0,0]=2 106 B11R1.35 N[C@H](CC1=COC=C1)C(=O)O MCULE-5383024553 [0,0,0,0,0,0|2,0,0]=2 107 B11R1.35 N[C@H](CC1=CSC=C1)C(=O)O MCULE-1622837336 [0,0,0,0,0,0|2,0,0]=2 108 B11R1.35 N[C@H](CC1=CSC=C1)C(=O)O MCULE-4992429415 [0,0,0,0,0,0|2,0,0]=2 109 B11R1.35 N[C@H](CC1=CSC=C1)C(=O)O MCULE-8070611987 [0,0,0,0,0,0|2,0,0]=2 110 B11R1.35 N[C@H](CC1=CSC=C1)C(=O)O MCULE-8506384635 [0,0,0,0,0,0|2,0,0]=2 111 B11R1.35 N[C@H](CC1=CSC=N1)C(=O)O MCULE-1425018039 [0,0,0,0,0,0|2,0,0]=2 112 B11R1.35 N[C@H](CC1=CSC=N1)C(=O)O MCULE-9292185704 [0,0,0,0,0,0|2,0,0]=2 113 B11R1.35 N[C@H](CC1=NNC=N1)C(=O)O MCULE-2637030444 [0,0,0,0,0,0|3,0,0]=3 114 B11R1.35 N[C@H](CN1C=CN=C1)C(=O)O MCULE-2628582629 [0,0,0,0,0,0|3,0,0]=3 115 B11R1.35 O=C(O)C(=CC1=CC=CO1)S MCULE-7963054894 [0,0,0,0,0,0|1,1,2]=4 116 B11R1.35 O=C(O)C(=O)CC1=CC=CS1 MCULE-8806340356 [0,0,0,0,0,0|1,0,1]=2 117 B11R1.35 O=C(O)C(=O)CC1=CNC=N1 MCULE-3580978419 [0,0,0,0,0,0|3,0,1]=4 118 B11R1.35 O=C(O)C(=O)NC1=NC=CS1 MCULE-9439892070 [0,0,0,0,0,0|3,0,1]=4 119 B11R1.35 O=C(O)C(Br)CC1=CN=CN1 MCULE-6042646005 [0,0,0,0,0,0|3,0,0]=3 120 B11R1.35 O=C(O)C(Cl)CN1C=CC=N1 MCULE-3448055509 [0,0,0,0,0,0|3,0,0]=3 121 B11R1.35 O=C(O)C(Cl)CN1C=NC=N1 MCULE-5595714575 [0,0,0,0,0,0|4,0,0]=4 122 B11R1.35 O=C(O)C(O)CC1=CC=CS1 MCULE-5295998672 [0,0,0,0,0,0|1,0,0]=1 123 B11R1.35 O=C(O)C(O)CC1=CN=CN1 MCULE-9405168040 [0,0,0,0,0,0|3,0,0]=3 124 B11R1.35 O=C(O)C(O)CN1C=CC=C1 MCULE-9216638920 [0,0,0,0,0,0|3,0,0]=3 125 B11R1.35 O=C(O)C(O)CN1C=CC=N1 MCULE-6573112131 [0,0,0,0,0,0|3,0,0]=3 126 B11R1.35 O=C(O)C(O)CN1C=CN=C1 MCULE-7247806406 [0,0,0,0,0,0|4,0,0]=4 127 B11R1.35 O=C(O)C(O)CN1C=NC=N1 MCULE-3781095446 [0,0,0,0,0,0|4,0,0]=4 128 B11R1.35 O=C(O)[C@@H](O)CC1=CNC=N1 MCULE-9508991160 [0,0,0,0,0,0|3,0,0]=3 129 B11R1.35 [C@H](N)(CC1=CSC=C1)C(=O)O MCULE-3699138278 [0,0,0,0,0,0|2,0,0]=2 130 B10R1.27 CC(CN)CC1=CC=CS1 MCULE-7826084885 [1,0,0,0,0,0|2,0,1]=4 131 B10R1.27 CNC(C)CC1=CC=CS1 MCULE-4120531084 [1,0,0,0,0,0|3,0,0]=4 132 B10R1.27 CNC(C)CC1=CC=CS1 MCULE-6048002321 [1,0,0,0,0,0|3,0,0]=4 133 B10R1.27 N/C(=N\O)/CC1=CC=CS1 MCULE-1424884088 [1,0,0,0,0,0|1,0,1]=3 134 B10R1.27 NC(CO)CC1=CC=CS1 MCULE-2524418000 [1,0,0,0,0,0|0,0,1]=2 135 B10R1.27 NC(CO)CC1=CC=CS1 MCULE-8198609380 [1,0,0,0,0,0|0,0,1]=2 136 B10R1.27 NC(CO)CC1=CN=CN1 MCULE-7235835981 [1,0,0,0,0,0|2,0,1]=4 137 B10R1.27 NC(CO)CC1=CN=CS1 MCULE-5544290114 [1,0,0,0,0,0|1,0,1]=3 138 B10R1.27 NC(CO)CC1=CN=CS1 MCULE-7214167079 [1,0,0,0,0,0|1,0,1]=3 139 B10R1.27 NC(CO)CC1=CNC=N1 MCULE-6372320124 [1,0,0,0,0,0|2,0,1]=4 140 B10R1.27 NC(CO)CC1=CNC=N1 MCULE-6514676641 [1,0,0,0,0,0|2,0,1]=4 141 B10R1.27 NC(CO)CC1=CNC=N1 MCULE-7997190567 [1,0,0,0,0,0|2,0,1]=4 142 B10R1.27 NC(CO)CC1=CNC=N1 MCULE-9281041619 [1,0,0,0,0,0|2,0,1]=4 143 B10R1.27 NC(CO)CC1=NC=CS1 MCULE-4391846022 [1,0,0,0,0,0|1,0,1]=3 144 B10R1.27 NC(CO)CC1=NC=CS1 MCULE-6346740824 [1,0,0,0,0,0|1,0,1]=3 145 B10R1.27 NC(CO)CN1C=CC=N1 MCULE-9350893167 [1,0,0,0,0,0|2,0,1]=4 146 B10R1.27 N[C@@H](CO)CC1=CNC=N1 MCULE-2195648856 [1,0,0,0,0,0|2,0,1]=4 147 B10R1.27 N[C@@H](CO)CC1=CNC=N1 MCULE-5523226969 [1,0,0,0,0,0|2,0,1]=4 148 B10R1.27 N[C@@H](CO)CC1=CNC=N1 MCULE-7842287861 [1,0,0,0,0,0|2,0,1]=4 149 B10R1.27 N[C@@H](CO)CC1=CNC=N1 MCULE-8131511898 [1,0,0,0,0,0|2,0,1]=4 150 B10R1.27 N[C@H](CO)CC1=CC=CS1 MCULE-8545709400 [1,0,0,0,0,0|0,0,1]=2 151 B10R1.27 N[C@H](CO)CC1=CN=CN1 MCULE-8732814122 [1,0,0,0,0,0|2,0,1]=4 152 B10R1.27 N[C@H](CO)CC1=CNC=N1 MCULE-4462090976 [1,0,0,0,0,0|2,0,1]=4 153 B10R1.27 N[C@H](CO)CC1=CNC=N1 MCULE-6352007011 [1,0,0,0,0,0|2,0,1]=4 154 B10R1.27 N[C@H](CO)CC1=CNC=N1 MCULE-7157632202 [1,0,0,0,0,0|2,0,1]=4 155 B10R1.27 N[C@H](CO)CC1=CNC=N1 MCULE-7447304629 [1,0,0,0,0,0|2,0,1]=4 156 B10R1.66 CC(=O)/C=C/C1=CC=CS1 MCULE-9668699729 [1,0,0,0,0,0|1,0,2]=4 157 B10R1.66 CC(=O)C=CC1=CC=CS1 MCULE-4792487998 [1,0,0,0,0,0|1,0,2]=4 158 B10R1.66 CC(=O)CCC1=CC=CO1 MCULE-2101099047 [1,0,0,0,0,0|1,1,0]=3 159 B10R1.66 CC(=O)CCC1=CSC=C1 MCULE-1818012086 [1,0,0,0,0,0|3,0,0]=4 160 B10R1.66 CC(=O)CCC1=NC=CS1 MCULE-2524666506 [1,0,0,0,0,0|2,0,0]=3 161 B10R1.66 CC(=O)CCN1C=CC=N1 MCULE-7966519689 [1,0,0,0,0,0|3,0,0]=4 162 B10R1.66 CC(=O)CSC1=CC=CS1 MCULE-1447269840 [1,0,0,0,0,0|2,0,0]=3 163 B10R1.66 CC(=O)NCC1=CC=CO1 MCULE-3515662037 [1,0,0,0,0,0|2,1,0]=4 164 B10R1.66 CC(=O)NCC1=CC=CS1 MCULE-9977095360 [1,0,0,0,0,0|2,0,0]=3 165 B10R1.66 CC(=O)OCC1=CC=CO1 MCULE-8997160416 [1,0,0,0,0,0|2,1,0]=4 166 B10R1.66 CC(=O)SCC1=CC=CO1 MCULE-2013313658 [1,0,0,0,0,0|2,1,0]=4 167 B10R1.66 CC(N)CCC1=CC=CS1 MCULE-9948064307 [1,0,0,0,0,0|2,0,1]=4 168 B10R1.66 N=C(N)CCC1=CC=CO1 MCULE-4674401212 [1,0,0,0,0,0|2,1,0]=4 169 B10R1.66 N=C(N)CCC1=CC=CO1 MCULE-8321587302 [1,0,0,0,0,0|2,1,0]=4 170 B10R1.66 N=C(N)SCC1=CC=CS1 MCULE-6003432020 [1,0,0,0,0,0|3,0,0]=4 171 B10R1.66 N=C(N)SCC1=CC=CS1 MCULE-9109938865 [1,0,0,0,0,0|3,0,0]=4 172 B10R1.66 NC(=O)/C=C/C1=CC=CS1 MCULE-2550089532 [1,0,0,0,0,0|1,0,2]=4 173 B10R1.66 NC(=O)C=CC1=CC=CS1 MCULE-4715280412 [1,0,0,0,0,0|1,0,2]=4 174 B10R1.66 NC(=O)CCN1C=CC=N1 MCULE-1939400196 [1,0,0,0,0,0|3,0,0]=4 175 B10R1.66 NC(=O)NCC1=CC=CO1 MCULE-8058725801 [1,0,0,0,0,0|2,1,0]=4 176 B10R1.66 NC(=O)NCC1=CC=CS1 MCULE-1971855222 [1,0,0,0,0,0|2,0,0]=3 177 B10R1.66 NC(=O)NCC1=NC=CS1 MCULE-3816919635 [1,0,0,0,0,0|3,0,0]=4 178 B10R1.66 NC(=S)NCC1=CC=CS1 MCULE-7007297451 [1,0,0,0,0,0|2,1,0]=4 179 B10R1.66 O=C(Cl)/C=C/C1=CC=CS1 MCULE-4325709525 [1,0,0,0,0,0|1,0,2]=4 180 B10R1.66 O=C(Cl)C=CC1=CC=CS1 MCULE-4244086123 [1,0,0,0,0,0|1,0,2]=4 181 B10R1.66 O=C(Cl)CCC1=CC=CS1 MCULE-7371256050 [1,0,0,0,0,0|1,0,0]=2 182 B10R1.66 O=C(O)/C=C/C1=CC=CO1 MCULE-1000282553 [1,0,0,0,0,0|0,1,2]=4 183 B10R1.66 O=C(O)/C=C/C1=CC=CS1 MCULE-7724588931 [1,0,0,0,0,0|0,0,2]=3 184 B10R1.66 O=C(O)/C=C/C1=CN=CS1 MCULE-7572472922 [1,0,0,0,0,0|1,0,2]=4 185 B10R1.66 O=C(O)/C=C/C1=NC=CS1 MCULE-7172278941 [1,0,0,0,0,0|1,0,2]=4 186 B10R1.66 O=C(O)C#CC1=CC=CO1 MCULE-9618528259 [1,0,0,0,0,0|0,1,2]=4 187 B10R1.66 O=C(O)C#CC1=CC=CS1 MCULE-6435823452 [1,0,0,0,0,0|0,0,2]=3 188 B10R1.66 O=C(O)C=CC1=CC=CN1 MCULE-5460570885 [1,0,0,0,0,0|1,0,2]=4 189 B10R1.66 O=C(O)C=CC1=CC=CO1 MCULE-8349779970 [1,0,0,0,0,0|0,1,2]=4 190 B10R1.66 O=C(O)C=CC1=CC=CS1 MCULE-8401835373 [1,0,0,0,0,0|0,0,2]=3 191 B10R1.66 O=C(O)C=CC1=CN=CS1 MCULE-7641560153 [1,0,0,0,0,0|1,0,2]=4 192 B10R1.66 O=C(O)C=CC1=NC=CS1 MCULE-2894674051 [1,0,0,0,0,0|1,0,2]=4 193 B10R1.66 O=C(O)CCC1=CC=CN1 MCULE-8495580718 [1,0,0,0,0,0|1,0,0]=2 194 B10R1.66 O=C(O)CCC1=CC=CO1 MCULE-3535606082 [1,0,0,0,0,0|0,1,0]=2 195 B10R1.66 O=C(O)CCC1=CC=CS1 MCULE-3548538547 [1,0,0,0,0,0|0,0,0]=1 196 B10R1.66 O=C(O)CCC1=CC=NO1 MCULE-2698728972 [1,0,0,0,0,0|1,1,0]=3 197 B10R1.66 O=C(O)CCC1=CN=CS1 MCULE-2668820713 [1,0,0,0,0,0|1,0,0]=2 198 B10R1.66 O=C(O)CCC1=CN=CS1 MCULE-7272215073 [1,0,0,0,0,0|1,0,0]=2 199 B10R1.66 O=C(O)CCC1=CNC=C1 MCULE-9116858435 [1,0,0,0,0,0|2,0,0]=3 200 B10R1.66 O=C(O)CCC1=CNC=N1 MCULE-3618491840 [1,0,0,0,0,0|2,0,0]=3 201 B10R1.66 O=C(O)CCC1=CNC=N1 MCULE-8133590347 [1,0,0,0,0,0|2,0,0]=3 202 B10R1.66 O=C(O)CCC1=CNN=C1 MCULE-1705333891 [1,0,0,0,0,0|3,0,0]=4 203 B10R1.66 O=C(O)CCC1=CNN=C1 MCULE-4996856052 [1,0,0,0,0,0|3,0,0]=4 204 B10R1.66 O=C(O)CCC1=CNN=N1 MCULE-2306529453 [1,0,0,0,0,0|3,0,0]=4 205 B10R1.66 O=C(O)CCC1=CNN=N1 MCULE-3429425016 [1,0,0,0,0,0|3,0,0]=4 206 B10R1.66 O=C(O)CCC1=COC=C1 MCULE-6225332803 [1,0,0,0,0,0|2,0,0]=3 207 B10R1.66 O=C(O)CCC1=CON=C1 MCULE-7141916112 [1,0,0,0,0,0|3,0,0]=4 208 B10R1.66 O=C(O)CCC1=CSC=C1 MCULE-5919306548 [1,0,0,0,0,0|2,0,0]=3 209 B10R1.66 O=C(O)CCC1=CSC=N1 MCULE-3188158342 [1,0,0,0,0,0|2,0,0]=3 210 B10R1.66 O=C(O)CCC1=NC=CN1 MCULE-8831721107 [1,0,0,0,0,0|2,0,0]=3 211 B10R1.66 O=C(O)CCC1=NC=CN1 MCULE-8898977198 [1,0,0,0,0,0|2,0,0]=3 212 B10R1.66 O=C(O)CCC1=NC=CO1 MCULE-8621379865 [1,0,0,0,0,0|1,1,0]=3 213 B10R1.66 O=C(O)CCC1=NC=CS1 MCULE-2473180013 [1,0,0,0,0,0|1,0,0]=2 214 B10R1.66 O=C(O)CCC1=NN=CN1 MCULE-9236882970 [1,0,0,0,0,0|3,0,0]=4 215 B10R1.66 O=C(O)CCC1=NOC=C1 MCULE-7542127444 [1,0,0,0,0,0|2,0,0]=3 216 B10R1.66 O=C(O)CCN1C=CC=C1 MCULE-8640172862 [1,0,0,0,0,0|2,0,0]=3 217 B10R1.66 O=C(O)CCN1C=CC=N1 MCULE-3245420562 [1,0,0,0,0,0|2,0,0]=3 218 B10R1.66 O=C(O)CCN1C=CC=N1 MCULE-7345461411 [1,0,0,0,0,0|2,0,0]=3 219 B10R1.66 O=C(O)CCN1C=CN=C1 MCULE-9380136310 [1,0,0,0,0,0|3,0,0]=4 220 B10R1.66 O=C(O)CCN1C=CN=N1 MCULE-4035524586 [1,0,0,0,0,0|3,0,0]=4 221 B10R1.66 O=C(O)CCN1C=CN=N1 MCULE-9295640009 [1,0,0,0,0,0|3,0,0]=4 222 B10R1.66 O=C(O)CCN1C=C[NH+]=C1 MCULE-7376823159 [1,0,0,0,0,0|3,0,0]=4 223 B10R1.66 O=C(O)CCN1C=NC=N1 MCULE-5526368399 [1,0,0,0,0,0|3,0,0]=4 224 B10R1.66 O=C(O)CNC1=CSC=C1 MCULE-7792185653 [1,0,0,0,0,0|3,0,0]=4 225 B10R1.66 O=C(O)CNC1=NC=CS1 MCULE-8036465286 [1,0,0,0,0,0|2,0,0]=3 226 B10R1.66 O=C(O)CNC1=NNC=C1 MCULE-8140407014 [1,0,0,0,0,0|3,0,0]=4 227 B10R1.66 O=C(O)COC1=CSC=C1 MCULE-1973135166 [1,0,0,0,0,0|3,0,0]=4 228 B10R1.66 O=C(O)COC1=NOC=C1 MCULE-7331920513 [1,0,0,0,0,0|3,0,0]=4 229 B10R1.66 O=C(O)COC1=NSC=C1 MCULE-2321879288 [1,0,0,0,0,0|3,0,0]=4 230 B10R1.66 O=C(O)CSC1=CC=CS1 MCULE-4950567579 [1,0,0,0,0,0|1,0,0]=2 231 B10R1.66 O=C(O)CSC1=NC=CS1 MCULE-1071824456 [1,0,0,0,0,0|2,0,0]=3 232 B10R1.66 O=C(O)CSC1=NN=CS1 MCULE-1744708192 [1,0,0,0,0,0|3,0,0]=4 233 B10R1.66 O=N(=O)CCC1=CC=CO1 MCULE-6179704930 [1,0,0,0,0,0|1,1,1]=4 234 B10R1.66 O=P([O-])CCC1=CC=CO1 MCULE-6900012549 [1,0,0,0,0,0|1,1,1]=4 235 B10R1.66 O=P([O-])CCC1=CC=CO1 MCULE-7798677915 [1,0,0,0,0,0|1,1,1]=4 236 B10R1.66 S=C(S)NCC1=CC=CS1 MCULE-4526324543 [1,0,0,0,0,0|1,2,0]=4 237 B12R1.104 CC(CC1=CC=C(S1)Cl)C(=O)O MCULE-8162537073 [0,1,0,0,0,0|1,0,0]=2 238 B12R1.104 CC(CN1C=C(C=N1)Br)C(=O)O MCULE-4150701302 [0,1,0,0,0,0|3,0,0]=4 239 B12R1.104 CC(CN1C=C(C=N1)Cl)C(=O)O MCULE-6408556278 [0,1,0,0,0,0|3,0,0]=4 240 B12R1.104 CC(CN1C=C(C=N1)F)C(=O)O MCULE-3398406930 [0,1,0,0,0,0|3,0,0]=4 241 B12R1.104 CC(CN1C=C(C=N1)I)C(=O)O MCULE-1837019027 [0,1,0,0,0,0|3,0,0]=4 242 B12R1.104 CC(CN1C=C(C=N1)N)C(=O)O MCULE-9174895404 [0,1,0,0,0,0|3,0,0]=4 243 B12R1.104 CC(CN1C=CC(=N1)F)C(=O)O MCULE-4813833401 [0,1,0,0,0,0|3,0,0]=4 244 B12R1.104 CC(CN1C=CC(=N1)N)C(=O)O MCULE-6683388855 [0,1,0,0,0,0|3,0,0]=4 245 B12R1.104 CC1=CC=C(O1)CC(C)C(=O)O MCULE-9134789589 [0,1,0,0,0,0|1,1,0]=3 246 B12R1.104 CC1=CC=C(S1)CC(C)C(=O)O MCULE-3637404220 [0,1,0,0,0,0|1,0,0]=2 247 B12R1.104 CC1=CC=C(S1)CC(N)C(=O)O MCULE-7413117787 [0,1,0,0,0,0|0,0,0]=1 248 B12R1.104 CC1=CN(N=C1)CC(C)C(=O)O MCULE-4911119962 [0,1,0,0,0,0|3,0,0]=4 249 B12R1.104 CC1=CN(N=C1)CC(N)C(=O)O MCULE-3294035463 [0,1,0,0,0,0|2,0,0]=3 250 B12R1.104 CC1=CN(N=C1)CC(N)C(=O)O MCULE-6388981895 [0,1,0,0,0,0|2,0,0]=3 251 B12R1.104 CC1=CSC(=N1)NC(C)C(=O)O MCULE-8012851672 [0,1,0,0,0,0|3,0,0]=4 252 B12R1.104 CC1=NN(C=C1)CC(C)C(=O)O MCULE-7937710275 [0,1,0,0,0,0|3,0,0]=4 253 B12R1.104 CN1C=C(C=N1)CC(N)C(=O)O MCULE-1082285581 [0,1,0,0,0,0|3,0,0]=4 254 B12R1.104 CN1C=C(C=N1)CC(N)C(=O)O MCULE-2929142322 [0,1,0,0,0,0|3,0,0]=4 255 B12R1.104 CN1C=NC(=C1)CC(N)C(=O)O MCULE-5486079144 [0,1,0,0,0,0|2,0,0]=3 256 B12R1.104 CN1C=NC(=C1)C[C@@H](N)C(=O)O MCULE-3613192458 [0,1,0,0,0,0|2,0,0]=3 257 B12R1.104 CN1C=NC(=C1)C[C@@H](N)C(=O)O MCULE-8344880310 [0,1,0,0,0,0|2,0,0]=3 258 B12R1.104 CN1C=NC(=C1)C[C@@H](N)C(=O)O MCULE-8858003477 [0,1,0,0,0,0|2,0,0]=3 259 B12R1.104 CN1C=NC(=C1)C[C@H](N)C(=O)O MCULE-3965514306 [0,1,0,0,0,0|2,0,0]=3 260 B12R1.104 CN1C=NC(=C1)C[C@H](N)C(=O)O MCULE-4475333124 [0,1,0,0,0,0|2,0,0]=3 261 B12R1.104 CN1C=NC(=C1)C[C@H](N)C(=O)O MCULE-5149650387 [0,1,0,0,0,0|2,0,0]=3 262 B12R1.104 CN1C=NC(=C1)C[C@H](N)C(=O)O MCULE-9575114305 [0,1,0,0,0,0|2,0,0]=3 263 B12R1.104 NC(=O)C(N)CN1C=C(C=N1)Br MCULE-4742957534 [0,1,0,0,0,0|3,0,0]=4 264 B12R1.104 NC(CC1=CC=C(S1)Br)C(=O)O MCULE-5965522969 [0,1,0,0,0,0|0,0,0]=1 265 B12R1.104 NC(CC1=CC=C(S1)Br)C(=O)O MCULE-6703511722 [0,1,0,0,0,0|0,0,0]=1 266 B12R1.104 NC(CC1=CN=C(N1)F)C(=O)O MCULE-4832311809 [0,1,0,0,0,0|2,0,0]=3 267 B12R1.104 NC(CC1=CNC(=N1)S)C(=O)O MCULE-9465947211 [0,1,0,0,0,0|2,0,0]=3 268 B12R1.104 NC(CC1=NC(=S)N=C1)C(=O)O MCULE-8976370172 [0,1,0,0,0,0|2,0,0]=3 269 B12R1.104 NC(CN1C=C(C=N1)Br)C(=O)O MCULE-1728546369 [0,1,0,0,0,0|2,0,0]=3 270 B12R1.104 NC(CN1C=C(C=N1)Br)C(=O)O MCULE-7283744620 [0,1,0,0,0,0|2,0,0]=3 271 B12R1.104 NC(CN1C=C(C=N1)Cl)C(=O)O MCULE-3067894787 [0,1,0,0,0,0|2,0,0]=3 272 B12R1.104 NC(CN1C=C(C=N1)Cl)C(=O)O MCULE-9192559156 [0,1,0,0,0,0|2,0,0]=3 273 B12R1.104 NC1=NC(=CN1)C[C@H](N)C(=O)O MCULE-6106532520 [0,1,0,0,0,0|2,0,0]=3 274 B12R1.104 N[C@@H](CC1=CC(=CS1)Br)C(=O)O MCULE-8498566253 [0,1,0,0,0,0|0,0,0]=1 275 B12R1.104 N[C@@H](CC1=CC=C(S1)Br)C(=O)O MCULE-3463438713 [0,1,0,0,0,0|0,0,0]=1 276 B12R1.104 N[C@@H](CC1=CC=C(S1)Br)C(=O)O MCULE-7727496077 [0,1,0,0,0,0|0,0,0]=1 277 B12R1.104 N[C@@H](CC1=CN=C(N1)F)C(=O)O MCULE-6234842384 [0,1,0,0,0,0|2,0,0]=3 278 B12R1.104 N[C@@H](CC1=CN=C(N1)I)C(=O)O MCULE-2987771351 [0,1,0,0,0,0|2,0,0]=3 279 B12R1.104 N[C@@H](CC1=CNC(=N1)O)C(=O)O MCULE-9186293071 [0,1,0,0,0,0|2,0,0]=3 280 B12R1.104 N[C@@H](CC1=CNC(=N1)S)C(=O)O MCULE-9093847859 [0,1,0,0,0,0|2,0,0]=3 281 B12R1.104 N[C@@H](CC1=CNC(=S)N1)C(=O)O MCULE-3988472498 [0,1,0,0,0,0|2,0,0]=3 282 B12R1.104 N[C@@H](CC1=NC(=S)N=C1)C(=O)O MCULE-9784169101 [0,1,0,0,0,0|2,0,0]=3 283 B12R1.104 N[C@H](CC1=CC=C(S1)Br)C(=O)O MCULE-3916316552 [0,1,0,0,0,0|0,0,0]=1 284 B12R1.104 N[C@H](CC1=CC=C(S1)Br)C(=O)O MCULE-9244913261 [0,1,0,0,0,0|0,0,0]=1 285 B12R1.104 N[C@H](CC1=CN=C(N1)F)C(=O)O MCULE-1359887597 [0,1,0,0,0,0|2,0,0]=3 286 B12R1.104 O=C(O)C(=O)CC1=CC(=CS1)Br MCULE-6736689318 [0,1,0,0,0,0|1,0,1]=3 287 B12R1.104 O=C(O)C(Cl)CN1C=C(C=N1)Br MCULE-4352712009 [0,1,0,0,0,0|3,0,0]=4 288 B12R1.104 O=C(O)C(O)CN1C=C(C=N1)Br MCULE-6251510619 [0,1,0,0,0,0|3,0,0]=4 289 B12R1.108 CN(CC1=CC=CS1)C(=O)CCl MCULE-9436891343 [0,1,0,0,0,0|3,0,0]=4 290 B12R1.108 CNC(=O)N(C)CC1=CC=CS1 MCULE-8080274290 [0,1,0,0,0,0|3,0,0]=4 291 B12R1.108 CNC(=O)[C@@H](N)CC1=CN=CN1 MCULE-5563608102 [0,1,0,0,0,0|3,0,0]=4 292 B12R1.108 CNC(=O)[C@@H](N)CC1=CNC=N1 MCULE-1233604567 [0,1,0,0,0,0|3,0,0]=4 293 B12R1.108 CNC(=O)[C@@H](N)CC1=CNC=N1 MCULE-8735746096 [0,1,0,0,0,0|3,0,0]=4 294 B12R1.108 COC(=O)C(=CC1=CC=CS1)O MCULE-2678751476 [0,1,0,0,0,0|1,0,2]=4 295 B12R1.108 COC(=O)C(C)CN1C=CC=N1 MCULE-6366696581 [0,1,0,0,0,0|3,0,0]=4 296 B12R1.108 COC(=O)C(Cl)CN1C=CC=N1 MCULE-9967629251 [0,1,0,0,0,0|3,0,0]=4 297 B12R1.108 COC(=O)C(N)CC1=CC=CO1 MCULE-7425094178 [0,1,0,0,0,0|0,1,0]=2 298 B12R1.108 COC(=O)C(N)CC1=CC=CS1 MCULE-6982143720 [0,1,0,0,0,0|0,0,0]=1 299 B12R1.108 COC(=O)C(N)CC1=CC=CS1 MCULE-8387363612 [0,1,0,0,0,0|0,0,0]=1 300 B12R1.108 COC(=O)C(N)CC1=CN=CS1 MCULE-5779450146 [0,1,0,0,0,0|1,0,0]=2 301 B12R1.108 COC(=O)C(N)CC1=CNC=N1 MCULE-1382272909 [0,1,0,0,0,0|2,0,0]=3 302 B12R1.108 COC(=O)C(N)CC1=CNC=N1 MCULE-9468241244 [0,1,0,0,0,0|2,0,0]=3 303 B12R1.108 COC(=O)C(N)CC1=CSC=N1 MCULE-4606210336 [0,1,0,0,0,0|2,0,0]=3 304 B12R1.108 COC(=O)C(N)CN1C=CC=N1 MCULE-8305136483 [0,1,0,0,0,0|2,0,0]=3 305 B12R1.108 COC(=O)C(N)CN1C=CC=N1 MCULE-9392205504 [0,1,0,0,0,0|2,0,0]=3 306 B12R1.108 COC(=O)C(N)CN1C=CN=C1 MCULE-8491062344 [0,1,0,0,0,0|3,0,0]=4 307 B12R1.108 COC(=O)C(N)CN1C=CN=C1 MCULE-9829482414 [0,1,0,0,0,0|3,0,0]=4 308 B12R1.108 COC(=O)C(N)CN1C=NC=N1 MCULE-1301127688 [0,1,0,0,0,0|3,0,0]=4 309 B12R1.108 COC(=O)C(N)CN1C=NC=N1 MCULE-7826787752 [0,1,0,0,0,0|3,0,0]=4 310 B12R1.108 COC(=O)[C@@H](N)CC1=CC=CO1 MCULE-4575656185 [0,1,0,0,0,0|0,1,0]=2 311 B12R1.108 COC(=O)[C@@H](N)CC1=CC=CO1 MCULE-7970765227 [0,1,0,0,0,0|0,1,0]=2 312 B12R1.108 COC(=O)[C@@H](N)CC1=CC=CS1 MCULE-2835282356 [0,1,0,0,0,0|0,0,0]=1 313 B12R1.108 COC(=O)[C@@H](N)CC1=CC=CS1 MCULE-3294290797 [0,1,0,0,0,0|0,0,0]=1 314 B12R1.108 COC(=O)[C@@H](N)CC1=CC=CS1 MCULE-5652908593 [0,1,0,0,0,0|0,0,0]=1 315 B12R1.108 COC(=O)[C@@H](N)CC1=CC=CS1 MCULE-9022594551 [0,1,0,0,0,0|0,0,0]=1 316 B12R1.108 COC(=O)[C@@H](N)CC1=CNC=N1 MCULE-2089031152 [0,1,0,0,0,0|2,0,0]=3 317 B12R1.108 COC(=O)[C@@H](N)CC1=CNC=N1 MCULE-3117511084 [0,1,0,0,0,0|2,0,0]=3 318 B12R1.108 COC(=O)[C@@H](N)CC1=CNC=N1 MCULE-6830070848 [0,1,0,0,0,0|2,0,0]=3 319 B12R1.108 COC(=O)[C@@H](N)CC1=CNC=N1 MCULE-7101749470 [0,1,0,0,0,0|2,0,0]=3 320 B12R1.108 COC(=O)[C@@H](N)CC1=CNC=N1 MCULE-8175090296 [0,1,0,0,0,0|2,0,0]=3 321 B12R1.108 COC(=O)[C@@H](N)CC1=CNN=C1 MCULE-5389770220 [0,1,0,0,0,0|3,0,0]=4 322 B12R1.108 COC(=O)[C@@H](N)CC1=CSC=C1 MCULE-6133111889 [0,1,0,0,0,0|2,0,0]=3 323 B12R1.108 COC(=O)[C@@H](N)CC1=CSC=C1 MCULE-8476662966 [0,1,0,0,0,0|2,0,0]=3 324 B12R1.108 COC(=O)[C@@H](N)CC1=CSC=C1 MCULE-8593400048 [0,1,0,0,0,0|2,0,0]=3 325 B12R1.108 COC(=O)[C@@H](N)CC1=NC=CS1 MCULE-1408218386 [0,1,0,0,0,0|1,0,0]=2 326 B12R1.108 COC(=O)[C@H](N)CC1=CC=CS1 MCULE-4014114104 [0,1,0,0,0,0|0,0,0]=1 327 B12R1.108 COC(=O)[C@H](N)CC1=CNC=N1 MCULE-3243651519 [0,1,0,0,0,0|2,0,0]=3 328 B12R1.108 COC(=O)[C@H](N)CC1=CNC=N1 MCULE-5122189343 [0,1,0,0,0,0|2,0,0]=3 329 B12R1.108 COC(=O)[C@H](N)CC1=CNC=N1 MCULE-6260177060 [0,1,0,0,0,0|2,0,0]=3 330 B12R1.108 COC(=O)[C@H](N)CC1=CNC=N1 MCULE-8406890275 [0,1,0,0,0,0|2,0,0]=3 331 B12R1.108 COC(=O)[C@H](N)CC1=CNN=C1 MCULE-6535862144 [0,1,0,0,0,0|3,0,0]=4 332 B12R1.108 COC(=O)[C@H](N)CC1=CSC=C1 MCULE-1233246484 [0,1,0,0,0,0|2,0,0]=3 333 B12R1.108 COC(=O)[C@H](N)CC1=NC=CS1 MCULE-1914931563 [0,1,0,0,0,0|1,0,0]=2 334 B12R1.108 [C@@H](N)(CC1=CNC=N1)C(=O)OC MCULE-1504920942 [0,1,0,0,0,0|2,0,0]=3 335 B12R1.108 [C@@H](N)(CC1=CNC=N1)C(=O)OC MCULE-3487476144 [0,1,0,0,0,0|2,0,0]=3 336 B12R1.108 [NH2+]1C=NC(=C1)CC(C(=O)OC)[NH3+] MCULE-5080231571 [0,1,0,0,0,0|2,0,1]=4 337 B12R1.120 C(N)(C(=O)O)C(O)C1=CC=CS1 MCULE-5580590169 [0,1,0,0,0,0|0,0,0]=1 338 B12R1.120 NC(C(=O)O)C(O)C1=CC=CO1 MCULE-8288781221 [0,1,0,0,0,0|0,1,0]=2 339 B12R1.120 N[C@H](C(=O)O)C(O)C1=CC=CS1 MCULE-6901102382 [0,1,0,0,0,0|0,0,0]=1 340 B12R1.145 CC(SC1=C(C=CS1)Br)C(=O)O MCULE-7401239847 [0,1,0,0,0,0|2,0,0]=3 341 B12R1.145 CC1=C(SC=C1)CC(N)C(=O)O MCULE-6046203051 [0,1,0,0,0,0|0,0,0]=1 342 B12R1.145 CC1=C(SC=N1)CC(N)C(=O)O MCULE-4057990716 [0,1,0,0,0,0|1,0,0]=2 343 B12R1.145 CC1=CC=NN1CC(C)C(=O)O MCULE-6118359800 [0,1,0,0,0,0|3,0,0]=4 344 B12R1.145 CN1C=CN=C1CC(N)C(=O)O MCULE-3034963823 [0,1,0,0,0,0|2,0,0]=3 345 B12R1.145 CN1C=NC=C1CC(N)C(=O)O MCULE-1761463456 [0,1,0,0,0,0|2,0,0]=3 346 B12R1.145 CN1C=NC=C1CC(N)C(=O)O MCULE-8928603063 [0,1,0,0,0,0|2,0,0]=3 347 B12R1.145 CN1C=NC=C1C[C@@H](N)C(=O)O MCULE-6549131401 [0,1,0,0,0,0|2,0,0]=3 348 B12R1.145 CN1C=NC=C1C[C@@H](N)C(=O)O MCULE-7888445981 [0,1,0,0,0,0|2,0,0]=3 349 B12R1.145 CN1C=NC=C1C[C@H](N)C(=O)O MCULE-4604416706 [0,1,0,0,0,0|2,0,0]=3 350 B12R1.145 CN1C=NC=C1C[C@H](N)C(=O)O MCULE-9852133553 [0,1,0,0,0,0|2,0,0]=3 351 B12R1.145 NC(CC1=C(N=CN1)F)C(=O)O MCULE-7082079488 [0,1,0,0,0,0|2,0,0]=3 352 B12R1.145 N[C@@H](CC1=C(N=CN1)F)C(=O)O MCULE-8451688674 [0,1,0,0,0,0|2,0,0]=3 353 B12R1.145 N[C@H](CC1=C(N=CN1)F)C(=O)O MCULE-6441017949 [0,1,0,0,0,0|2,0,0]=3 354 B12R1.266 NC(CC1=CC=CS1)C(F)(F)F MCULE-4444683071 [0,1,0,0,0,0|2,0,1]=4 355 B12R1.298 CCC(CC1=CC=CO1)C(=O)O MCULE-7903666102 [0,1,0,0,0,0|1,1,0]=3 356 B12R1.298 CCC(CC1=CC=CS1)C(=O)O MCULE-9874298852 [0,1,0,0,0,0|1,0,0]=2 357 B12R1.298 CCC(CC1=CSC=C1)C(=O)O MCULE-1201084026 [0,1,0,0,0,0|3,0,0]=4 358 B12R1.298 CNC(CC1=CNC=N1)C(=O)O MCULE-3468413328 [0,1,0,0,0,0|2,0,0]=3 359 B12R1.298 CNC(CC1=CNC=N1)C(=O)O MCULE-5120111645 [0,1,0,0,0,0|2,0,0]=3 360 B12R1.298 CNC(CC1=CNC=N1)C(=O)O MCULE-9037833083 [0,1,0,0,0,0|2,0,0]=3 361 B12R1.298 CNC(CN1C=CC=N1)C(=O)O MCULE-2312037192 [0,1,0,0,0,0|2,0,0]=3 362 B12R1.298 CNC(CN1C=CN=C1)C(=O)O MCULE-9844325577 [0,1,0,0,0,0|3,0,0]=4 363 B12R1.298 CN[C@@H](CC1=CNC=N1)C(=O)O MCULE-2344748112 [0,1,0,0,0,0|2,0,0]=3 364 B12R1.298 CN[C@@H](CC1=CNC=N1)C(=O)O MCULE-3787836793 [0,1,0,0,0,0|2,0,0]=3 365 B12R1.298 CN[C@@H](CC1=CNC=N1)C(=O)O MCULE-4956436206 [0,1,0,0,0,0|2,0,0]=3 366 B12R1.298 CN[C@@H](CC1=CNC=N1)C(=O)O MCULE-6672172984 [0,1,0,0,0,0|2,0,0]=3 367 B12R1.298 CN[C@@H](CC1=CSC=N1)C(=O)O MCULE-4087378294 [0,1,0,0,0,0|2,0,0]=3 368 B12R1.298 CN[C@H](CC1=CNC=N1)C(=O)O MCULE-1286452065 [0,1,0,0,0,0|2,0,0]=3 369 B12R1.298 CN[C@H](CC1=CNC=N1)C(=O)O MCULE-6136956486 [0,1,0,0,0,0|2,0,0]=3 370 B12R1.298 CN[C@H](CC1=CNC=N1)C(=O)O MCULE-6660467173 [0,1,0,0,0,0|2,0,0]=3 371 B12R1.298 CN[C@H](CC1=CNC=N1)C(=O)O MCULE-8650714391 [0,1,0,0,0,0|2,0,0]=3 372 B12R1.298 COC(CN1C=CC=C1)C(=O)O MCULE-9112294940 [0,1,0,0,0,0|3,0,0]=4 373 B12R1.298 COC(CN1C=CC=N1)C(=O)O MCULE-8361560096 [0,1,0,0,0,0|3,0,0]=4 374 B12R1.298 N#C/C(=C\C1=CC=CS1)/C(=O)O MCULE-1318138263 [0,1,0,0,0,0|0,0,3]=4 375 B12R1.298 N#CC(=CC1=CC=CS1)C(=O)O MCULE-9274500443 [0,1,0,0,0,0|0,0,3]=4 376 B12R1.298 N#CC(CC1=CC=CO1)C(=O)N MCULE-3746985232 [0,1,0,0,0,0|1,1,1]=4 377 B12R1.298 N#CC(CC1=CC=CS1)C(=O)O MCULE-6017135189 [0,1,0,0,0,0|0,0,1]=2 378 B12R1.298 NNC(CC1=CN=CN1)C(=O)O MCULE-2772979578 [0,1,0,0,0,0|2,0,0]=3 379 B12R1.1373 CC(N)(CC1=CNC=N1)C(=O)O MCULE-3037820078 [0,1,0,0,0,0|2,0,0]=3 380 B12R1.1373 CC(N)(CC1=CNC=N1)C(=O)O MCULE-6308670546 [0,1,0,0,0,0|2,0,0]=3 381 B12R1.1373 CC(N)(CN1C=CC=N1)C(=O)N MCULE-9913444300 [0,1,0,0,0,0|3,0,0]=4 382 B12R1.1373 CC(N)(CN1C=CC=N1)C(=O)O MCULE-5320054225 [0,1,0,0,0,0|2,0,0]=3 383 B12R1.1373 CC(N)(CN1C=CC=N1)C(=O)O MCULE-6617682254 [0,1,0,0,0,0|2,0,0]=3 384 B12R1.1373 CC(N)(CN1C=CN=C1)C(=O)O MCULE-6884089127 [0,1,0,0,0,0|3,0,0]=4 385 B12R1.1373 CC(N)(CN1C=NC=N1)C(=O)O MCULE-1504258279 [0,1,0,0,0,0|3,0,0]=4 386 B12R1.1373 CC(N)(CN1C=NC=N1)C(=O)O MCULE-5903271495 [0,1,0,0,0,0|3,0,0]=4 387 B12R1.1373 CC(O)(CN1C=CC=N1)C(=O)O MCULE-6088615166 [0,1,0,0,0,0|3,0,0]=4 388 B10R0.26 C=CCS(=O)CC(N)C(=O)O MCULE-1644221115 [0,0,1,0,0,0|1,1,1]=4 389 B10R0.26 C=CCS(=O)C[C@H](N)C(=O)O MCULE-5403139844 [0,0,1,0,0,0|1,1,1]=4 390 B10R0.26 C=CCS(=O)C[C@H](N)C(=O)O MCULE-6091538783 [0,0,1,0,0,0|1,1,1]=4 391 B10R0.26 C=CC[S@](=O)C[C@H](N)C(=O)O MCULE-2127698614 [0,0,1,0,0,0|1,1,1]=4 392 B10R0.26 C=CC[S@](=O)C[C@H](N)C(=O)O MCULE-6116290976 [0,0,1,0,0,0|1,1,1]=4 393 B10R0.26 CC=CS(=O)C[C@H](N)C(=O)O MCULE-4397511090 [0,0,1,0,0,0|1,1,1]=4 394 B10R0.75 C=CCCCCC(N)C(=O)O MCULE-9003674294 [0,0,1,0,0,0|1,0,2]=4 395 B10R0.75 C=CCCCC[C@@H](N)C(=O)O MCULE-5424595854 [0,0,1,0,0,0|1,0,2]=4 396 B10R0.75 C=CCCCC[C@@H](N)C(=O)O MCULE-7894205841 [0,0,1,0,0,0|1,0,2]=4 397 B10R0.75 C=CCCCC[C@H](N)C(=O)O MCULE-6386840550 [0,0,1,0,0,0|1,0,2]=4 398 B10R0.75 C=CCCCC[C@H](N)C(=O)O MCULE-8206632491 [0,0,1,0,0,0|1,0,2]=4 399 B10R0.75 C=CCSSC[C@H](N)C(=O)O MCULE-8012244687 [0,0,1,0,0,0|1,0,1]=3 400 B12R2.252 CC(=O)C1=CC2=C(N1)C=CS2 MCULE-7178568906 [0,0,0,1,0,0|1,0,2]=4 401 B12R2.252 NC(=O)C1=CC2=C(N1)C=CS2 MCULE-7206766276 [0,0,0,1,0,0|1,0,2]=4 402 B12R2.252 O=C(O)C1=CC2=C(N1)C=CO2 MCULE-4890412119 [0,0,0,1,0,0|0,1,2]=4 403 B12R2.252 O=C(O)C1=CC2=C(N1)C=CS2 MCULE-2564302171 [0,0,0,1,0,0|0,0,2]=3 404 B12R2.252 O=C(O)C1=CC2=C(N1)N=CS2 MCULE-2978831614 [0,0,0,1,0,0|1,0,2]=4 405 B12R2.252 O=C(O)C1=CC2=C(N1)SC=C2 MCULE-1244115319 [0,0,0,1,0,0|2,0,1]=4 406 B12R2.252 O=C(O)C1=CC2=C(S1)C=CS2 MCULE-9074494739 [0,0,0,1,0,0|1,0,2]=4 407 B12R2.252 O=C(O)C1=CC2=C(S1)SC=C2 MCULE-6523251244 [0,0,0,1,0,0|2,0,1]=4 408 B12R2.252 O=C(O)C1=CC2=C([Se]1)C=CS2 MCULE-1870487907 [0,0,0,1,0,0|1,0,2]=4 409 B12R2.252 O=C(O)C1CC2=C(C1)SC=C2 MCULE-3558781460 [0,0,0,1,0,0|1,0,0]=2 410 B12R2.252 O=C(O)C1CC2=CNN=C2C1 MCULE-1728416617 [0,0,0,1,0,0|3,0,0]=4 411 B12R2.252 O=C(O)C1CC2=CSC=C2C1 MCULE-1981316561 [0,0,0,1,0,0|3,0,0]=4 412 B12R2.252 O=C(O)C1CC2=NC=CN2C1 MCULE-4199442684 [0,0,0,1,0,0|3,0,0]=4 413 B12R2.252 O=C(O)C1CC2=NC=CN2C1 MCULE-9791039063 [0,0,0,1,0,0|3,0,0]=4 414 B12R2.1354 CC(=O)C1CC1C2=CC=CO2 MCULE-2239066013 [0,0,0,1,0,0|2,1,0]=4 415 B12R2.1354 CC(=O)C1CC1C2=CC=CS2 MCULE-7550767802 [0,0,0,1,0,0|2,0,0]=3 416 B12R2.1354 CC(=O)[C@@H]1C[C@H]1C2=CC=CS2 MCULE-4200702765 [0,0,0,1,0,0|2,0,0]=3 417 B12R2.1354 CC(O)C1CC1C2=CC=CS2 MCULE-5857108631 [0,0,0,1,0,0|2,0,1]=4 418 B12R2.1354 O=C(O)C1CC1C2=CC=CO2 MCULE-6611007978 [0,0,0,1,0,0|1,1,0]=3 419 B12R2.1354 O=C(O)C1CC1C2=CC=CS2 MCULE-6134860704 [0,0,0,1,0,0|1,0,0]=2 420 B12R2.1354 O=C(O)C1CC1C2=CSC=C2 MCULE-2425985743 [0,0,0,1,0,0|3,0,0]=4 421 B12R2.1354 O=C(O)C1CC1C2=NNC=C2 MCULE-4672099110 [0,0,0,1,0,0|3,0,0]=4 422 B12R2.1354 O=C(O)[C@@H]1C[C@H]1C2=CC=CS2 MCULE-8767987097 [0,0,0,1,0,0|1,0,0]=2 423 B12R2.1354 O=C(O)[C@@H]1C[C@H]1C2=CNC=N2 MCULE-3430818972 [0,0,0,1,0,0|3,0,0]=4 424 B12R2.1354 O=C(O)[C@@H]1C[C@H]1C2=CNC=N2 MCULE-6157324496 [0,0,0,1,0,0|3,0,0]=4 425 B12R2.1354 O=C(O)[C@@H]1C[C@H]1C2=CSC=C2 MCULE-1268110497 [0,0,0,1,0,0|3,0,0]=4 426 B10R1.23 C(N)(C(=O)O)C1=CC=CS1 MCULE-1250665795 [0,0,0,0,1,0|0,0,0]=1 427 B10R1.23 CC(C(=O)O)C1=CC=CO1 MCULE-6443441937 [0,0,0,0,1,0|1,1,0]=3 428 B10R1.23 CC(C(=O)O)C1=CC=CS1 MCULE-4675409626 [0,0,0,0,1,0|1,0,0]=2 429 B10R1.23 CC(C(=O)O)C1=COC=C1 MCULE-4326585522 [0,0,0,0,1,0|3,0,0]=4 430 B10R1.23 CC(C(=O)O)C1=CSC=C1 MCULE-7049134758 [0,0,0,0,1,0|3,0,0]=4 431 B10R1.23 CC(C(=O)O)C1=NC=CS1 MCULE-7498229711 [0,0,0,0,1,0|2,0,0]=3 432 B10R1.23 CC(C(=O)O)N1C=CC=C1 MCULE-1593386499 [0,0,0,0,1,0|3,0,0]=4 433 B10R1.23 CC(C(=O)O)N1C=CC=N1 MCULE-3691423772 [0,0,0,0,1,0|3,0,0]=4 434 B10R1.23 CC(C)C(N)C1=CC=CS1 MCULE-5479071893 [0,0,0,0,1,0|2,0,1]=4 435 B10R1.23 CC(C)C(N)C1=CC=CS1 MCULE-8132459912 [0,0,0,0,1,0|2,0,1]=4 436 B10R1.23 C[C@@H](C(=O)O)N1C=CC=C1 MCULE-2640563942 [0,0,0,0,1,0|3,0,0]=4 437 B10R1.23 C[C@@H](C(=O)O)N1C=CC=C1 MCULE-4656802518 [0,0,0,0,1,0|3,0,0]=4 438 B10R1.23 C[C@@H](C(=O)O)N1C=CC=N1 MCULE-7400707941 [0,0,0,0,1,0|3,0,0]=4 439 B10R1.23 NC(=O)C(=O)C1=CC=CS1 MCULE-7042640781 [0,0,0,0,1,0|2,0,1]=4 440 B10R1.23 NC(=O)C(N)C1=CC=CS1 MCULE-8794248297 [0,0,0,0,1,0|1,0,0]=2 441 B10R1.23 NC(C(=O)O)C1=CC=CO1 MCULE-9043644841 [0,0,0,0,1,0|0,1,0]=2 442 B10R1.23 NC(C(=O)O)C1=CC=CS1 MCULE-2621741244 [0,0,0,0,1,0|0,0,0]=1 443 B10R1.23 NC(C(=O)O)C1=CC=NS1 MCULE-1938977249 [0,0,0,0,1,0|1,0,0]=2 444 B10R1.23 NC(C(=O)O)C1=CNN=C1 MCULE-5361903799 [0,0,0,0,1,0|3,0,0]=4 445 B10R1.23 NC(C(=O)O)C1=COC=C1 MCULE-7814394097 [0,0,0,0,1,0|2,0,0]=3 446 B10R1.23 NC(C(=O)O)C1=CSC=C1 MCULE-1102402224 [0,0,0,0,1,0|2,0,0]=3 447 B10R1.23 NC(C(=O)O)C1=CSC=C1 MCULE-6018523481 [0,0,0,0,1,0|2,0,0]=3 448 B10R1.23 NC(C(=O)O)C1=CSC=C1 MCULE-8080979991 [0,0,0,0,1,0|2,0,0]=3 449 B10R1.23 N[C@@H](C(=O)O)C1=CC=CS1 MCULE-5616654577 [0,0,0,0,1,0|0,0,0]=1 450 B10R1.23 N[C@@H](C(=O)O)C1=CC=CS1 MCULE-8589130349 [0,0,0,0,1,0|0,0,0]=1 451 B10R1.23 N[C@@H](C(=O)O)C1=CSC=C1 MCULE-6987247145 [0,0,0,0,1,0|2,0,0]=3 452 B10R1.23 N[C@@H](C(=O)O)C1=CSC=C1 MCULE-8041766294 [0,0,0,0,1,0|2,0,0]=3 453 B10R1.23 N[C@@H](C1=CC=CS1)C(F)F MCULE-4063191603 [0,0,0,0,1,0|2,0,1]=4 454 B10R1.23 N[C@@H](C1=CC=CS1)C(F)F MCULE-6137083776 [0,0,0,0,1,0|2,0,1]=4 455 B10R1.23 N[C@H](C(=O)O)C1=CC=CS1 MCULE-6119385757 [0,0,0,0,1,0|0,0,0]=1 456 B10R1.23 N[C@H](C(=O)O)C1=CC=CS1 MCULE-8662100722 [0,0,0,0,1,0|0,0,0]=1 457 B10R1.23 N[C@H](C(=O)O)C1=CSC=C1 MCULE-3946730105 [0,0,0,0,1,0|2,0,0]=3 458 B10R1.23 N[C@H](C(=O)O)C1=CSC=C1 MCULE-5706986594 [0,0,0,0,1,0|2,0,0]=3 459 B10R1.23 N[C@H](C1=CC=CS1)C(F)F MCULE-3197581677 [0,0,0,0,1,0|2,0,1]=4 460 B10R1.23 N[C@H](C1=CC=CS1)C(F)F MCULE-9077354238 [0,0,0,0,1,0|2,0,1]=4 461 B10R1.23 O=C(O)C(=O)C1=CC=CN1 MCULE-9607086039 [0,0,0,0,1,0|2,0,1]=4 462 B10R1.23 O=C(O)C(=O)C1=CC=CO1 MCULE-5129158726 [0,0,0,0,1,0|1,1,1]=4 463 B10R1.23 O=C(O)C(=O)C1=CC=CS1 MCULE-2381062967 [0,0,0,0,1,0|1,0,1]=3 464 B10R1.23 O=C(O)C(F)C1=CC=CS1 MCULE-4401360218 [0,0,0,0,1,0|1,0,0]=2 465 B10R1.23 O=C(O)C(F)C1=CSC=C1 MCULE-5837038972 [0,0,0,0,1,0|3,0,0]=4 466 B10R1.23 O=C(O)C(F)N1C=CC=N1 MCULE-8397654618 [0,0,0,0,1,0|3,0,0]=4 467 B10R1.23 O=C(O)C(O)C1=CC=CO1 MCULE-1444782782 [0,0,0,0,1,0|1,1,0]=3 468 B10R1.23 O=C(O)C(O)C1=CC=CS1 MCULE-2358633427 [0,0,0,0,1,0|1,0,0]=2 469 B10R1.23 O=C(O)C(O)C1=CNC=N1 MCULE-3158873766 [0,0,0,0,1,0|3,0,0]=4 470 B10R1.23 O=C(O)C(O)C1=CNC=N1 MCULE-5031403061 [0,0,0,0,1,0|3,0,0]=4 471 B10R1.23 O=C(O)C(O)C1=COC=C1 MCULE-3232908149 [0,0,0,0,1,0|3,0,0]=4 472 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O MCULE-6200285839 [0,0,0,0,0,1|2,0,1]=4 473 B12R1.43 CC(=O)C(Br)CC1=CC=CC=C1 MCULE-1714878295 [0,0,0,0,0,1|3,0,0]=4 474 B12R1.43 CC(=O)C(C)CC1=CC=CC=C1 MCULE-9879731396 [0,0,0,0,0,1|3,0,0]=4 475 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 MCULE-4230256436 [0,0,0,0,0,1|2,0,0]=3 476 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 MCULE-7161249545 [0,0,0,0,0,1|2,0,0]=3 477 B12R1.43 CC(CC1=CC=CC=C1)C(=O)Cl MCULE-6045163933 [0,0,0,0,0,1|3,0,0]=4 478 B12R1.43 CC(CC1=CC=CC=C1)C(=O)N MCULE-5416273234 [0,0,0,0,0,1|3,0,0]=4 479 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O MCULE-7326511541 [0,0,0,0,0,1|2,0,0]=3 480 B12R1.43 CC(CC1=CC=CN=C1)C(=O)O MCULE-2945865799 [0,0,0,0,0,1|2,0,0]=3 481 B12R1.43 CC(CC1=CC=CN=C1)C(=O)O MCULE-5331249082 [0,0,0,0,0,1|2,0,0]=3 482 B12R1.43 CC(CC1=CC=NC=C1)C(=O)O MCULE-6152899620 [0,0,0,0,0,1|2,0,0]=3 483 B12R1.43 CC(CC1=CC=NC=N1)C(=O)O MCULE-5948691397 [0,0,0,0,0,1|2,0,0]=3 484 B12R1.43 CC(CC1=CN=CN=C1)C(=O)O MCULE-3850019109 [0,0,0,0,0,1|3,0,0]=4 485 B12R1.43 CC(CC1=NC=CC=C1)C(=O)O MCULE-6566847057 [0,0,0,0,0,1|2,0,0]=3 486 B12R1.43 CC(CC1=NC=CC=N1)C(=O)O MCULE-9423018015 [0,0,0,0,0,1|2,0,0]=3 487 B12R1.43 CC(NC1=CC=CC=C1)C(=O)O MCULE-7005885995 [0,0,0,0,0,1|3,0,0]=4 488 B12R1.43 CC(NC1=CC=CN=C1)C(=O)O MCULE-7829627263 [0,0,0,0,0,1|3,0,0]=4 489 B12R1.43 CC(NC1=NC=CC=N1)C(=O)O MCULE-6276105830 [0,0,0,0,0,1|3,0,0]=4 490 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O MCULE-3922404950 [0,0,0,0,0,1|3,0,0]=4 491 B12R1.43 CC(OC1=CN=CC=C1)C(=O)O MCULE-9438736579 [0,0,0,0,0,1|3,0,0]=4 492 B12R1.43 CC(OC1=NC=CC=C1)C(=O)O MCULE-8335834842 [0,0,0,0,0,1|3,0,0]=4 493 B12R1.43 CC(SC1=CC=CC=C1)C(=O)O MCULE-9280194220 [0,0,0,0,0,1|3,0,0]=4 494 B12R1.43 CC(SC1=CC=NC=C1)C(=O)O MCULE-6570780253 [0,0,0,0,0,1|3,0,0]=4 495 B12R1.43 CC(SC1=NC=CC=C1)C(=O)O MCULE-1835508382 [0,0,0,0,0,1|3,0,0]=4 496 B12R1.43 CC(SC1=NC=CC=N1)C(=O)O MCULE-6756579773 [0,0,0,0,0,1|3,0,0]=4 497 B12R1.43 CC(SC1=NC=CN=C1)C(=O)O MCULE-1556190570 [0,0,0,0,0,1|3,0,0]=4 498 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-2382098458 [0,0,0,0,0,1|2,0,0]=3 499 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-3028530630 [0,0,0,0,0,1|2,0,0]=3 500 B12R1.43 C[C@@H](NC1=NC=CC=N1)C(=O)O MCULE-5416728922 [0,0,0,0,0,1|3,0,0]=4 501 B12R1.43 C[C@@H](OC1=CC=CC=C1)C(=O)O MCULE-2381911676 [0,0,0,0,0,1|3,0,0]=4 502 B12R1.43 C[C@@H](OC1=CC=CC=C1)C(=O)O MCULE-5540145744 [0,0,0,0,0,1|3,0,0]=4 503 B12R1.43 C[C@H](CC1=CC=CC=C1)C(=O)O MCULE-5116283906 [0,0,0,0,0,1|2,0,0]=3 504 B12R1.43 C[C@H](NC1=CC=CC=C1)C(=O)O MCULE-1832900891 [0,0,0,0,0,1|3,0,0]=4 505 B12R1.43 C[C@H](NC1=CC=NC=C1)C(=O)O MCULE-6289170240 [0,0,0,0,0,1|3,0,0]=4 506 B12R1.43 C[C@H](NC1=CC=NC=C1)C(=O)O MCULE-7122084450 [0,0,0,0,0,1|3,0,0]=4 507 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O MCULE-1535867362 [0,0,0,0,0,1|3,0,0]=4 508 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O MCULE-6976463834 [0,0,0,0,0,1|3,0,0]=4 509 B12R1.43 C[C@H](SC1=NC=CC=C1)C(=O)O MCULE-8631279326 [0,0,0,0,0,1|3,0,0]=4 510 B12R1.43 NC(=O)C(Br)CC1=CC=CC=C1 MCULE-8335898952 [0,0,0,0,0,1|3,0,0]=4 511 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-2161822841 [0,0,0,0,0,1|2,0,0]=3 512 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-2610261909 [0,0,0,0,0,1|2,0,0]=3 513 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-9345667353 [0,0,0,0,0,1|2,0,0]=3 514 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-9732246414 [0,0,0,0,0,1|2,0,0]=3 515 B12R1.43 NC(=O)C(O)CC1=CC=CC=C1 MCULE-2820917516 [0,0,0,0,0,1|3,0,0]=4 516 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-6548337580 [0,0,0,0,0,1|2,0,0]=3 517 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-7119612436 [0,0,0,0,0,1|2,0,0]=3 518 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-9635114334 [0,0,0,0,0,1|2,0,0]=3 519 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-3676093786 [0,0,0,0,0,1|2,0,0]=3 520 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-5027501057 [0,0,0,0,0,1|2,0,0]=3 521 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-5946837057 [0,0,0,0,0,1|2,0,0]=3 522 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-8948644005 [0,0,0,0,0,1|2,0,0]=3 523 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O MCULE-4509365715 [0,0,0,0,0,1|1,0,0]=2 524 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O MCULE-9481096822 [0,0,0,0,0,1|1,0,0]=2 525 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O MCULE-3369503748 [0,0,0,0,0,1|1,0,0]=2 526 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O MCULE-4500681212 [0,0,0,0,0,1|1,0,0]=2 527 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-3037053990 [0,0,0,0,0,1|1,0,0]=2 528 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-3740298834 [0,0,0,0,0,1|1,0,0]=2 529 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-4165068673 [0,0,0,0,0,1|1,0,0]=2 530 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-8377448441 [0,0,0,0,0,1|1,0,0]=2 531 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-9526041825 [0,0,0,0,0,1|1,0,0]=2 532 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O MCULE-2658135318 [0,0,0,0,0,1|1,0,0]=2 533 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O MCULE-4065287784 [0,0,0,0,0,1|1,0,0]=2 534 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O MCULE-4169399134 [0,0,0,0,0,1|1,0,0]=2 535 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O MCULE-2466401514 [0,0,0,0,0,1|1,0,0]=2 536 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O MCULE-7994000866 [0,0,0,0,0,1|1,0,0]=2 537 B12R1.43 NC(CC1=NC=CC=N1)C(=O)O MCULE-3988060033 [0,0,0,0,0,1|1,0,0]=2 538 B12R1.43 NC(CC1=NC=CC=N1)C(=O)O MCULE-6011199658 [0,0,0,0,0,1|1,0,0]=2 539 B12R1.43 NC(CC1=NC=NC=C1)C(=O)O MCULE-3627790030 [0,0,0,0,0,1|1,0,0]=2 540 B12R1.43 NC(CC1=NC=NC=C1)C(=O)O MCULE-8971528550 [0,0,0,0,0,1|1,0,0]=2 541 B12R1.43 NC(CC1=NN=CC=C1)C(=O)O MCULE-3486949364 [0,0,0,0,0,1|1,0,0]=2 542 B12R1.43 NC(CC1=NN=CC=C1)C(=O)O MCULE-9714711796 [0,0,0,0,0,1|1,0,0]=2 543 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-1311765992 [0,0,0,0,0,1|1,0,0]=2 544 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-4249753593 [0,0,0,0,0,1|1,0,0]=2 545 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-5960921520 [0,0,0,0,0,1|1,0,0]=2 546 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9410526237 [0,0,0,0,0,1|1,0,0]=2 547 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-1318776684 [0,0,0,0,0,1|1,0,0]=2 548 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-2756511850 [0,0,0,0,0,1|1,0,0]=2 549 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-6450114631 [0,0,0,0,0,1|1,0,0]=2 550 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-6451205573 [0,0,0,0,0,1|1,0,0]=2 551 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-6819782094 [0,0,0,0,0,1|1,0,0]=2 552 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-7779462392 [0,0,0,0,0,1|1,0,0]=2 553 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-1319584746 [0,0,0,0,0,1|1,0,0]=2 554 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-4038860269 [0,0,0,0,0,1|1,0,0]=2 555 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-5445835001 [0,0,0,0,0,1|1,0,0]=2 556 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-9469765262 [0,0,0,0,0,1|1,0,0]=2 557 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O MCULE-1225994987 [0,0,0,0,0,1|1,0,0]=2 558 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O MCULE-1559053573 [0,0,0,0,0,1|1,0,0]=2 559 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O MCULE-2320178150 [0,0,0,0,0,1|1,0,0]=2 560 B12R1.43 N[C@@H](CC1=NN=CC=C1)C(=O)O MCULE-1359394268 [0,0,0,0,0,1|1,0,0]=2 561 B12R1.43 N[C@@H](CC1=NN=CC=C1)C(=O)O MCULE-2088497949 [0,0,0,0,0,1|1,0,0]=2 562 B12R1.43 N[C@@H](CC1=NN=CC=C1)C(=O)O MCULE-3144048553 [0,0,0,0,0,1|1,0,0]=2 563 B12R1.43 N[C@@H](CC1=NN=CC=C1)C(=O)O MCULE-6040113143 [0,0,0,0,0,1|1,0,0]=2 564 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2148272872 [0,0,0,0,0,1|1,0,0]=2 565 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2197316791 [0,0,0,0,0,1|1,0,0]=2 566 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2827782619 [0,0,0,0,0,1|1,0,0]=2 567 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-3011969403 [0,0,0,0,0,1|1,0,0]=2 568 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-3394687698 [0,0,0,0,0,1|1,0,0]=2 569 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-4997997022 [0,0,0,0,0,1|1,0,0]=2 570 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-5673410743 [0,0,0,0,0,1|1,0,0]=2 571 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-8503334355 [0,0,0,0,0,1|1,0,0]=2 572 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-9702283993 [0,0,0,0,0,1|1,0,0]=2 573 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-1530965630 [0,0,0,0,0,1|1,0,0]=2 574 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-2261526216 [0,0,0,0,0,1|1,0,0]=2 575 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-5458063668 [0,0,0,0,0,1|1,0,0]=2 576 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-8584771604 [0,0,0,0,0,1|1,0,0]=2 577 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-2767701043 [0,0,0,0,0,1|1,0,0]=2 578 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-3184854322 [0,0,0,0,0,1|1,0,0]=2 579 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-5316652497 [0,0,0,0,0,1|1,0,0]=2 580 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-8407561976 [0,0,0,0,0,1|1,0,0]=2 581 B12R1.43 O=C(Cl)C(Br)CC1=CC=CC=C1 MCULE-8151311396 [0,0,0,0,0,1|3,0,0]=4 582 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 MCULE-9935480822 [0,0,0,0,0,1|2,0,1]=4 583 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 MCULE-1864489061 [0,0,0,0,0,1|2,0,0]=3 584 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 MCULE-5141593227 [0,0,0,0,0,1|2,0,0]=3 585 B12R1.43 O=C(O)C(Br)C[N+]1=CC=CC=C1 MCULE-5162156323 [0,0,0,0,0,1|3,0,0]=4 586 B12R1.43 O=C(O)C(Br)C[N+]1=CC=CC=C1 MCULE-5251609604 [0,0,0,0,0,1|3,0,0]=4 587 B12R1.43 O=C(O)C(F)CC1=CC=CC=C1 MCULE-9166012619 [0,0,0,0,0,1|2,0,0]=3 588 B12R1.43 O=C(O)C(F)SC1=NC=CC=N1 MCULE-9308659340 [0,0,0,0,0,1|3,0,0]=4 589 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 MCULE-8315491131 [0,0,0,0,0,1|2,0,0]=3 590 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 MCULE-9508817950 [0,0,0,0,0,1|2,0,0]=3 591 B12R1.43 O=C(O)C(O)CC1=CC=CN=C1 MCULE-6280644145 [0,0,0,0,0,1|2,0,0]=3 592 B12R1.43 O=C(O)C(S)CC1=CC=CC=C1 MCULE-2786315780 [0,0,0,0,0,1|2,0,0]=3 593 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 MCULE-4327885480 [0,0,0,0,0,1|2,0,0]=3 594 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 MCULE-7060788630 [0,0,0,0,0,1|2,0,0]=3 595 B12R1.43 O=C(O)[C@@H](Cl)CC1=CC=CC=C1 MCULE-1955124001 [0,0,0,0,0,1|2,0,0]=3 596 B12R1.43 O=C(O)[C@@H](Cl)CC1=CC=CC=C1 MCULE-2054040205 [0,0,0,0,0,1|2,0,0]=3 597 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 MCULE-1839486703 [0,0,0,0,0,1|2,0,0]=3 598 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 MCULE-4919076158 [0,0,0,0,0,1|2,0,0]=3 599 B12R1.43 O=C(O)[C@H](Br)CC1=CC=CC=C1 MCULE-7765977229 [0,0,0,0,0,1|2,0,0]=3 600 B12R1.43 O=C(O)[C@H](Br)CC1=CC=CC=C1 MCULE-9087197160 [0,0,0,0,0,1|2,0,0]=3 601 B12R1.43 O=C(O)[C@H](Cl)CC1=CC=CC=C1 MCULE-1353432482 [0,0,0,0,0,1|2,0,0]=3 602 B12R1.43 O=C(O)[C@H](Cl)CC1=CC=CC=C1 MCULE-5962224015 [0,0,0,0,0,1|2,0,0]=3 603 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 MCULE-2910632779 [0,0,0,0,0,1|2,0,0]=3 604 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 MCULE-9829239357 [0,0,0,0,0,1|2,0,0]=3 605 B12R1.43 O=C(O)[C@H](S)CC1=CC=CC=C1 MCULE-6360971092 [0,0,0,0,0,1|2,0,0]=3 606 B12R1.43 [C@@H](C)(NC1=CC=CN=C1)C(=O)O MCULE-1618208931 [0,0,0,0,0,1|3,0,0]=4 607 B12R1.43 [C@H](N)(CC1=CC=CC=C1)C(=O)N MCULE-5599449655 [0,0,0,0,0,1|2,0,0]=3 608 B12R1.260 CC(CC(=O)O)SC1=CC=CS1 MCULE-2533398337 [0,0,0,0,0,1|2,0,0]=3 609 B12R1.260 CN(CC(=O)O)CC1=CC=CO1 MCULE-1468459956 [0,0,0,0,0,1|2,1,0]=4 610 B12R1.260 CN(CC(=O)O)CC1=CC=CS1 MCULE-5304662926 [0,0,0,0,0,1|2,0,0]=3 611 B12R1.260 CN(CC(=O)O)CC1=CC=CS1 MCULE-9524004401 [0,0,0,0,0,1|2,0,0]=3 612 B12R1.260 CN(CC(=O)O)CC1=CN=CS1 MCULE-4344396964 [0,0,0,0,0,1|3,0,0]=4 613 B12R1.260 C[C@@H](CC(=O)O)SC1=CC=CS1 MCULE-7549637938 [0,0,0,0,0,1|2,0,0]=3 614 B12R1.260 NC(CC(=O)O)CC1=CC=CO1 MCULE-4305476704 [0,0,0,0,0,1|0,1,0]=2 615 B12R1.260 NC(CC(=O)O)CC1=CC=CS1 MCULE-1845608833 [0,0,0,0,0,1|0,0,0]=1 616 B12R1.260 NC(CC(=O)O)CC1=CC=CS1 MCULE-9790060982 [0,0,0,0,0,1|0,0,0]=1 617 B12R1.260 NC(CC(=O)O)CC1=CSC=C1 MCULE-2015108408 [0,0,0,0,0,1|2,0,0]=3 618 B12R1.260 NC(CC(=O)O)CC1=CSC=C1 MCULE-3927224923 [0,0,0,0,0,1|2,0,0]=3 619 B12R1.260 N[C@@H](CC(=O)O)CC1=CC=CO1 MCULE-2795775303 [0,0,0,0,0,1|0,1,0]=2 620 B12R1.260 N[C@@H](CC(=O)O)CC1=CC=CS1 MCULE-1088707523 [0,0,0,0,0,1|0,0,0]=1 621 B12R1.260 N[C@@H](CC(=O)O)CC1=CC=CS1 MCULE-3654310109 [0,0,0,0,0,1|0,0,0]=1 622 B12R1.260 N[C@@H](CC(=O)O)CC1=CC=CS1 MCULE-8289125524 [0,0,0,0,0,1|0,0,0]=1 623 B12R1.260 N[C@@H](CC(=O)O)CC1=CC=CS1 MCULE-8671246375 [0,0,0,0,0,1|0,0,0]=1 624 B12R1.260 N[C@@H](CC(=O)O)CC1=CSC=C1 MCULE-2108707344 [0,0,0,0,0,1|2,0,0]=3 625 B12R1.260 N[C@@H](CC(=O)O)CC1=CSC=C1 MCULE-3736456892 [0,0,0,0,0,1|2,0,0]=3 626 B12R1.260 N[C@@H](CC(=O)O)CC1=CSC=C1 MCULE-4800211250 [0,0,0,0,0,1|2,0,0]=3 627 B12R1.260 N[C@@H](CC(=O)O)CC1=CSC=C1 MCULE-5605183606 [0,0,0,0,0,1|2,0,0]=3 628 B12R1.260 N[C@H](CC(=O)O)CC1=CC=CO1 MCULE-3040009628 [0,0,0,0,0,1|0,1,0]=2 629 B12R1.260 N[C@H](CC(=O)O)CC1=CC=CO1 MCULE-6537016762 [0,0,0,0,0,1|0,1,0]=2 630 B12R1.260 N[C@H](CC(=O)O)CC1=CC=CO1 MCULE-7106321565 [0,0,0,0,0,1|0,1,0]=2 631 B12R1.260 N[C@H](CC(=O)O)CC1=CC=CS1 MCULE-1090315375 [0,0,0,0,0,1|0,0,0]=1 632 B12R1.260 N[C@H](CC(=O)O)CC1=CC=CS1 MCULE-1963711592 [0,0,0,0,0,1|0,0,0]=1 633 B12R1.260 N[C@H](CC(=O)O)CC1=CC=CS1 MCULE-2441525494 [0,0,0,0,0,1|0,0,0]=1 634 B12R1.260 N[C@H](CC(=O)O)CC1=CC=CS1 MCULE-5323841763 [0,0,0,0,0,1|0,0,0]=1 635 B12R1.260 N[C@H](CC(=O)O)CC1=CSC=C1 MCULE-1375949973 [0,0,0,0,0,1|2,0,0]=3 636 B12R1.260 N[C@H](CC(=O)O)CC1=CSC=C1 MCULE-1481519275 [0,0,0,0,0,1|2,0,0]=3 637 B12R1.260 N[C@H](CC(=O)O)CC1=CSC=C1 MCULE-1711849337 [0,0,0,0,0,1|2,0,0]=3 638 B12R1.260 N[C@H](CC(=O)O)CC1=CSC=C1 MCULE-6560082822 [0,0,0,0,0,1|2,0,0]=3 639 B12R1.260 O=C(O)CS(=O)CC1=CC=CO1 MCULE-1088686925 [0,0,0,0,0,1|2,1,0]=4 640 B12R1.264 CC(CCC1=CC=CS1)C(=O)O MCULE-3548866690 [0,0,0,0,0,1|1,0,0]=2 641 B12R1.264 CC(SCC1=CC=CO1)C(=O)O MCULE-4549363559 [0,0,0,0,0,1|1,1,0]=3 642 B12R1.264 NC(CSC1=CC=CS1)C(=O)O MCULE-1034881546 [0,0,0,0,0,1|0,0,0]=1 643 B12R1.264 NC(CSC1=NC=CS1)C(=O)O MCULE-4673937684 [0,0,0,0,0,1|1,0,0]=2 644 B12R1.264 O=C(O)C(=O)C=CC1=CC=CS1 MCULE-3493980124 [0,0,0,0,0,1|1,0,2]=4 645 B9R0.47 C/C=C/SC[C@H](N)C(=O)O MCULE-2540874981 [1,0,1,0,0,0|0,0,1]=3 646 B9R0.47 C=CCCCC(N)C(=O)O MCULE-3707920281 [1,0,1,0,0,0|0,0,2]=4 647 B9R0.47 C=CCCCC(N)C(=O)O MCULE-5939027667 [1,0,1,0,0,0|0,0,2]=4 648 B9R0.47 C=CCCCC(N)C(=O)O MCULE-6095387409 [1,0,1,0,0,0|0,0,2]=4 649 B9R0.47 C=CCCC[C@@H](N)C(=O)O MCULE-2101628204 [1,0,1,0,0,0|0,0,2]=4 650 B9R0.47 C=CCCC[C@@H](N)C(=O)O MCULE-7328150693 [1,0,1,0,0,0|0,0,2]=4 651 B9R0.47 C=CCCC[C@H](N)C(=O)O MCULE-1162071877 [1,0,1,0,0,0|0,0,2]=4 652 B9R0.47 C=CCCC[C@H](N)C(=O)O MCULE-7245809917 [1,0,1,0,0,0|0,0,2]=4 653 B9R0.47 C=CCSCC(N)C(=O)O MCULE-6058548878 [1,0,1,0,0,0|0,0,1]=3 654 B9R0.47 C=CCSCC(N)C(=O)O MCULE-9209051108 [1,0,1,0,0,0|0,0,1]=3 655 B9R0.47 C=CCSC[C@@H](N)C(=O)O MCULE-8305031365 [1,0,1,0,0,0|0,0,1]=3 656 B9R0.47 C=CCSC[C@@H](N)C(=O)O MCULE-9911064679 [1,0,1,0,0,0|0,0,1]=3 657 B9R0.47 C=CCSC[C@H](N)C(=O)O MCULE-8106938913 [1,0,1,0,0,0|0,0,1]=3 658 B9R0.47 C=CCSC[C@H](N)C(=O)O MCULE-8215284816 [1,0,1,0,0,0|0,0,1]=3 659 B9R0.47 C=CCSC[C@H](N)C(=O)O MCULE-9415243514 [1,0,1,0,0,0|0,0,1]=3 660 B9R0.47 C=CSCC[C@H](N)C(=O)O MCULE-2736074137 [1,0,1,0,0,0|0,0,1]=3 661 B9R0.47 CC=CSC[C@H](N)C(=O)O MCULE-2840170360 [1,0,1,0,0,0|0,0,1]=3 662 B9R0.47 NCC=CCC(N)C(=O)O MCULE-9924781011 [1,0,1,0,0,0|1,0,1]=4 663 B9R1.12 BrCCCC1=CC=CS1 MCULE-8473809288 [2,0,0,0,0,0|1,0,1]=4 664 B9R1.12 CCCCC1=CC=CS1 MCULE-6497067465 [2,0,0,0,0,0|1,0,1]=4 665 B9R1.12 CNCCC1=CC=CS1 MCULE-3255812275 [2,0,0,0,0,0|2,0,0]=4 666 B9R1.12 CNCCC1=CC=CS1 MCULE-7158889063 [2,0,0,0,0,0|2,0,0]=4 667 B9R1.12 ICCCC1=CC=CS1 MCULE-4415945327 [2,0,0,0,0,0|1,0,1]=4 668 B9R1.12 N#CCCC1=CC=CS1 MCULE-6985631481 [2,0,0,0,0,0|1,0,1]=4 669 B9R1.12 NCCCC1=CC=CS1 MCULE-9727379761 [2,0,0,0,0,0|1,0,1]=4 670 B9R1.12 O=C=NCC1=CC=CS1 MCULE-8982331264 [2,0,0,0,0,0|1,0,1]=4 671 B9R1.12 O=CCCC1=CSC=C1 MCULE-6196067591 [2,0,0,0,0,0|2,0,0]=4 672 B9R1.12 O=CCCN1C=CC=N1 MCULE-4967326734 [2,0,0,0,0,0|2,0,0]=4 673 B9R1.12 O=CNCC1=CC=CO1 MCULE-1492066833 [2,0,0,0,0,0|1,1,0]=4 674 B9R1.12 OCCCC1=CC=CO1 MCULE-9519443667 [2,0,0,0,0,0|0,1,1]=4 675 B9R1.12 OCCCC1=CC=CS1 MCULE-7758662539 [2,0,0,0,0,0|0,0,1]=3 676 B9R1.12 OCCCC1=CN=CS1 MCULE-9607601938 [2,0,0,0,0,0|1,0,1]=4 677 B9R1.12 OCCSC1=CC=CS1 MCULE-7432462864 [2,0,0,0,0,0|1,0,1]=4 678 B9R1.13 C=C(Br)CC1=CC=CS1 MCULE-4173578387 [2,0,0,0,0,0|1,0,1]=4 679 B9R1.13 C=C(C)CC1=CC=CS1 MCULE-7442921300 [2,0,0,0,0,0|1,0,1]=4 680 B9R1.13 C=C(Cl)CC1=CC=CS1 MCULE-7939948941 [2,0,0,0,0,0|1,0,1]=4 681 B9R1.13 CC(=O)CC1=CC=CS1 MCULE-9004703203 [2,0,0,0,0,0|1,0,1]=4 682 B9R1.13 CC(C)CC1=CC=CS1 MCULE-7756712498 [2,0,0,0,0,0|1,0,1]=4 683 B9R1.13 CC(N)CC1=CC=CN1 MCULE-3993757072 [2,0,0,0,0,0|1,0,1]=4 684 B9R1.13 CC(N)CC1=CC=CO1 MCULE-3146116219 [2,0,0,0,0,0|0,1,1]=4 685 B9R1.13 CC(N)CC1=CC=CO1 MCULE-4578762065 [2,0,0,0,0,0|0,1,1]=4 686 B9R1.13 CC(N)CC1=CC=CS1 MCULE-5917281272 [2,0,0,0,0,0|0,0,1]=3 687 B9R1.13 CC(N)CC1=CC=CS1 MCULE-9871715308 [2,0,0,0,0,0|0,0,1]=3 688 B9R1.13 CC(N)CC1=NC=CS1 MCULE-1794303960 [2,0,0,0,0,0|1,0,1]=4 689 B9R1.13 CC(N)CC1=NC=CS1 MCULE-4613740594 [2,0,0,0,0,0|1,0,1]=4 690 B9R1.13 CC(O)CC1=CC=CO1 MCULE-5714080569 [2,0,0,0,0,0|1,1,0]=4 691 B9R1.13 N=C(N)CC1=CC=CS1 MCULE-6269778112 [2,0,0,0,0,0|1,0,1]=4 692 B9R1.13 N=C(N)CC1=CC=CS1 MCULE-7350630491 [2,0,0,0,0,0|1,0,1]=4 693 B9R1.13 NC(=O)CC1=CC=CS1 MCULE-6510920095 [2,0,0,0,0,0|0,0,1]=3 694 B9R1.13 NC(=S)CC1=CC=CS1 MCULE-6485403231 [2,0,0,0,0,0|0,1,1]=4 695 B9R1.13 O=C(Cl)CC1=CC=CS1 MCULE-3077784578 [2,0,0,0,0,0|1,0,1]=4 696 B9R1.13 O=C(O)CC1=CC=CS1 MCULE-7149489344 [2,0,0,0,0,0|1,0,1]=4 697 B11R1.84 N#CC(CO)CC1=CC=CS1 MCULE-1515423765 [1,1,0,0,0,0|0,0,2]=4 698 B11R1.84 NCC(CO)CC1=CC=CO1 MCULE-4198447918 [1,1,0,0,0,0|0,1,1]=4 699 B11R1.84 NCC(CO)CC1=CC=CS1 MCULE-7996114416 [1,1,0,0,0,0|0,0,1]=3 700 B11R1.25 CCC(=O)NCC1=CC=CS1 MCULE-1610876111 [1,1,0,0,0,0|2,0,0]=4 701 B11R1.25 CNC(=O)NCC1=CC=CS1 MCULE-1125755388 [1,1,0,0,0,0|2,0,0]=4 702 B11R1.25 COC(=O)/C=C/C1=CC=CS1 MCULE-5564124883 [1,1,0,0,0,0|0,0,2]=4 703 B11R1.25 COC(=O)C#CC1=CC=CS1 MCULE-9094321397 [1,1,0,0,0,0|0,0,2]=4 704 B11R1.25 COC(=O)C=CC1=CC=CS1 MCULE-8316070904 [1,1,0,0,0,0|0,0,2]=4 705 B11R1.25 COC(=O)CCC1=CC=CN1 MCULE-3378177183 [1,1,0,0,0,0|1,0,0]=3 706 B11R1.25 COC(=O)CCC1=CC=CS1 MCULE-2290836142 [1,1,0,0,0,0|0,0,0]=2 707 B11R1.25 COC(=O)CCC1=CNC=N1 MCULE-4772939579 [1,1,0,0,0,0|2,0,0]=4 708 B11R1.25 COC(=O)CCC1=CNC=N1 MCULE-6123767498 [1,1,0,0,0,0|2,0,0]=4 709 B11R1.25 COC(=O)CCC1=CSC=C1 MCULE-3462905030 [1,1,0,0,0,0|2,0,0]=4 710 B11R1.25 COC(=O)CCN1C=CC=N1 MCULE-3487586495 [1,1,0,0,0,0|2,0,0]=4 711 B11R1.25 N/C(=N\O)/CSC1=CC=CS1 MCULE-8536583038 [1,1,0,0,0,0|2,0,0]=4 712 B11R1.25 NNC(=O)CCC1=CC=CO1 MCULE-2610803816 [1,1,0,0,0,0|1,1,0]=4 713 B11R1.25 NNC(=O)CSC1=CC=CS1 MCULE-6283713453 [1,1,0,0,0,0|2,0,0]=4 714 B11R1.25 O=C(CBr)NCC1=CC=CS1 MCULE-3638675359 [1,1,0,0,0,0|2,0,0]=4 715 B11R1.25 O=C(CCl)NCC1=CC=CS1 MCULE-8042041374 [1,1,0,0,0,0|2,0,0]=4 716 B11R1.75 CC(=O)CCC1=CC=C(S1)Cl MCULE-1642922072 [1,1,0,0,0,0|1,0,0]=3 717 B11R1.75 CC(=O)SCC1=CC(=CS1)Br MCULE-6460082219 [1,1,0,0,0,0|2,0,0]=4 718 B11R1.75 CC1=CC(=NO1)CCC(=O)O MCULE-3378074738 [1,1,0,0,0,0|2,0,0]=4 719 B11R1.75 CC1=CC=C(O1)CCC(=O)N MCULE-3566354504 [1,1,0,0,0,0|1,1,0]=4 720 B11R1.75 CC1=CC=C(O1)CCC(=O)O MCULE-6067365329 [1,1,0,0,0,0|0,1,0]=3 721 B11R1.75 CC1=CC=C(S1)/C=C/C(=O)O MCULE-4670055713 [1,1,0,0,0,0|0,0,2]=4 722 B11R1.75 CC1=CC=C(S1)C#CC(=O)O MCULE-3230780385 [1,1,0,0,0,0|0,0,2]=4 723 B11R1.75 CC1=CC=C(S1)C=CC(=O)O MCULE-8372699009 [1,1,0,0,0,0|0,0,2]=4 724 B11R1.75 CC1=CC=C(S1)CCC(=O)O MCULE-1322543612 [1,1,0,0,0,0|0,0,0]=2 725 B11R1.75 CC1=CN(N=C1)CCC(=O)O MCULE-7604509857 [1,1,0,0,0,0|2,0,0]=4 726 B11R1.75 CC1=CN=C(N1)CCC(=O)O MCULE-3730863195 [1,1,0,0,0,0|2,0,0]=4 727 B11R1.75 CC1=CN=C(O1)CCC(=O)O MCULE-2444599746 [1,1,0,0,0,0|1,1,0]=4 728 B11R1.75 CC1=CSC(=C1)/C=C/C(=O)O MCULE-6467593472 [1,1,0,0,0,0|0,0,2]=4 729 B11R1.75 CC1=CSC(=C1)CCC(=O)O MCULE-9487444949 [1,1,0,0,0,0|0,0,0]=2 730 B11R1.75 CC1=CSC(=N1)CCC(=O)N MCULE-5623580389 [1,1,0,0,0,0|2,0,0]=4 731 B11R1.75 CC1=CSC(=N1)CCC(=O)O MCULE-4382447299 [1,1,0,0,0,0|1,0,0]=3 732 B11R1.75 CC1=CSC(=N1)NCC(=O)O MCULE-4902640151 [1,1,0,0,0,0|2,0,0]=4 733 B11R1.75 CC1=CSC(=N1)SCC(=O)O MCULE-6976524215 [1,1,0,0,0,0|2,0,0]=4 734 B11R1.75 CC1=C[NH+]=C(S1)SCC(=O)O MCULE-5281457461 [1,1,0,0,0,0|2,0,0]=4 735 B11R1.75 CC1=C[NH+]=C(S1)SCC(=O)O MCULE-6150685273 [1,1,0,0,0,0|2,0,0]=4 736 B11R1.75 CC1=NC(=CN1)CCC(=O)O MCULE-4312521330 [1,1,0,0,0,0|2,0,0]=4 737 B11R1.75 CC1=NC(=CS1)CCC(=O)O MCULE-6201333243 [1,1,0,0,0,0|2,0,0]=4 738 B11R1.75 CC1=NC(=CS1)CCC(=O)O MCULE-7724457432 [1,1,0,0,0,0|2,0,0]=4 739 B11R1.75 CC1=NC=C(S1)CCC(=O)O MCULE-3350399518 [1,1,0,0,0,0|1,0,0]=3 740 B11R1.75 CC1=NN(C=C1)CCC(=O)O MCULE-4493982895 [1,1,0,0,0,0|2,0,0]=4 741 B11R1.75 CC1=NN=C(S1)CCC(=O)O MCULE-6765716317 [1,1,0,0,0,0|2,0,0]=4 742 B11R1.75 CC1=NNC(=C1)CCC(=O)O MCULE-6612442548 [1,1,0,0,0,0|2,0,0]=4 743 B11R1.75 CC1=NOC(=C1)CCC(=O)O MCULE-6454692713 [1,1,0,0,0,0|1,1,0]=4 744 B11R1.75 CN1C=CC(=C1)CCC(=O)O MCULE-4623817123 [1,1,0,0,0,0|2,0,0]=4 745 B11R1.75 CN1C=CC(=N1)CCC(=O)O MCULE-8327068965 [1,1,0,0,0,0|2,0,0]=4 746 B11R1.75 N=C(N)CCC1=CC=C(S1)Br MCULE-9135113865 [1,1,0,0,0,0|2,0,0]=4 747 B11R1.75 N=C(N)CCC1=CC=C(S1)Br MCULE-9346681122 [1,1,0,0,0,0|2,0,0]=4 748 B11R1.75 NC1=CN(N=C1)CCC(=O)O MCULE-5141494259 [1,1,0,0,0,0|2,0,0]=4 749 B11R1.75 NC1=CN(N=C1)CCC(=O)O MCULE-5520811129 [1,1,0,0,0,0|2,0,0]=4 750 B11R1.75 NC1=NC(=CS1)CCC(=O)O MCULE-1519545014 [1,1,0,0,0,0|2,0,0]=4 751 B11R1.75 NC1=NC(=CS1)CCC(=O)O MCULE-2497158466 [1,1,0,0,0,0|2,0,0]=4 752 B11R1.75 NC1=NC(=CS1)CCC(=O)O MCULE-5882922452 [1,1,0,0,0,0|2,0,0]=4 753 B11R1.75 NC1=NC=C(S1)CCC(=O)O MCULE-1788897200 [1,1,0,0,0,0|1,0,0]=3 754 B11R1.75 NC1=NN(C=C1)CCC(=O)O MCULE-2349651141 [1,1,0,0,0,0|2,0,0]=4 755 B11R1.75 NC1=NN(C=C1)CCC(=O)O MCULE-5522157737 [1,1,0,0,0,0|2,0,0]=4 756 B11R1.75 NC1=NN=C(S1)CCC(=O)O MCULE-4126907880 [1,1,0,0,0,0|2,0,0]=4 757 B11R1.75 O=C(O)/C=C/C1=CC(=CS1)Br MCULE-8144525587 [1,1,0,0,0,0|0,0,2]=4 758 B11R1.75 O=C(O)/C=C/C1=CC=C(S1)Br MCULE-6931620559 [1,1,0,0,0,0|0,0,2]=4 759 B11R1.75 O=C(O)C=CC1=CC(=CS1)Br MCULE-2182030384 [1,1,0,0,0,0|0,0,2]=4 760 B11R1.75 O=C(O)C=CC1=CC=C(S1)Br MCULE-2801862894 [1,1,0,0,0,0|0,0,2]=4 761 B11R1.75 O=C(O)CCC1=CC(=CS1)Br MCULE-2009432961 [1,1,0,0,0,0|0,0,0]=2 762 B11R1.75 O=C(O)CCC1=CC(=CS1)Cl MCULE-3702716997 [1,1,0,0,0,0|0,0,0]=2 763 B11R1.75 O=C(O)CCC1=CC(=NO1)Br MCULE-2306740292 [1,1,0,0,0,0|1,1,0]=4 764 B11R1.75 O=C(O)CCC1=CC(=NO1)Cl MCULE-8953796559 [1,1,0,0,0,0|1,1,0]=4 765 B11R1.75 O=C(O)CCC1=CC(=O)NO1 MCULE-1230469268 [1,1,0,0,0,0|1,1,0]=4 766 B11R1.75 O=C(O)CCC1=CC=C(S1)Br MCULE-1504750189 [1,1,0,0,0,0|0,0,0]=2 767 B11R1.75 O=C(O)CCC1=CC=C(S1)Cl MCULE-8046412357 [1,1,0,0,0,0|0,0,0]=2 768 B11R1.75 O=C(O)CCC1=CN=C(S1)Br MCULE-8659303793 [1,1,0,0,0,0|1,0,0]=3 769 B11R1.75 O=C(O)CCC1=CNC(=O)N1 MCULE-2706002292 [1,1,0,0,0,0|2,0,0]=4 770 B11R1.75 O=C(O)CCC1=CNC(=S)N1 MCULE-3837669031 [1,1,0,0,0,0|2,0,0]=4 771 B11R1.75 O=C(O)CCC1=CSC(=C1)Br MCULE-4727002489 [1,1,0,0,0,0|2,0,0]=4 772 B11R1.75 O=C(O)CCN1C=C(C=N1)Br MCULE-2058062625 [1,1,0,0,0,0|2,0,0]=4 773 B11R1.75 O=C(O)CCN1C=C(C=N1)Br MCULE-7711015175 [1,1,0,0,0,0|2,0,0]=4 774 B11R1.75 O=C(O)CCN1C=C(C=N1)Cl MCULE-2424288635 [1,1,0,0,0,0|2,0,0]=4 775 B11R1.75 O=C(O)CCN1C=C(C=N1)F MCULE-7041627124 [1,1,0,0,0,0|2,0,0]=4 776 B11R1.75 O=C(O)CCN1C=C(C=N1)I MCULE-5094869596 [1,1,0,0,0,0|2,0,0]=4 777 B11R1.75 O=C(O)CCN1C=CC(=N1)Br MCULE-8600169451 [1,1,0,0,0,0|2,0,0]=4 778 B11R1.75 O=C(O)CCN1C=CC(=N1)F MCULE-5963463856 [1,1,0,0,0,0|2,0,0]=4 779 B11R1.75 O=C(O)CCN1C=CC(=N1)I MCULE-1402780610 [1,1,0,0,0,0|2,0,0]=4 780 B11R1.77 C=C(C)C[C@@H](N)C1=CC=CS1 MCULE-1300695825 [1,1,0,0,0,0|2,0,0]=4 781 B11R1.77 C=C(C)C[C@@H](N)C1=CC=CS1 MCULE-1669893695 [1,1,0,0,0,0|2,0,0]=4 782 B11R1.77 C=C(C)C[C@H](N)C1=CC=CS1 MCULE-1807659264 [1,1,0,0,0,0|2,0,0]=4 783 B11R1.77 C=C(C)C[C@H](N)C1=CC=CS1 MCULE-5600084582 [1,1,0,0,0,0|2,0,0]=4 784 B11R1.77 CC(=CC(=O)O)C1=CC=CS1 MCULE-7179456295 [1,1,0,0,0,0|0,0,2]=4 785 B11R1.77 CC(=O)CC(=O)C1=CC=CS1 MCULE-3430263061 [1,1,0,0,0,0|1,0,1]=4 786 B11R1.77 CC(CC(=O)O)C1=CC=CO1 MCULE-1929187509 [1,1,0,0,0,0|0,1,0]=3 787 B11R1.77 CC(CC(=O)O)C1=CC=CS1 MCULE-4589142714 [1,1,0,0,0,0|0,0,0]=2 788 B11R1.77 CC(CC(=O)O)N1C=CC=C1 MCULE-6250699921 [1,1,0,0,0,0|2,0,0]=4 789 B11R1.77 CC(CC(=O)O)N1C=CC=N1 MCULE-7333285698 [1,1,0,0,0,0|2,0,0]=4 790 B11R1.77 NC(CC(=O)O)C1=CC=CO1 MCULE-4837417792 [1,1,0,0,0,0|0,1,0]=3 791 B11R1.77 NC(CC(=O)O)C1=CC=CO1 MCULE-4958340543 [1,1,0,0,0,0|0,1,0]=3 792 B11R1.77 NC(CC(=O)O)C1=CC=CS1 MCULE-4310408967 [1,1,0,0,0,0|0,0,0]=2 793 B11R1.77 NC(CC(=O)O)C1=CC=CS1 MCULE-4515895911 [1,1,0,0,0,0|0,0,0]=2 794 B11R1.77 NC(CC(=O)O)C1=CC=CS1 MCULE-8010171040 [1,1,0,0,0,0|0,0,0]=2 795 B11R1.77 NC(CC(=O)O)C1=COC=C1 MCULE-6837342366 [1,1,0,0,0,0|2,0,0]=4 796 B11R1.77 NC(CC(=O)O)C1=CSC=C1 MCULE-6863038462 [1,1,0,0,0,0|2,0,0]=4 797 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CO1 MCULE-3487071362 [1,1,0,0,0,0|0,1,0]=3 798 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CO1 MCULE-6738812017 [1,1,0,0,0,0|0,1,0]=3 799 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CO1 MCULE-6817919574 [1,1,0,0,0,0|0,1,0]=3 800 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CS1 MCULE-5396701536 [1,1,0,0,0,0|0,0,0]=2 801 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CS1 MCULE-6166848611 [1,1,0,0,0,0|0,0,0]=2 802 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CS1 MCULE-7980073440 [1,1,0,0,0,0|0,0,0]=2 803 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CS1 MCULE-9153700407 [1,1,0,0,0,0|0,0,0]=2 804 B11R1.77 N[C@@H](CC(=O)O)C1=COC=C1 MCULE-1944262956 [1,1,0,0,0,0|2,0,0]=4 805 B11R1.77 N[C@@H](CC(=O)O)C1=CSC=C1 MCULE-2001475870 [1,1,0,0,0,0|2,0,0]=4 806 B11R1.77 N[C@@H](CC(=O)O)C1=CSC=C1 MCULE-7065799451 [1,1,0,0,0,0|2,0,0]=4 807 B11R1.77 N[C@H](CC(=O)O)C1=CC=CO1 MCULE-1644247813 [1,1,0,0,0,0|0,1,0]=3 808 B11R1.77 N[C@H](CC(=O)O)C1=CC=CO1 MCULE-3339059246 [1,1,0,0,0,0|0,1,0]=3 809 B11R1.77 N[C@H](CC(=O)O)C1=CC=CO1 MCULE-9235419752 [1,1,0,0,0,0|0,1,0]=3 810 B11R1.77 N[C@H](CC(=O)O)C1=CC=CO1 MCULE-9295639672 [1,1,0,0,0,0|0,1,0]=3 811 B11R1.77 N[C@H](CC(=O)O)C1=CC=CS1 MCULE-3827031042 [1,1,0,0,0,0|0,0,0]=2 812 B11R1.77 N[C@H](CC(=O)O)C1=CC=CS1 MCULE-7126396520 [1,1,0,0,0,0|0,0,0]=2 813 B11R1.77 N[C@H](CC(=O)O)C1=CSC=C1 MCULE-3280793536 [1,1,0,0,0,0|2,0,0]=4 814 B11R1.77 N[C@H](CC(=O)O)C1=CSC=C1 MCULE-5136787808 [1,1,0,0,0,0|2,0,0]=4 815 B11R1.77 O=C(O)CC(=O)C1=CC=CO1 MCULE-2623089072 [1,1,0,0,0,0|0,1,1]=4 816 B11R1.90 CC1=C(SC=C1)/C=C/C(=O)O MCULE-7874369652 [1,1,0,0,0,0|0,0,2]=4 817 B11R1.90 CC1=C(SC=C1)C=CC(=O)O MCULE-5468660790 [1,1,0,0,0,0|0,0,2]=4 818 B11R1.90 CC1=C(SC=C1)CCC(=O)O MCULE-6164958609 [1,1,0,0,0,0|0,0,0]=2 819 B11R1.90 CC1=C(SC=N1)CCC(=O)O MCULE-5922966332 [1,1,0,0,0,0|1,0,0]=3 820 B11R1.90 CC1=CC=NN1CCC(=O)O MCULE-2170696066 [1,1,0,0,0,0|2,0,0]=4 821 B11R1.90 CN1C=CC=C1CCC(=O)O MCULE-2837121735 [1,1,0,0,0,0|1,0,0]=3 822 B11R1.90 CN1C=CN=C1CCC(=O)O MCULE-7010355695 [1,1,0,0,0,0|2,0,0]=4 823 B11R1.90 CN1C=CN=C1CCC(=O)O MCULE-9754415146 [1,1,0,0,0,0|2,0,0]=4 824 B11R1.90 CN1C=NC=C1CCC(=O)O MCULE-6757787886 [1,1,0,0,0,0|2,0,0]=4 825 B11R1.90 CN1C=NC=C1CCC(=O)O MCULE-9165044655 [1,1,0,0,0,0|2,0,0]=4 826 B11R1.90 CN1N=CC=C1CCC(=O)O MCULE-9654508612 [1,1,0,0,0,0|2,0,0]=4 827 B11R1.90 O=C(O)CCC1=C(C=CS1)Br MCULE-6201800612 [1,1,0,0,0,0|0,0,0]=2 828 B11R1.90 O=C(O)CCC1=C(SC=C1)Br MCULE-2144738859 [1,1,0,0,0,0|2,0,0]=4 829 B11R1.90 O=C(O)CCC1=CSC=C1Br MCULE-7023777453 [1,1,0,0,0,0|2,0,0]=4 830 B11R1.90 O=C(O)CCN1N=CC=C1Br MCULE-9755197354 [1,1,0,0,0,0|2,0,0]=4 831 B11R1.90 O=C(O)CCN1N=CC=C1I MCULE-5457464804 [1,1,0,0,0,0|2,0,0]=4 832 B11R1.510 CC(C)(O)CCC1=CC=CS1 MCULE-2494489075 [1,1,0,0,0,0|1,0,1]=4 833 B11R1.510 NS(=O)(=O)CCC1=CC=CS1 MCULE-1604732649 [1,1,0,0,0,0|1,0,1]=4 834 B11R1.510 O=S(=O)(Cl)CCC1=CC=CS1 MCULE-9605811722 [1,1,0,0,0,0|1,0,1]=4 835 B11R1.89 CC1=C(NC=N1)[C@H](N)C(=O)O MCULE-9548760808 [0,1,0,0,1,0|2,0,0]=4 836 B11R1.89 CC1=C(SC=C1)C(N)C(=O)N MCULE-2672164846 [0,1,0,0,1,0|1,0,0]=3 837 B11R1.89 CC1=C(SC=C1)C(N)C(=O)O MCULE-5383112400 [0,1,0,0,1,0|0,0,0]=2 838 B11R1.89 CC1=C(SC=C1)C(O)C(=O)O MCULE-5857251955 [0,1,0,0,1,0|1,0,0]=3 839 B11R1.89 CC1=C(SC=N1)C(N)C(=O)O MCULE-5986966626 [0,1,0,0,1,0|1,0,0]=3 840 B11R1.89 CN1C=CN=C1C(N)C(=O)O MCULE-1792986363 [0,1,0,0,1,0|2,0,0]=4 841 B11R1.89 CN1N=CC=C1C(N)C(=O)O MCULE-9588355519 [0,1,0,0,1,0|2,0,0]=4 842 B11R1.89 CN1N=CC=C1C(N)C(=O)O MCULE-9641985239 [0,1,0,0,1,0|2,0,0]=4 843 B11R1.173 CC(C)(C(=O)O)C1=CC=CO1 MCULE-9089584618 [0,1,0,0,1,0|1,1,0]=4 844 B11R1.173 CC(C)(C(=O)O)C1=CC=CS1 MCULE-2841371357 [0,1,0,0,1,0|1,0,0]=3 845 B11R1.173 CC(C)(C(=O)O)C1=CC=NS1 MCULE-6416991030 [0,1,0,0,1,0|2,0,0]=4 846 B11R1.173 CC(C)(C(=O)O)C1=NC=CS1 MCULE-9385157327 [0,1,0,0,1,0|2,0,0]=4 847 B11R1.173 CC(N)(C(=O)N)C1=CC=CS1 MCULE-5343337552 [0,1,0,0,1,0|1,0,0]=3 848 B11R1.173 CC(N)(C(=O)O)C1=CC=CO1 MCULE-1585679619 [0,1,0,0,1,0|0,1,0]=3 849 B11R1.173 CC(N)(C(=O)O)C1=CC=CS1 MCULE-9404385881 [0,1,0,0,1,0|0,0,0]=2 850 B11R1.173 CC(O)(C(=O)O)C1=CC=CS1 MCULE-7214377033 [0,1,0,0,1,0|1,0,0]=3 851 B11R1.173 C[C@](N)(C(=O)O)C1=CC=CO1 MCULE-1980010432 [0,1,0,0,1,0|0,1,0]=3 852 B11R1.173 C[C@](N)(C(=O)O)C1=CC=CS1 MCULE-4767708238 [0,1,0,0,1,0|0,0,0]=2 853 B11R1.173 NC(=O)C(F)(F)C1=CC=CS1 MCULE-2325528943 [0,1,0,0,1,0|2,0,0]=4 854 B11R1.173 O=C(O)C(F)(F)C1=CN=CS1 MCULE-7748890477 [0,1,0,0,1,0|2,0,0]=4 855 B11R1.173 O=C(O)C(F)(F)C1=NC=CS1 MCULE-6185941984 [0,1,0,0,1,0|2,0,0]=4 856 B11R1.298 CC(=O)C(C#N)C1=CC=CS1 MCULE-2394211158 [0,1,0,0,1,0|1,0,1]=4 857 B11R1.298 CNC(C(=O)O)C1=CC=CS1 MCULE-7262084049 [0,1,0,0,1,0|0,0,0]=2 858 B11R1.298 CNC(C(=O)O)C1=CC=CS1 MCULE-9149972598 [0,1,0,0,1,0|0,0,0]=2 859 B11R1.298 COC(C(=O)O)C1=CC=CS1 MCULE-6999127669 [0,1,0,0,1,0|1,0,0]=3 860 B11R1.314 CC(C(=O)O)C1=CC=C(S1)Br MCULE-2022826696 [0,1,0,0,1,0|1,0,0]=3 861 B11R1.314 CC(C(=O)O)C1=CC=C(S1)Cl MCULE-5632721232 [0,1,0,0,1,0|1,0,0]=3 862 B11R1.314 CC1=CC=C(O1)C(C)C(=O)O MCULE-5527161933 [0,1,0,0,1,0|1,1,0]=4 863 B11R1.314 CC1=CC=C(S1)C(C)C(=O)O MCULE-8801257182 [0,1,0,0,1,0|1,0,0]=3 864 B11R1.314 CC1=CC=C(S1)C(N)C(=O)N MCULE-6178098010 [0,1,0,0,1,0|1,0,0]=3 865 B11R1.314 CC1=CC=C(S1)C(N)C(=O)O MCULE-9803888253 [0,1,0,0,1,0|0,0,0]=2 866 B11R1.314 CC1=CC=C(S1)C(O)C(=O)N MCULE-2322598883 [0,1,0,0,1,0|2,0,0]=4 867 B11R1.314 CC1=CC=C(S1)C(O)C(=O)O MCULE-6438806460 [0,1,0,0,1,0|1,0,0]=3 868 B11R1.314 CC1=CSC(=N1)C(C)C(=O)O MCULE-7615785348 [0,1,0,0,1,0|2,0,0]=4 869 B11R1.314 CN1C=CC(=N1)C(N)C(=O)O MCULE-4282498303 [0,1,0,0,1,0|2,0,0]=4 870 B11R1.314 NC(=O)C(N)C1=CC(=CS1)Br MCULE-8044286943 [0,1,0,0,1,0|1,0,0]=3 871 B11R1.314 NC(C(=O)O)C1=CC(=CS1)Br MCULE-1427984761 [0,1,0,0,1,0|0,0,0]=2 872 B11R1.314 NC(C(=O)O)C1=CC(=O)NO1 MCULE-5209210148 [0,1,0,0,1,0|1,1,0]=4 873 B11R1.314 NC(C(=O)O)C1=CSC(=C1)Br MCULE-2671506137 [0,1,0,0,1,0|2,0,0]=4 874 B11R1.314 N[C@H](C(=O)O)C1=CC(=O)NO1 MCULE-5753702701 [0,1,0,0,1,0|1,1,0]=4 875 B11R1.314 O=C(O)C(=O)C1=CC=C(S1)Br MCULE-8370383819 [0,1,0,0,1,0|1,0,1]=4 876 B11R1.314 O=C(O)C(=O)C1=CC=C(S1)Cl MCULE-9143047721 [0,1,0,0,1,0|1,0,1]=4 877 B11R1.314 O=C(O)C(O)C1=CC=C(S1)Br MCULE-8096148089 [0,1,0,0,1,0|1,0,0]=3 878 B13R1.133 CC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-6683812666 [0,1,0,0,0,1|2,0,0]=4 879 B13R1.133 CC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-1280505558 [0,1,0,0,0,1|2,0,0]=4 880 B13R1.133 CC(CC1=CC=C(C=C1)F)C(=O)O MCULE-5939301963 [0,1,0,0,0,1|2,0,0]=4 881 B13R1.133 CC(CC1=CC=C(C=C1)N)C(=O)O MCULE-5845815463 [0,1,0,0,0,1|2,0,0]=4 882 B13R1.133 CC(CC1=CC=C(C=C1)O)C(=O)O MCULE-2516510846 [0,1,0,0,0,1|2,0,0]=4 883 B13R1.133 CC1=CC=C(C=C1)CC(C)C(=O)O MCULE-4590037722 [0,1,0,0,0,1|2,0,0]=4 884 B13R1.133 CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-5938013882 [0,1,0,0,0,1|1,0,0]=3 885 B13R1.133 CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-5941415626 [0,1,0,0,0,1|1,0,0]=3 886 B13R1.133 CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-4074563438 [0,1,0,0,0,1|1,0,0]=3 887 B13R1.133 CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-6283014667 [0,1,0,0,0,1|1,0,0]=3 888 B13R1.133 CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-4426041269 [0,1,0,0,0,1|1,0,0]=3 889 B13R1.133 CC1=CC=C(C=N1)CC(N)C(=O)O MCULE-7515109915 [0,1,0,0,0,1|1,0,0]=3 890 B13R1.133 CC1=CC=C(C=N1)CC(N)C(=O)O MCULE-7970126746 [0,1,0,0,0,1|1,0,0]=3 891 B13R1.133 CC1=CC=C(C=N1)C[C@H](N)C(=O)O MCULE-3552123991 [0,1,0,0,0,1|1,0,0]=3 892 B13R1.133 CC1=CC=C(C=N1)C[C@H](N)C(=O)O MCULE-8500104051 [0,1,0,0,0,1|1,0,0]=3 893 B13R1.133 CC1=CN=C(C=C1)CC(N)C(=O)O MCULE-9990775207 [0,1,0,0,0,1|1,0,0]=3 894 B13R1.133 CC1=NC=C(C=C1)CC(C)C(=O)O MCULE-3690219579 [0,1,0,0,0,1|2,0,0]=4 895 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)Cl MCULE-3507738342 [0,1,0,0,0,1|2,0,0]=4 896 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)Cl MCULE-3797575548 [0,1,0,0,0,1|2,0,0]=4 897 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)I MCULE-5322396806 [0,1,0,0,0,1|2,0,0]=4 898 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)O MCULE-4534251709 [0,1,0,0,0,1|2,0,0]=4 899 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)O MCULE-6666960690 [0,1,0,0,0,1|2,0,0]=4 900 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)O MCULE-7581214871 [0,1,0,0,0,1|2,0,0]=4 901 B13R1.133 NC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-2962528193 [0,1,0,0,0,1|2,0,0]=4 902 B13R1.133 NC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-4978506956 [0,1,0,0,0,1|2,0,0]=4 903 B13R1.133 NC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-6881448953 [0,1,0,0,0,1|2,0,0]=4 904 B13R1.133 NC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-8756948838 [0,1,0,0,0,1|2,0,0]=4 905 B13R1.133 NC(=O)[C@H](N)CC1=CC=C(C=C1)O MCULE-3717625016 [0,1,0,0,0,1|2,0,0]=4 906 B13R1.133 NC(=O)[C@H](N)CC1=CC=C(C=C1)O MCULE-5489720734 [0,1,0,0,0,1|2,0,0]=4 907 B13R1.133 NC(=O)[C@H](N)CC1=CC=C(C=C1)O MCULE-6882717101 [0,1,0,0,0,1|2,0,0]=4 908 B13R1.133 NC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-1775451572 [0,1,0,0,0,1|1,0,0]=3 909 B13R1.133 NC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-7470720579 [0,1,0,0,0,1|1,0,0]=3 910 B13R1.133 NC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-2078281838 [0,1,0,0,0,1|1,0,0]=3 911 B13R1.133 NC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3147443800 [0,1,0,0,0,1|1,0,0]=3 912 B13R1.133 NC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-6446437625 [0,1,0,0,0,1|1,0,0]=3 913 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-1002354431 [0,1,0,0,0,1|1,0,0]=3 914 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-3057881279 [0,1,0,0,0,1|1,0,0]=3 915 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-3274733318 [0,1,0,0,0,1|1,0,0]=3 916 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-9271769862 [0,1,0,0,0,1|1,0,0]=3 917 B13R1.133 NC(CC1=CC=C(C=C1)I)C(=O)O MCULE-3082140157 [0,1,0,0,0,1|1,0,0]=3 918 B13R1.133 NC(CC1=CC=C(C=C1)I)C(=O)O MCULE-8666804898 [0,1,0,0,0,1|1,0,0]=3 919 B13R1.133 NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-1694199256 [0,1,0,0,0,1|1,0,0]=3 920 B13R1.133 NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-3703416768 [0,1,0,0,0,1|1,0,0]=3 921 B13R1.133 NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-6898017610 [0,1,0,0,0,1|1,0,0]=3 922 B13R1.133 NC(CC1=CC=C(C=C1)[O-])C(=O)[O-] MCULE-4113012438 [0,1,0,0,0,1|1,0,1]=4 923 B13R1.133 NC(CC1=CC=C(C=C1)[O-])C(=O)[O-] MCULE-6004946837 [0,1,0,0,0,1|1,0,1]=4 924 B13R1.133 NC(CC1=CC=C(C=N1)Cl)C(=O)O MCULE-3104561565 [0,1,0,0,0,1|1,0,0]=3 925 B13R1.133 NC(CC1=CN=C(C=C1)Cl)C(=O)O MCULE-6144527889 [0,1,0,0,0,1|1,0,0]=3 926 B13R1.133 NC(CC1=NC=C(C=C1)Br)C(=O)O MCULE-1184762054 [0,1,0,0,0,1|1,0,0]=3 927 B13R1.133 NC(CC1=NC=C(C=C1)Br)C(=O)O MCULE-3401635049 [0,1,0,0,0,1|1,0,0]=3 928 B13R1.133 NC(CC1=NC=C(C=C1)Cl)C(=O)O MCULE-7003179779 [0,1,0,0,0,1|1,0,0]=3 929 B13R1.133 NC1=CC=C(C=C1)CC(N)C(=O)O MCULE-3239737488 [0,1,0,0,0,1|1,0,0]=3 930 B13R1.133 NC1=CC=C(C=C1)CC(N)C(=O)O MCULE-6150381462 [0,1,0,0,0,1|1,0,0]=3 931 B13R1.133 NC1=CC=C(C=C1)CC(N)C(=O)O MCULE-9416228233 [0,1,0,0,0,1|1,0,0]=3 932 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-1451751780 [0,1,0,0,0,1|1,0,0]=3 933 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-2816716756 [0,1,0,0,0,1|1,0,0]=3 934 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-6139445410 [0,1,0,0,0,1|1,0,0]=3 935 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-9266819464 [0,1,0,0,0,1|1,0,0]=3 936 B13R1.133 NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-2156725008 [0,1,0,0,0,1|1,0,0]=3 937 B13R1.133 NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-3637255624 [0,1,0,0,0,1|1,0,0]=3 938 B13R1.133 NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-4975962563 [0,1,0,0,0,1|1,0,0]=3 939 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-7143135740 [0,1,0,0,0,1|1,0,0]=3 940 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-8089296783 [0,1,0,0,0,1|1,0,0]=3 941 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-4387611400 [0,1,0,0,0,1|1,0,0]=3 942 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-7124632876 [0,1,0,0,0,1|1,0,0]=3 943 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-7237411145 [0,1,0,0,0,1|1,0,0]=3 944 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-9545997189 [0,1,0,0,0,1|1,0,0]=3 945 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-1704209264 [0,1,0,0,0,1|1,0,0]=3 946 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-4577062521 [0,1,0,0,0,1|1,0,0]=3 947 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-8737892544 [0,1,0,0,0,1|1,0,0]=3 948 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-8976470347 [0,1,0,0,0,1|1,0,0]=3 949 B13R1.133 N[C@@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-2723914313 [0,1,0,0,0,1|1,0,0]=3 950 B13R1.133 N[C@@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-6302870801 [0,1,0,0,0,1|1,0,0]=3 951 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-2932088896 [0,1,0,0,0,1|1,0,0]=3 952 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-2973514450 [0,1,0,0,0,1|1,0,0]=3 953 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-6154244493 [0,1,0,0,0,1|1,0,0]=3 954 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-8059108702 [0,1,0,0,0,1|1,0,0]=3 955 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)[O-] MCULE-5588166039 [0,1,0,0,0,1|1,0,1]=4 956 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)[O-] MCULE-6851459722 [0,1,0,0,0,1|1,0,1]=4 957 B13R1.133 N[C@@H](CC1=CC=C(C=C1)[O-])C(=O)[O-] MCULE-1962102238 [0,1,0,0,0,1|1,0,1]=4 958 B13R1.133 N[C@@H](CC1=CC=C(C=C1)[O-])C(=O)[O-] MCULE-2311115551 [0,1,0,0,0,1|1,0,1]=4 959 B13R1.133 N[C@@H](CC1=CC=C(C=N1)Cl)C(=O)O MCULE-8852055943 [0,1,0,0,0,1|1,0,0]=3 960 B13R1.133 N[C@@H](CC1=CC=C(N=C1)Cl)C(=O)O MCULE-1340381614 [0,1,0,0,0,1|1,0,0]=3 961 B13R1.133 N[C@@H](CC1=CC=C(N=C1)Cl)C(=O)O MCULE-5029235962 [0,1,0,0,0,1|1,0,0]=3 962 B13R1.133 N[C@@H](CC1=CN=C(C=C1)Cl)C(=O)O MCULE-5440835507 [0,1,0,0,0,1|1,0,0]=3 963 B13R1.133 N[C@@H](CC1=CN=C(C=C1)Cl)C(=O)O MCULE-6580710907 [0,1,0,0,0,1|1,0,0]=3 964 B13R1.133 N[C@@H](CC1=NC=C(C=C1)Br)C(=O)O MCULE-5841875025 [0,1,0,0,0,1|1,0,0]=3 965 B13R1.133 N[C@@H](CC1=NC=C(C=C1)Br)C(=O)O MCULE-8825878130 [0,1,0,0,0,1|1,0,0]=3 966 B13R1.133 N[C@@H](CC1=NC=C(C=C1)Cl)C(=O)O MCULE-7695251719 [0,1,0,0,0,1|1,0,0]=3 967 B13R1.133 N[C@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-4875394682 [0,1,0,0,0,1|1,0,0]=3 968 B13R1.133 N[C@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-8335788231 [0,1,0,0,0,1|1,0,0]=3 969 B13R1.133 N[C@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-8515191610 [0,1,0,0,0,1|1,0,0]=3 970 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-2834745731 [0,1,0,0,0,1|1,0,0]=3 971 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3982277557 [0,1,0,0,0,1|1,0,0]=3 972 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-4128938211 [0,1,0,0,0,1|1,0,0]=3 973 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-6437321299 [0,1,0,0,0,1|1,0,0]=3 974 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-1442650276 [0,1,0,0,0,1|1,0,0]=3 975 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-3700362961 [0,1,0,0,0,1|1,0,0]=3 976 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-8139852905 [0,1,0,0,0,1|1,0,0]=3 977 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-9312923607 [0,1,0,0,0,1|1,0,0]=3 978 B13R1.133 N[C@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-2177794046 [0,1,0,0,0,1|1,0,0]=3 979 B13R1.133 N[C@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-2766032223 [0,1,0,0,0,1|1,0,0]=3 980 B13R1.133 N[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-6003337645 [0,1,0,0,0,1|1,0,0]=3 981 B13R1.133 N[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-7719741497 [0,1,0,0,0,1|1,0,0]=3 982 B13R1.133 O=C(O)C(Br)CC1=CC=C(C=C1)Cl MCULE-5204071465 [0,1,0,0,0,1|2,0,0]=4 983 B13R1.133 O=C(O)C(Br)CC1=CC=C(C=C1)F MCULE-5681231647 [0,1,0,0,0,1|2,0,0]=4 984 B13R1.133 O=C(O)C(F)CC1=CC=C(C=C1)O MCULE-6083408945 [0,1,0,0,0,1|2,0,0]=4 985 B13R1.133 O=C(O)C(O)CC1=CC=C(C=C1)Br MCULE-7943248642 [0,1,0,0,0,1|2,0,0]=4 986 B13R1.133 O=C(O)C(O)CC1=CC=C(C=C1)Cl MCULE-5286691003 [0,1,0,0,0,1|2,0,0]=4 987 B13R1.133 O=C(O)C(O)CC1=CC=C(C=C1)F MCULE-6155847565 [0,1,0,0,0,1|2,0,0]=4 988 B13R1.133 O=C(O)C(O)CC1=CC=C(C=C1)O MCULE-3818086505 [0,1,0,0,0,1|2,0,0]=4 989 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)Br MCULE-5481131839 [0,1,0,0,0,1|2,0,0]=4 990 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)Cl MCULE-3794917513 [0,1,0,0,0,1|2,0,0]=4 991 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)Cl MCULE-8872282292 [0,1,0,0,0,1|2,0,0]=4 992 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)F MCULE-4209923445 [0,1,0,0,0,1|2,0,0]=4 993 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)I MCULE-3480936336 [0,1,0,0,0,1|2,0,0]=4 994 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)I MCULE-5777591096 [0,1,0,0,0,1|2,0,0]=4 995 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)O MCULE-6006549262 [0,1,0,0,0,1|2,0,0]=4 996 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)O MCULE-6391958547 [0,1,0,0,0,1|2,0,0]=4 997 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)Br MCULE-2757025614 [0,1,0,0,0,1|2,0,0]=4 998 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)Br MCULE-5816449429 [0,1,0,0,0,1|2,0,0]=4 999 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)Cl MCULE-2366295919 [0,1,0,0,0,1|2,0,0]=4 1000 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)Cl MCULE-3979202399 [0,1,0,0,0,1|2,0,0]=4 1001 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)F MCULE-2135193623 [0,1,0,0,0,1|2,0,0]=4 1002 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)F MCULE-4947433128 [0,1,0,0,0,1|2,0,0]=4 1003 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)O MCULE-3449547842 [0,1,0,0,0,1|2,0,0]=4 1004 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)O MCULE-5440585564 [0,1,0,0,0,1|2,0,0]=4 1005 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)C)C(=O)O MCULE-6439185943 [0,1,0,0,0,1|1,0,0]=3 1006 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)N)C(=O)O MCULE-5291387050 [0,1,0,0,0,1|1,0,0]=3 1007 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)N)C(=O)O MCULE-6099117172 [0,1,0,0,0,1|1,0,0]=3 1008 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)N)C(=O)O MCULE-7165201455 [0,1,0,0,0,1|1,0,0]=3 1009 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)O)C(=O)N MCULE-1861808000 [0,1,0,0,0,1|2,0,0]=4 1010 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)O)C(=O)N MCULE-5954878034 [0,1,0,0,0,1|2,0,0]=4 1011 B13R1.133 [C@H](O)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-1724377709 [0,1,0,0,0,1|2,0,0]=4 1012 B13R1.133 [NH3+]C(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-2011771181 [0,1,0,0,0,1|1,0,1]=4 1013 B13R1.135 CNC(=O)C(N)CC1=CC=CC=C1 MCULE-4070468166 [0,1,0,0,0,1|2,0,0]=4 1014 B13R1.135 CNC(=O)C(N)CC1=CC=CC=C1 MCULE-4208900885 [0,1,0,0,0,1|2,0,0]=4 1015 B13R1.135 CNC(=O)C(N)CC1=CC=CC=C1 MCULE-9291095634 [0,1,0,0,0,1|2,0,0]=4 1016 B13R1.135 CNC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-1773982239 [0,1,0,0,0,1|2,0,0]=4 1017 B13R1.135 CNC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-6534348496 [0,1,0,0,0,1|2,0,0]=4 1018 B13R1.135 CNC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-8400640986 [0,1,0,0,0,1|2,0,0]=4 1019 B13R1.135 CNC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-9994461517 [0,1,0,0,0,1|2,0,0]=4 1020 B13R1.135 CNC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-1222832030 [0,1,0,0,0,1|2,0,0]=4 1021 B13R1.135 CNC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-2609705403 [0,1,0,0,0,1|2,0,0]=4 1022 B13R1.135 CNC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-8230887511 [0,1,0,0,0,1|2,0,0]=4 1023 B13R1.135 CNC(=O)[C@H](N)CC1=NC=CC=C1 MCULE-7037745060 [0,1,0,0,0,1|2,0,0]=4 1024 B13R1.135 COC(=O)C(Br)CC1=CC=CC=C1 MCULE-1727282438 [0,1,0,0,0,1|2,0,0]=4 1025 B13R1.135 COC(=O)C(C)CC1=CC=CC=C1 MCULE-3514867680 [0,1,0,0,0,1|2,0,0]=4 1026 B13R1.135 COC(=O)C(Cl)CC1=CC=CC=C1 MCULE-7069297422 [0,1,0,0,0,1|2,0,0]=4 1027 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 MCULE-2582237555 [0,1,0,0,0,1|1,0,0]=3 1028 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 MCULE-3332878876 [0,1,0,0,0,1|1,0,0]=3 1029 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 MCULE-8835211261 [0,1,0,0,0,1|1,0,0]=3 1030 B13R1.135 COC(=O)C(N)CC1=CC=CN=C1 MCULE-7706046290 [0,1,0,0,0,1|1,0,0]=3 1031 B13R1.135 COC(=O)C(N)CC1=CC=NC=C1 MCULE-2976855251 [0,1,0,0,0,1|1,0,0]=3 1032 B13R1.135 COC(=O)C(N)CC1=CC=NC=C1 MCULE-5373720754 [0,1,0,0,0,1|1,0,0]=3 1033 B13R1.135 COC(=O)C(N)CC1=CN=CC=C1 MCULE-3627205617 [0,1,0,0,0,1|1,0,0]=3 1034 B13R1.135 COC(=O)C(N)CC1=CN=CC=C1 MCULE-7012025618 [0,1,0,0,0,1|1,0,0]=3 1035 B13R1.135 COC(=O)C(N)CC1=CN=CN=C1 MCULE-3079670999 [0,1,0,0,0,1|2,0,0]=4 1036 B13R1.135 COC(=O)C(N)CC1=CN=CN=C1 MCULE-9441093234 [0,1,0,0,0,1|2,0,0]=4 1037 B13R1.135 COC(=O)C(N)CC1=NC=CC=C1 MCULE-1266368138 [0,1,0,0,0,1|1,0,0]=3 1038 B13R1.135 COC(=O)C(N)CC1=NC=CC=C1 MCULE-2613909092 [0,1,0,0,0,1|1,0,0]=3 1039 B13R1.135 COC(=O)C(O)CC1=CC=CC=C1 MCULE-6031932659 [0,1,0,0,0,1|2,0,0]=4 1040 B13R1.135 COC(=O)C(O)CC1=CC=CC=C1 MCULE-9590442554 [0,1,0,0,0,1|2,0,0]=4 1041 B13R1.135 COC(=O)C([NH3+])CC1=CC=CC=C1 MCULE-1626074104 [0,1,0,0,0,1|1,0,1]=4 1042 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-4108104134 [0,1,0,0,0,1|1,0,0]=3 1043 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-5129708210 [0,1,0,0,0,1|1,0,0]=3 1044 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-5580078035 [0,1,0,0,0,1|1,0,0]=3 1045 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-8316158523 [0,1,0,0,0,1|1,0,0]=3 1046 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CN=C1 MCULE-6632328194 [0,1,0,0,0,1|1,0,0]=3 1047 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CN=C1 MCULE-9030456400 [0,1,0,0,0,1|1,0,0]=3 1048 B13R1.135 COC(=O)[C@@H](N)CC1=CN=CC=C1 MCULE-7900774985 [0,1,0,0,0,1|1,0,0]=3 1049 B13R1.135 COC(=O)[C@@H](N)CC1=CN=CN=C1 MCULE-5570117337 [0,1,0,0,0,1|2,0,0]=4 1050 B13R1.135 COC(=O)[C@@H](N)CC1=NC=CC=C1 MCULE-1066367695 [0,1,0,0,0,1|1,0,0]=3 1051 B13R1.135 COC(=O)[C@@H](N)CC1=NC=CC=N1 MCULE-5468945581 [0,1,0,0,0,1|1,0,0]=3 1052 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 MCULE-1258210976 [0,1,0,0,0,1|2,0,0]=4 1053 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 MCULE-5761303799 [0,1,0,0,0,1|2,0,0]=4 1054 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-1447476278 [0,1,0,0,0,1|1,0,0]=3 1055 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-2751110672 [0,1,0,0,0,1|1,0,0]=3 1056 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-3397498089 [0,1,0,0,0,1|1,0,0]=3 1057 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-7887773710 [0,1,0,0,0,1|1,0,0]=3 1058 B13R1.135 COC(=O)[C@H](N)CC1=CC=CN=C1 MCULE-7992953998 [0,1,0,0,0,1|1,0,0]=3 1059 B13R1.135 COC(=O)[C@H](N)CC1=CC=CN=C1 MCULE-9728277739 [0,1,0,0,0,1|1,0,0]=3 1060 B13R1.135 COC(=O)[C@H](N)CC1=CN=CC=C1 MCULE-8391597596 [0,1,0,0,0,1|1,0,0]=3 1061 B13R1.135 COC(=O)[C@H](N)CC1=CN=CC=C1 MCULE-8615923673 [0,1,0,0,0,1|1,0,0]=3 1062 B13R1.135 COC(=O)[C@H](N)CC1=CN=CN=C1 MCULE-3279694287 [0,1,0,0,0,1|2,0,0]=4 1063 B13R1.135 COC(=O)[C@H](N)CC1=NC=CC=C1 MCULE-1464248967 [0,1,0,0,0,1|1,0,0]=3 1064 B13R1.135 COC(=O)[C@H](N)CC1=NC=CC=C1 MCULE-5048055396 [0,1,0,0,0,1|1,0,0]=3 1065 B13R1.135 COC(=O)[C@H](N)CC1=NC=CC=N1 MCULE-4841067344 [0,1,0,0,0,1|1,0,0]=3 1066 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 MCULE-7480874576 [0,1,0,0,0,1|2,0,0]=4 1067 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 MCULE-8892812779 [0,1,0,0,0,1|2,0,0]=4 1068 B13R1.135 NC(CC1=CC=CC=C1)C(=O)CCl MCULE-3632493232 [0,1,0,0,0,1|2,0,0]=4 1069 B13R1.135 NC(CC1=CC=CC=C1)C(=O)CCl MCULE-9368328818 [0,1,0,0,0,1|2,0,0]=4 1070 B13R1.135 NNC(=O)C(N)CC1=CC=CC=C1 MCULE-2537370909 [0,1,0,0,0,1|2,0,0]=4 1071 B13R1.135 NNC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-1732509159 [0,1,0,0,0,1|2,0,0]=4 1072 B13R1.135 NNC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-2824459658 [0,1,0,0,0,1|2,0,0]=4 1073 B13R1.135 N[C@@H](CC1=CC=CC=C1)C(=O)CCl MCULE-4785157219 [0,1,0,0,0,1|2,0,0]=4 1074 B13R1.135 N[C@@H](CC1=CC=CC=C1)C(=O)CCl MCULE-5921852671 [0,1,0,0,0,1|2,0,0]=4 1075 B13R1.135 N[C@@H](CC1=CC=CC=C1)C(=O)CCl MCULE-7658780305 [0,1,0,0,0,1|2,0,0]=4 1076 B13R1.135 N[C@@H](CC1=CC=CC=C1)C(=O)CCl MCULE-9175221232 [0,1,0,0,0,1|2,0,0]=4 1077 B13R1.148 CC(CC1=CC(=CC=C1)Cl)C(=O)O MCULE-6477232957 [0,1,0,0,0,1|2,0,0]=4 1078 B13R1.148 CC(CC1=CC(=CC=C1)F)C(=O)O MCULE-2517739295 [0,1,0,0,0,1|2,0,0]=4 1079 B13R1.148 CC(CC1=CC=CC(=C1)Br)C(=O)O MCULE-5772259355 [0,1,0,0,0,1|2,0,0]=4 1080 B13R1.148 CC(CC1=CC=CC(=C1)I)C(=O)O MCULE-8176960531 [0,1,0,0,0,1|2,0,0]=4 1081 B13R1.148 CC1=CC(=CC=C1)CC(N)C(=O)O MCULE-1997175050 [0,1,0,0,0,1|1,0,0]=3 1082 B13R1.148 CC1=CC(=CC=C1)CC(N)C(=O)O MCULE-9587136551 [0,1,0,0,0,1|1,0,0]=3 1083 B13R1.148 CC1=CC(=CC=C1)C[C@@H](N)C(=O)O MCULE-8447730242 [0,1,0,0,0,1|1,0,0]=3 1084 B13R1.148 CC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-5228247053 [0,1,0,0,0,1|1,0,0]=3 1085 B13R1.148 CC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-8475369617 [0,1,0,0,0,1|1,0,0]=3 1086 B13R1.148 CC1=CC=CC(=C1)CC(C)C(=O)O MCULE-8982907611 [0,1,0,0,0,1|2,0,0]=4 1087 B13R1.148 CC1=CC=CC(=C1)CC(N)C(=O)O MCULE-1770281237 [0,1,0,0,0,1|1,0,0]=3 1088 B13R1.148 CC1=CC=CC(=C1)C[C@@H](N)C(=O)O MCULE-8538987390 [0,1,0,0,0,1|1,0,0]=3 1089 B13R1.148 NC(=O)C(N)CC1=CC(=CC=C1)Br MCULE-3460219781 [0,1,0,0,0,1|2,0,0]=4 1090 B13R1.148 NC(CC1=CC(=CC=C1)Br)C(=O)O MCULE-2348274001 [0,1,0,0,0,1|1,0,0]=3 1091 B13R1.148 NC(CC1=CC(=CC=C1)Br)C(=O)O MCULE-6147884206 [0,1,0,0,0,1|1,0,0]=3 1092 B13R1.148 NC(CC1=CC(=CC=C1)Cl)C(=O)O MCULE-1289187602 [0,1,0,0,0,1|1,0,0]=3 1093 B13R1.148 NC(CC1=CC(=CC=C1)Cl)C(=O)O MCULE-8409034063 [0,1,0,0,0,1|1,0,0]=3 1094 B13R1.148 NC(CC1=CC(=CC=C1)F)C(=O)O MCULE-3048081903 [0,1,0,0,0,1|1,0,0]=3 1095 B13R1.148 NC(CC1=CC(=CC=C1)I)C(=O)O MCULE-4400986534 [0,1,0,0,0,1|1,0,0]=3 1096 B13R1.148 NC(CC1=CC(=CC=C1)O)C(=O)O MCULE-1682126004 [0,1,0,0,0,1|1,0,0]=3 1097 B13R1.148 NC(CC1=CC(=CC=C1)O)C(=O)O MCULE-1870924489 [0,1,0,0,0,1|1,0,0]=3 1098 B13R1.148 NC(CC1=CC=CC(=C1)Br)C(=O)O MCULE-8007269772 [0,1,0,0,0,1|1,0,0]=3 1099 B13R1.148 NC(CC1=CC=CC(=C1)Cl)C(=O)O MCULE-1743986990 [0,1,0,0,0,1|1,0,0]=3 1100 B13R1.148 NC(CC1=CC=CC(=C1)Cl)C(=O)O MCULE-6477168764 [0,1,0,0,0,1|1,0,0]=3 1101 B13R1.148 NC(CC1=CC=CC(=C1)F)C(=O)O MCULE-1037840303 [0,1,0,0,0,1|1,0,0]=3 1102 B13R1.148 NC(CC1=CC=CC(=C1)F)C(=O)O MCULE-1978574097 [0,1,0,0,0,1|1,0,0]=3 1103 B13R1.148 NC(CC1=CC=CC(=C1)O)C(=O)O MCULE-7197195437 [0,1,0,0,0,1|1,0,0]=3 1104 B13R1.148 NC1=CC(=CC=C1)CC(N)C(=O)O MCULE-2467932131 [0,1,0,0,0,1|1,0,0]=3 1105 B13R1.148 NC1=CC(=CC=C1)CC(N)C(=O)O MCULE-5537013080 [0,1,0,0,0,1|1,0,0]=3 1106 B13R1.148 NC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-2052828414 [0,1,0,0,0,1|1,0,0]=3 1107 B13R1.148 NC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-2924867217 [0,1,0,0,0,1|1,0,0]=3 1108 B13R1.148 NC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-5878731697 [0,1,0,0,0,1|1,0,0]=3 1109 B13R1.148 NC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-8248386535 [0,1,0,0,0,1|1,0,0]=3 1110 B13R1.148 NC1=CC=CC(=C1)CC(N)C(=O)O MCULE-6788793962 [0,1,0,0,0,1|1,0,0]=3 1111 B13R1.148 NC1=CC=CC(=C1)CC(N)C(=O)O MCULE-7989672916 [0,1,0,0,0,1|1,0,0]=3 1112 B13R1.148 N[C@@H](CC1=CC(=CC=C1)Br)C(=O)O MCULE-3495438482 [0,1,0,0,0,1|1,0,0]=3 1113 B13R1.148 N[C@@H](CC1=CC(=CC=C1)Cl)C(=O)O MCULE-9561585574 [0,1,0,0,0,1|1,0,0]=3 1114 B13R1.148 N[C@@H](CC1=CC(=CC=C1)O)C(=O)O MCULE-2356956274 [0,1,0,0,0,1|1,0,0]=3 1115 B13R1.148 N[C@@H](CC1=CC(=CN=C1)F)C(=O)O MCULE-1217529300 [0,1,0,0,0,1|1,0,0]=3 1116 B13R1.148 N[C@@H](CC1=CC(=CN=C1)F)C(=O)O MCULE-6320059944 [0,1,0,0,0,1|1,0,0]=3 1117 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-1686064373 [0,1,0,0,0,1|1,0,0]=3 1118 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-4183003026 [0,1,0,0,0,1|1,0,0]=3 1119 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-5029761730 [0,1,0,0,0,1|1,0,0]=3 1120 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-6284927524 [0,1,0,0,0,1|1,0,0]=3 1121 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-9100547203 [0,1,0,0,0,1|1,0,0]=3 1122 B13R1.148 N[C@@H](CC1=CC=CC(=C1)F)C(=O)O MCULE-7481903657 [0,1,0,0,0,1|1,0,0]=3 1123 B13R1.148 N[C@@H](CC1=CC=CC(=C1)F)C(=O)O MCULE-8671021032 [0,1,0,0,0,1|1,0,0]=3 1124 B13R1.148 N[C@@H](CC1=CC=CC(=C1)I)C(=O)O MCULE-6787387564 [0,1,0,0,0,1|1,0,0]=3 1125 B13R1.148 N[C@@H](CC1=CC=CC(=C1)I)C(=O)O MCULE-8633614286 [0,1,0,0,0,1|1,0,0]=3 1126 B13R1.148 N[C@@H](CC1=CC=CC(=C1)O)C(=O)O MCULE-2174973339 [0,1,0,0,0,1|1,0,0]=3 1127 B13R1.148 N[C@@H](CC1=CC=CC(=C1)O)C(=O)O MCULE-6923480945 [0,1,0,0,0,1|1,0,0]=3 1128 B13R1.148 N[C@@H](CC1=CC=CC(=C1)O)C(=O)O MCULE-8483193639 [0,1,0,0,0,1|1,0,0]=3 1129 B13R1.148 N[C@H](CC1=CC(=CC=C1)O)C(=O)O MCULE-4455335179 [0,1,0,0,0,1|1,0,0]=3 1130 B13R1.148 N[C@H](CC1=CC(=CC=C1)O)C(=O)O MCULE-6512619298 [0,1,0,0,0,1|1,0,0]=3 1131 B13R1.148 N[C@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-6055691240 [0,1,0,0,0,1|1,0,0]=3 1132 B13R1.148 N[C@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-8797288798 [0,1,0,0,0,1|1,0,0]=3 1133 B13R1.148 N[C@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-5153208600 [0,1,0,0,0,1|1,0,0]=3 1134 B13R1.148 N[C@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-7991505295 [0,1,0,0,0,1|1,0,0]=3 1135 B13R1.148 N[C@H](CC1=CC=CC(=C1)F)C(=O)O MCULE-2189181945 [0,1,0,0,0,1|1,0,0]=3 1136 B13R1.148 N[C@H](CC1=CC=CC(=C1)F)C(=O)O MCULE-5152700511 [0,1,0,0,0,1|1,0,0]=3 1137 B13R1.148 N[C@H](CC1=CC=CC(=C1)I)C(=O)O MCULE-1640787822 [0,1,0,0,0,1|1,0,0]=3 1138 B13R1.148 N[C@H](CC1=CC=CC(=C1)I)C(=O)O MCULE-7721290088 [0,1,0,0,0,1|1,0,0]=3 1139 B13R1.148 O=C(O)C(O)CC1=CC(=CC=C1)Br MCULE-3046403950 [0,1,0,0,0,1|2,0,0]=4 1140 B13R1.148 O=C(O)C(O)CC1=CC(=CC=C1)Cl MCULE-9442017506 [0,1,0,0,0,1|2,0,0]=4 1141 B13R1.148 O=C(O)C(O)CC1=CC(=CC=C1)F MCULE-2359914332 [0,1,0,0,0,1|2,0,0]=4 1142 B13R1.148 O=C(O)C(O)CC1=CC(=CC=C1)O MCULE-6217953446 [0,1,0,0,0,1|2,0,0]=4 1143 B13R1.148 O=C(O)[C@@H](O)CC1=CC=CC(=C1)F MCULE-4562223673 [0,1,0,0,0,1|2,0,0]=4 1144 B13R1.148 O=C(O)[C@@H](O)CC1=CC=CC(=C1)F MCULE-7772826280 [0,1,0,0,0,1|2,0,0]=4 1145 B13R1.148 O=C(O)[C@H](O)CC1=CC=CC(=C1)Br MCULE-5782934287 [0,1,0,0,0,1|2,0,0]=4 1146 B13R1.152 CC(C(=O)O)C(N)C1=CC=CC=C1 MCULE-4471810169 [0,1,0,0,0,1|2,0,0]=4 1147 B13R1.152 CC(C(=O)O)C(N)C1=CC=CC=C1 MCULE-9697052753 [0,1,0,0,0,1|2,0,0]=4 1148 B13R1.152 CC(C1=CC=CC=C1)C(N)C(=O)N MCULE-2624287617 [0,1,0,0,0,1|2,0,0]=4 1149 B13R1.152 CC(C1=CC=CC=C1)C(N)C(=O)N MCULE-9151101030 [0,1,0,0,0,1|2,0,0]=4 1150 B13R1.152 CC(C1=CC=CC=C1)C(N)C(=O)O MCULE-8491955673 [0,1,0,0,0,1|1,0,0]=3 1151 B13R1.152 CC(C1=CC=CC=C1)C(N)C(=O)O MCULE-9701727761 [0,1,0,0,0,1|1,0,0]=3 1152 B13R1.152 CC(C1=CC=CC=C1)C(O)C(=O)O MCULE-2096048463 [0,1,0,0,0,1|2,0,0]=4 1153 B13R1.152 CC(C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-5202341879 [0,1,0,0,0,1|1,0,0]=3 1154 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@@H](N)C(=O)O MCULE-3296564620 [0,1,0,0,0,1|1,0,0]=3 1155 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@@H](N)C(=O)O MCULE-5770222064 [0,1,0,0,0,1|1,0,0]=3 1156 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-8614292304 [0,1,0,0,0,1|1,0,0]=3 1157 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-8697326618 [0,1,0,0,0,1|1,0,0]=3 1158 B13R1.152 C[C@H](C(=O)O)[C@H](O)C1=CC=CC=C1 MCULE-5479131562 [0,1,0,0,0,1|2,0,0]=4 1159 B13R1.152 C[C@H](C1=CC=CC=C1)[C@@H](N)C(=O)O MCULE-8687654257 [0,1,0,0,0,1|1,0,0]=3 1160 B13R1.152 C[C@H](C1=CC=CC=C1)[C@@H](N)C(=O)O MCULE-9499293392 [0,1,0,0,0,1|1,0,0]=3 1161 B13R1.152 C[C@H](C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-1845048066 [0,1,0,0,0,1|1,0,0]=3 1162 B13R1.152 C[C@H](C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-9752844525 [0,1,0,0,0,1|1,0,0]=3 1163 B13R1.152 NC(C(=O)O)C(Cl)C1=CC=CC=C1 MCULE-2618772778 [0,1,0,0,0,1|1,0,0]=3 1164 B13R1.152 NC(C(=O)O)C(O)C1=CC=CC=C1 MCULE-3348967519 [0,1,0,0,0,1|1,0,0]=3 1165 B13R1.152 NC(C(=O)O)C(O)C1=CC=CC=C1 MCULE-4051921601 [0,1,0,0,0,1|1,0,0]=3 1166 B13R1.152 NC(C(=O)O)C(O)C1=CN=CC=C1 MCULE-5411267363 [0,1,0,0,0,1|1,0,0]=3 1167 B13R1.152 NC(C1=CC=CC=C1)C(O)C(=O)O MCULE-2719281342 [0,1,0,0,0,1|2,0,0]=4 1168 B13R1.152 NC(C1=CC=CC=C1)C(O)C(=O)O MCULE-5123619879 [0,1,0,0,0,1|2,0,0]=4 1169 B13R1.152 NC(C1=CC=CN=C1)C(O)C(=O)O MCULE-1719112007 [0,1,0,0,0,1|2,0,0]=4 1170 B13R1.152 N[C@@H](C(=O)O)[C@@H](O)C1=CC=CC=C1 MCULE-6532492719 [0,1,0,0,0,1|1,0,0]=3 1171 B13R1.152 N[C@@H](C(=O)O)[C@H](O)C1=CC=CC=C1 MCULE-7686375522 [0,1,0,0,0,1|1,0,0]=3 1172 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-2183846050 [0,1,0,0,0,1|2,0,0]=4 1173 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-3688029768 [0,1,0,0,0,1|2,0,0]=4 1174 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-3819078710 [0,1,0,0,0,1|2,0,0]=4 1175 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-5219240474 [0,1,0,0,0,1|2,0,0]=4 1176 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-6868554139 [0,1,0,0,0,1|2,0,0]=4 1177 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-7992078018 [0,1,0,0,0,1|2,0,0]=4 1178 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@H](O)C(=O)O MCULE-9060327137 [0,1,0,0,0,1|2,0,0]=4 1179 B13R1.152 N[C@H](C(=O)O)[C@@H](O)C1=CC=CC=C1 MCULE-3533562532 [0,1,0,0,0,1|1,0,0]=3 1180 B13R1.152 N[C@H](C(=O)O)[C@H](O)C1=CC=CC=C1 MCULE-7276106585 [0,1,0,0,0,1|1,0,0]=3 1181 B13R1.152 N[C@H](C(=O)O)[C@H](O)C1=CC=CC=C1 MCULE-7798579567 [0,1,0,0,0,1|1,0,0]=3 1182 B13R1.152 N[C@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-3650949263 [0,1,0,0,0,1|2,0,0]=4 1183 B13R1.152 N[C@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-8610185053 [0,1,0,0,0,1|2,0,0]=4 1184 B13R1.152 N[C@H](C1=CC=CC=C1)[C@H](O)C(=O)O MCULE-5142392737 [0,1,0,0,0,1|2,0,0]=4 1185 B13R1.152 O=C(O)C(Br)C(Br)C1=CC=CC=C1 MCULE-2104980401 [0,1,0,0,0,1|2,0,0]=4 1186 B13R1.152 O=C(O)C(O)C(O)C1=CC=CC=C1 MCULE-7246952508 [0,1,0,0,0,1|2,0,0]=4 1187 B13R1.152 [C@@H](N)(C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-4071607168 [0,1,0,0,0,1|2,0,0]=4 1188 B13R1.202 CC(CC1=C(C=CC=C1)Br)C(=O)O MCULE-5369615416 [0,1,0,0,0,1|2,0,0]=4 1189 B13R1.202 CC(CC1=C(C=CC=C1)Cl)C(=O)O MCULE-1157893995 [0,1,0,0,0,1|2,0,0]=4 1190 B13R1.202 CC(CC1=C(C=CC=C1)F)C(=O)O MCULE-3357333139 [0,1,0,0,0,1|2,0,0]=4 1191 B13R1.202 CC1=C(C=CC=C1)CC(C)C(=O)O MCULE-2487760745 [0,1,0,0,0,1|2,0,0]=4 1192 B13R1.202 CC1=C(C=CC=C1)CC(N)C(=O)O MCULE-3928457353 [0,1,0,0,0,1|1,0,0]=3 1193 B13R1.202 CC1=C(C=CC=C1)CC(N)C(=O)O MCULE-4728915963 [0,1,0,0,0,1|1,0,0]=3 1194 B13R1.202 CC1=C(C=CC=C1)CC(N)C(=O)O MCULE-9582945892 [0,1,0,0,0,1|1,0,0]=3 1195 B13R1.202 CC1=C(C=CC=C1)C[C@@H](N)C(=O)O MCULE-7777290104 [0,1,0,0,0,1|1,0,0]=3 1196 B13R1.202 CC1=C(C=CC=N1)CC(C)C(=O)O MCULE-6308639265 [0,1,0,0,0,1|2,0,0]=4 1197 B13R1.202 CC1=C(C=CC=N1)C[C@H](N)C(=O)O MCULE-2857482966 [0,1,0,0,0,1|1,0,0]=3 1198 B13R1.202 CC1=CC=CC=C1C[C@@H](N)C(=O)O MCULE-3139735845 [0,1,0,0,0,1|1,0,0]=3 1199 B13R1.202 CC1=CC=CC=C1C[C@H](N)C(=O)O MCULE-4423394672 [0,1,0,0,0,1|1,0,0]=3 1200 B13R1.202 CC1=CC=CC=C1C[C@H](N)C(=O)O MCULE-8459527082 [0,1,0,0,0,1|1,0,0]=3 1201 B13R1.202 CC1=NC=CC=C1C[C@H](N)C(=O)O MCULE-1450162280 [0,1,0,0,0,1|1,0,0]=3 1202 B13R1.202 CC1=NC=CC=C1C[C@H](N)C(=O)O MCULE-2509567482 [0,1,0,0,0,1|1,0,0]=3 1203 B13R1.202 CC1=NC=CC=C1C[C@H](N)C(=O)O MCULE-3945955464 [0,1,0,0,0,1|1,0,0]=3 1204 B13R1.202 NC(CC1=C(C=CC=C1)Br)C(=O)O MCULE-5724659686 [0,1,0,0,0,1|1,0,0]=3 1205 B13R1.202 NC(CC1=C(C=CC=C1)Br)C(=O)O MCULE-8657034756 [0,1,0,0,0,1|1,0,0]=3 1206 B13R1.202 NC(CC1=C(C=CC=C1)Cl)C(=O)O MCULE-1003643925 [0,1,0,0,0,1|1,0,0]=3 1207 B13R1.202 NC(CC1=C(C=CC=C1)Cl)C(=O)O MCULE-5234125993 [0,1,0,0,0,1|1,0,0]=3 1208 B13R1.202 NC(CC1=C(C=CC=C1)F)C(=O)O MCULE-1643139482 [0,1,0,0,0,1|1,0,0]=3 1209 B13R1.202 NC(CC1=C(C=CC=C1)F)C(=O)O MCULE-8132487617 [0,1,0,0,0,1|1,0,0]=3 1210 B13R1.202 NC(CC1=C(C=CC=C1)O)C(=O)O MCULE-2760582536 [0,1,0,0,0,1|1,0,0]=3 1211 B13R1.202 NC(CC1=C(C=CC=C1)O)C(=O)O MCULE-3181624921 [0,1,0,0,0,1|1,0,0]=3 1212 B13R1.202 NC(CC1=CC=CC=C1Br)C(=O)O MCULE-4720569207 [0,1,0,0,0,1|1,0,0]=3 1213 B13R1.202 NC(CC1=CC=CC=C1I)C(=O)O MCULE-5831466387 [0,1,0,0,0,1|1,0,0]=3 1214 B13R1.202 NC(CC1=CC=CC=C1O)C(=O)O MCULE-3693150441 [0,1,0,0,0,1|1,0,0]=3 1215 B13R1.202 NC(CC1=CC=CC=C1O)C(=O)O MCULE-8522650891 [0,1,0,0,0,1|1,0,0]=3 1216 B13R1.202 NC1=CC=CC=C1CC(N)C(=O)O MCULE-7465695275 [0,1,0,0,0,1|1,0,0]=3 1217 B13R1.202 NC1=CC=CC=C1C[C@@H](N)C(=O)O MCULE-6308202600 [0,1,0,0,0,1|1,0,0]=3 1218 B13R1.202 NC1=CC=CC=C1C[C@H](N)C(=O)O MCULE-2066886177 [0,1,0,0,0,1|1,0,0]=3 1219 B13R1.202 N[C@@H](CC1=C(C=CC=C1)F)C(=O)O MCULE-5925880420 [0,1,0,0,0,1|1,0,0]=3 1220 B13R1.202 N[C@@H](CC1=C(C=CC=C1)I)C(=O)O MCULE-5539213577 [0,1,0,0,0,1|1,0,0]=3 1221 B13R1.202 N[C@@H](CC1=CC=CC=C1Br)C(=O)O MCULE-7720110968 [0,1,0,0,0,1|1,0,0]=3 1222 B13R1.202 N[C@@H](CC1=CC=CC=C1Br)C(=O)O MCULE-8611213892 [0,1,0,0,0,1|1,0,0]=3 1223 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-4843973004 [0,1,0,0,0,1|1,0,0]=3 1224 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-6583454610 [0,1,0,0,0,1|1,0,0]=3 1225 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-8729370801 [0,1,0,0,0,1|1,0,0]=3 1226 B13R1.202 N[C@@H](CC1=CC=CC=C1F)C(=O)O MCULE-1023509436 [0,1,0,0,0,1|1,0,0]=3 1227 B13R1.202 N[C@@H](CC1=CC=CC=C1I)C(=O)O MCULE-1271250491 [0,1,0,0,0,1|1,0,0]=3 1228 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-3324530063 [0,1,0,0,0,1|1,0,0]=3 1229 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-4252485679 [0,1,0,0,0,1|1,0,0]=3 1230 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-8738209502 [0,1,0,0,0,1|1,0,0]=3 1231 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-9497377193 [0,1,0,0,0,1|1,0,0]=3 1232 B13R1.202 N[C@@H](CC1=NC=CC=C1Cl)C(=O)O MCULE-2291118366 [0,1,0,0,0,1|1,0,0]=3 1233 B13R1.202 N[C@H](CC1=C(C=CC=C1)F)C(=O)O MCULE-2582515595 [0,1,0,0,0,1|1,0,0]=3 1234 B13R1.202 N[C@H](CC1=CC=CC=C1Br)C(=O)O MCULE-1182640112 [0,1,0,0,0,1|1,0,0]=3 1235 B13R1.202 N[C@H](CC1=CC=CC=C1Br)C(=O)O MCULE-7433575732 [0,1,0,0,0,1|1,0,0]=3 1236 B13R1.202 N[C@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-2211654501 [0,1,0,0,0,1|1,0,0]=3 1237 B13R1.202 N[C@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-7072462727 [0,1,0,0,0,1|1,0,0]=3 1238 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O MCULE-2083626274 [0,1,0,0,0,1|1,0,0]=3 1239 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O MCULE-3474904707 [0,1,0,0,0,1|1,0,0]=3 1240 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O MCULE-4069544287 [0,1,0,0,0,1|1,0,0]=3 1241 B13R1.202 N[C@H](CC1=CC=CC=C1I)C(=O)O MCULE-1367493363 [0,1,0,0,0,1|1,0,0]=3 1242 B13R1.202 N[C@H](CC1=CC=CC=C1I)C(=O)O MCULE-5236102575 [0,1,0,0,0,1|1,0,0]=3 1243 B13R1.202 N[C@H](CC1=CC=CC=C1O)C(=O)O MCULE-2348504704 [0,1,0,0,0,1|1,0,0]=3 1244 B13R1.202 N[C@H](CC1=CC=CC=C1O)C(=O)O MCULE-8147742693 [0,1,0,0,0,1|1,0,0]=3 1245 B13R1.202 N[C@H](CC1=NC=CC=C1Br)C(=O)O MCULE-3372881597 [0,1,0,0,0,1|1,0,0]=3 1246 B13R1.202 N[C@H](CC1=NC=CC=C1F)C(=O)O MCULE-2506093240 [0,1,0,0,0,1|1,0,0]=3 1247 B13R1.202 O=C(O)C(Br)CC1=C(C=CC=C1)Br MCULE-5032087774 [0,1,0,0,0,1|2,0,0]=4 1248 B13R1.202 O=C(O)C(Br)CC1=CC=CC=C1Cl MCULE-4038063637 [0,1,0,0,0,1|2,0,0]=4 1249 B13R1.202 O=C(O)C(Br)CC1=CC=CC=C1F MCULE-3940590279 [0,1,0,0,0,1|2,0,0]=4 1250 B13R1.202 O=C(O)C(O)CC1=C(C=CC=C1)Br MCULE-1533586444 [0,1,0,0,0,1|2,0,0]=4 1251 B13R1.202 O=C(O)C(O)CC1=C(C=CC=C1)Cl MCULE-2811622154 [0,1,0,0,0,1|2,0,0]=4 1252 B13R1.418 CCC(CC1=CC=CC=C1)C(=O)O MCULE-7383023006 [0,1,0,0,0,1|2,0,0]=4 1253 B13R1.418 CCC(CC1=CN=CC=C1)C(=O)O MCULE-2499732491 [0,1,0,0,0,1|2,0,0]=4 1254 B13R1.418 CNC(CC1=CC=CC=C1)C(=O)O MCULE-3842005714 [0,1,0,0,0,1|1,0,0]=3 1255 B13R1.418 CNC(CC1=CC=CC=C1)C(=O)O MCULE-7025734622 [0,1,0,0,0,1|1,0,0]=3 1256 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-5892127646 [0,1,0,0,0,1|1,0,0]=3 1257 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6660510193 [0,1,0,0,0,1|1,0,0]=3 1258 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-7617883459 [0,1,0,0,0,1|1,0,0]=3 1259 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9210211125 [0,1,0,0,0,1|1,0,0]=3 1260 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2038566174 [0,1,0,0,0,1|1,0,0]=3 1261 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-8805615196 [0,1,0,0,0,1|1,0,0]=3 1262 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-9690973894 [0,1,0,0,0,1|1,0,0]=3 1263 B13R1.418 COC(CC1=CC=CC=C1)C(=O)O MCULE-9999723715 [0,1,0,0,0,1|2,0,0]=4 1264 B13R1.418 CO[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9906113693 [0,1,0,0,0,1|2,0,0]=4 1265 B13R1.418 N#CC(CC1=CC=CC=C1)C(=O)O MCULE-2489113249 [0,1,0,0,0,1|1,0,1]=4 1266 B13R1.418 N#CC(CC1=CC=CC=N1)C(=O)O MCULE-5618647127 [0,1,0,0,0,1|1,0,1]=4 1267 B13R1.418 N#CC(CC1=CC=CN=C1)C(=O)O MCULE-6461806417 [0,1,0,0,0,1|1,0,1]=4 1268 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-3435928554 [0,1,0,0,0,1|1,0,0]=3 1269 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-4710137264 [0,1,0,0,0,1|1,0,0]=3 1270 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-5594566401 [0,1,0,0,0,1|1,0,0]=3 1271 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-7040954795 [0,1,0,0,0,1|1,0,0]=3 1272 B13R1.418 NCC(CC1=CN=CC=C1)C(=O)O MCULE-4896890670 [0,1,0,0,0,1|1,0,0]=3 1273 B13R1.418 NCC(CC1=CN=CC=C1)C(=O)O MCULE-7456176624 [0,1,0,0,0,1|1,0,0]=3 1274 B13R1.418 NCC(CC1=NC=CC=C1)C(=O)O MCULE-1712969305 [0,1,0,0,0,1|1,0,0]=3 1275 B13R1.418 NCC(CC1=NC=CC=C1)C(=O)O MCULE-4796581653 [0,1,0,0,0,1|1,0,0]=3 1276 B13R1.418 NCC(OC1=CC=CC=C1)C(=O)O MCULE-4491410346 [0,1,0,0,0,1|2,0,0]=4 1277 B13R1.418 NCC(OC1=CC=CC=C1)C(=O)O MCULE-6780268530 [0,1,0,0,0,1|2,0,0]=4 1278 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-4543639508 [0,1,0,0,0,1|1,0,0]=3 1279 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6429844971 [0,1,0,0,0,1|1,0,0]=3 1280 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-7718503080 [0,1,0,0,0,1|1,0,0]=3 1281 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9663366424 [0,1,0,0,0,1|1,0,0]=3 1282 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-3343846707 [0,1,0,0,0,1|1,0,0]=3 1283 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-4830325742 [0,1,0,0,0,1|1,0,0]=3 1284 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-6363695814 [0,1,0,0,0,1|1,0,0]=3 1285 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-8977991880 [0,1,0,0,0,1|1,0,0]=3 1286 B13R1.418 NOC(CC1=CC=CC=C1)C(=O)O MCULE-2996535605 [0,1,0,0,0,1|1,0,0]=3 1287 B13R1.418 NOC(CC1=CC=CC=C1)C(=O)O MCULE-3251573694 [0,1,0,0,0,1|1,0,0]=3 1288 B13R1.418 NOC(CC1=CC=CC=C1)C(=O)O MCULE-5462822882 [0,1,0,0,0,1|1,0,0]=3 1289 B13R1.418 NO[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-2535668835 [0,1,0,0,0,1|1,0,0]=3 1290 B13R1.418 NO[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6514153575 [0,1,0,0,0,1|1,0,0]=3 1291 B13R1.418 O=C(O)C(CO)CC1=CC=CC=C1 MCULE-8227526589 [0,1,0,0,0,1|2,0,0]=4 1292 B13R1.418 O=C(O)[C@@H](CO)CC1=CC=CC=C1 MCULE-6466727593 [0,1,0,0,0,1|2,0,0]=4 1293 B13R1.418 O=C(O)[C@@H](CO)CC1=CC=CC=C1 MCULE-9405740406 [0,1,0,0,0,1|2,0,0]=4 1294 B13R1.418 O=C(O)[C@H](CO)CC1=CC=CC=C1 MCULE-2746275491 [0,1,0,0,0,1|2,0,0]=4 1295 B13R1.1073 CC(=O)C(C)(N)CC1=CC=CC=C1 MCULE-1149531273 [0,1,0,0,0,1|2,0,0]=4 1296 B13R1.1073 CC(=O)C(C)(N)CC1=CC=CC=C1 MCULE-5783774426 [0,1,0,0,0,1|2,0,0]=4 1297 B13R1.1073 CC(C)(CC1=CC=CC=C1)C(=O)O MCULE-3089413335 [0,1,0,0,0,1|2,0,0]=4 1298 B13R1.1073 CC(C)(CC1=CC=CC=N1)C(=O)O MCULE-8613960483 [0,1,0,0,0,1|2,0,0]=4 1299 B13R1.1073 CC(C)(CC1=CC=CN=C1)C(=O)O MCULE-1786635477 [0,1,0,0,0,1|2,0,0]=4 1300 B13R1.1073 CC(C)(CC1=CC=NC=C1)C(=O)O MCULE-2392185420 [0,1,0,0,0,1|2,0,0]=4 1301 B13R1.1073 CC(C)(CC1=CC=NC=C1)C(=O)O MCULE-7606943048 [0,1,0,0,0,1|2,0,0]=4 1302 B13R1.1073 CC(N)(CC1=CC=CC=C1)C(=O)N MCULE-3712903728 [0,1,0,0,0,1|2,0,0]=4 1303 B13R1.1073 CC(N)(CC1=CC=CC=C1)C(=O)O MCULE-3264509800 [0,1,0,0,0,1|1,0,0]=3 1304 B13R1.1073 CC(N)(CC1=CC=CC=C1)C(=O)O MCULE-8062918187 [0,1,0,0,0,1|1,0,0]=3 1305 B13R1.1073 CC(O)(CC1=CC=CC=C1)C(=O)O MCULE-6210049820 [0,1,0,0,0,1|2,0,0]=4 1306 B13R1.1073 C[C@@](N)(CC1=CC=CC=C1)C(=O)O MCULE-6080134898 [0,1,0,0,0,1|1,0,0]=3 1307 B13R1.1073 C[C@@](N)(CC1=CC=CC=C1)C(=O)O MCULE-8126155759 [0,1,0,0,0,1|1,0,0]=3 1308 B13R1.1073 C[C@](N)(CC1=CC=CC=C1)C(=O)O MCULE-1833368325 [0,1,0,0,0,1|1,0,0]=3 1309 B13R1.1073 C[C@](N)(CC1=CC=CC=C1)C(=O)O MCULE-7774485933 [0,1,0,0,0,1|1,0,0]=3 1310 B13R1.1073 NC(O)(CC1=CC=CC=C1)C(=O)O MCULE-3023341284 [0,1,0,0,0,1|1,0,0]=3 1311 B13R1.1073 O=C(O)C(F)(F)CC1=CC=CC=C1 MCULE-9117160881 [0,1,0,0,0,1|2,0,0]=4 1312 B13R1.282 CC1=C(SC=C1)CN(C)CC(=O)O MCULE-8288159934 [0,1,0,0,0,1|2,0,0]=4 1313 B13R1.340 O=C(O)CC(Br)C(=O)C1=CC=CS1 MCULE-8075496553 [0,1,0,0,0,1|1,0,1]=4 1314 B13R1.545 COC(=O)C[C@H](C)SC1=CC=CS1 MCULE-1982373251 [0,1,0,0,0,1|2,0,0]=4 1315 B13R1.2007 O=C(O)CS(=O)(=O)CC1=CC=CS1 MCULE-4674642433 [0,1,0,0,0,1|2,0,0]=4 1316 B13R1.339 CC(NC(=O)C1=CC=CS1)C(=O)O MCULE-7096705343 [0,1,0,0,0,1|1,0,1]=4 1317 B13R1.339 NC(CC(=O)C1=CC=CS1)C(=O)O MCULE-3001867467 [0,1,0,0,0,1|0,0,0]=2 1318 B13R1.339 O=C(O)C(=O)CC(=O)C1=CC=CS1 MCULE-5797623406 [0,1,0,0,0,1|1,0,1]=4 1319 B13R1.134 COC(=O)C(N)CC1=CN(C=N1)C MCULE-1161726679 [0,2,0,0,0,0|2,0,0]=4 1320 B13R1.134 COC(=O)C(N)CC1=CN(C=N1)C MCULE-8450355930 [0,2,0,0,0,0|2,0,0]=4 1321 B13R1.134 COC(=O)C(N)CN1C=C(C=N1)Br MCULE-9663514139 [0,2,0,0,0,0|2,0,0]=4 1322 B13R1.134 COC(=O)C(N)CN1C=C(C=N1)C MCULE-3097950183 [0,2,0,0,0,0|2,0,0]=4 1323 B13R1.134 COC(=O)C(N)CN1C=C(C=N1)C MCULE-7192930311 [0,2,0,0,0,0|2,0,0]=4 1324 B13R1.134 COC(=O)[C@@H](N)CC1=CC=C(S1)C MCULE-6848336004 [0,2,0,0,0,0|0,0,0]=2 1325 B13R1.134 COC(=O)[C@@H](N)CC1=CC=C(S1)Cl MCULE-8685697536 [0,2,0,0,0,0|0,0,0]=2 1326 B13R1.134 COC(=O)[C@@H](N)CC1=CN(C=N1)C MCULE-1729680041 [0,2,0,0,0,0|2,0,0]=4 1327 B13R1.134 COC(=O)[C@@H](N)CC1=CN(C=N1)C MCULE-2938188839 [0,2,0,0,0,0|2,0,0]=4 1328 B13R1.134 COC(=O)[C@@H](N)CC1=CN(C=N1)C MCULE-3472013655 [0,2,0,0,0,0|2,0,0]=4 1329 B13R1.134 COC(=O)[C@@H](N)CC1=CN(C=N1)C MCULE-8175161010 [0,2,0,0,0,0|2,0,0]=4 1330 B13R1.134 COC(=O)[C@H](N)CC1=CC=C(S1)C MCULE-5990308296 [0,2,0,0,0,0|0,0,0]=2 1331 B13R1.134 COC(=O)[C@H](N)CC1=CC=C(S1)Cl MCULE-7062678935 [0,2,0,0,0,0|0,0,0]=2 1332 B13R1.410 CC1=CC=C(S1)CC(C#N)C(=O)O MCULE-3518889242 [0,2,0,0,0,0|0,0,1]=3 1333 B13R1.410 CCC(CC1=CC=C(O1)C)C(=O)O MCULE-6528111255 [0,2,0,0,0,0|1,1,0]=4 1334 B13R1.410 CCC(CC1=CC=C(S1)C)C(=O)O MCULE-7029975472 [0,2,0,0,0,0|1,0,0]=3 1335 B13R1.410 CNC(CN1C=C(C=N1)Br)C(=O)O MCULE-1219157826 [0,2,0,0,0,0|2,0,0]=4 1336 B13R1.3429 CC(N)(CC1=CC=C(S1)Br)C(=O)O MCULE-6460783832 [0,2,0,0,0,0|0,0,0]=2 1337 B13R1.3429 CC(N)(CN1C=C(C=N1)Br)C(=O)O MCULE-6717879231 [0,2,0,0,0,0|2,0,0]=4 1338 B13R1.3481 CC1=CC(=NN1CC(N)C(=O)O)C MCULE-7091980005 [0,2,0,0,0,0|2,0,0]=4 1339 B13R1.3481 CC1=CC(=NN1CC(N)C(=O)O)C MCULE-9662200101 [0,2,0,0,0,0|2,0,0]=4 1340 B13R1.3481 CC1=NN(C(=C1)CC(N)C(=O)O)C MCULE-7052233785 [0,2,0,0,0,0|2,0,0]=4 1341 B13R1.3481 CC1=NN(C(=C1)CC(N)C(=O)O)C MCULE-8229929653 [0,2,0,0,0,0|2,0,0]=4 1342 B13R1.3481 CN1C=C(C(=N1)CC(N)C(=O)O)Cl MCULE-6428516847 [0,2,0,0,0,0|2,0,0]=4 1343 B13R1.3481 CN1C=C(C(=N1)CC(N)C(=O)O)Cl MCULE-8388552774 [0,2,0,0,0,0|2,0,0]=4 1344 B13R1.3481 CN1C=C(C(=N1)C[C@H](N)C(=O)O)Cl MCULE-3483023733 [0,2,0,0,0,0|2,0,0]=4 1345 B13R1.3481 CN1C=C(C(=N1)C[C@H](N)C(=O)O)Cl MCULE-6796361280 [0,2,0,0,0,0|2,0,0]=4 1346 B13R1.5896 CC1=C(ON=C1O)C[C@@H](N)C(=O)O MCULE-7614933775 [0,2,0,0,0,0|1,1,0]=4 1347 B13R1.5896 CC1=C(ON=C1O)C[C@H](N)C(=O)O MCULE-8406387032 [0,2,0,0,0,0|1,1,0]=4 1348 B13R1.5896 N[C@@H](CC1=C(C(=O)NO1)Cl)C(=O)O MCULE-7859147590 [0,2,0,0,0,0|1,1,0]=4 1349 B13R1.66 CCOC(=O)C(C)CC1=CC=CN1 MCULE-7657841230 [0,2,0,0,0,0|2,0,0]=4 1350 B13R1.66 CCOC(=O)C(N)CC1=CNC=N1 MCULE-3872787530 [0,2,0,0,0,0|2,0,0]=4 1351 B13R1.66 CCOC(=O)C(N)CC1=CNC=N1 MCULE-8972710163 [0,2,0,0,0,0|2,0,0]=4 1352 B13R1.66 CCOC(=O)[C@@H](N)CC1=CNC=N1 MCULE-1557607999 [0,2,0,0,0,0|2,0,0]=4 1353 B13R1.66 CCOC(=O)[C@@H](N)CC1=CNC=N1 MCULE-3018944736 [0,2,0,0,0,0|2,0,0]=4 1354 B13R1.66 CCOC(=O)[C@@H](N)CC1=CNC=N1 MCULE-3309488051 [0,2,0,0,0,0|2,0,0]=4 1355 B13R1.66 CCOC(=O)[C@@H](N)CC1=CNC=N1 MCULE-3791539661 [0,2,0,0,0,0|2,0,0]=4 1356 B13R1.66 CCOC(=O)[C@@H](N)CC1=CNC=N1 MCULE-7039442133 [0,2,0,0,0,0|2,0,0]=4 1357 B13R1.83 COC(=O)C(C)C(=O)C1=CC=CS1 MCULE-9700353937 [0,2,0,0,0,0|1,0,1]=4 1358 B13R1.704 COC(=O)C(N)CC1=CC=CN1C MCULE-4851742309 [0,2,0,0,0,0|1,0,0]=3 1359 B13R1.704 COC(=O)C(N)CC1=CN=CN1C MCULE-4041428391 [0,2,0,0,0,0|2,0,0]=4 1360 B13R1.704 COC(=O)C(N)CC1=CN=CN1C MCULE-4051657005 [0,2,0,0,0,0|2,0,0]=4 1361 B13R1.704 COC(=O)[C@@H](N)CC1=C(C=CS1)Br MCULE-2577651819 [0,2,0,0,0,0|0,0,0]=2 1362 B13R1.704 COC(=O)[C@@H](N)CC1=C(C=CS1)Br MCULE-8914759431 [0,2,0,0,0,0|0,0,0]=2 1363 B13R1.704 COC(=O)[C@@H](N)CC1=C(SC=C1)Cl MCULE-2304536711 [0,2,0,0,0,0|2,0,0]=4 1364 B13R1.704 COC(=O)[C@H](N)CC1=C(SC=C1)Cl MCULE-7797355306 [0,2,0,0,0,0|2,0,0]=4 1365 B13R1.721 CN[C@@H](CC1=CNC=N1)C(=O)OC MCULE-2405422259 [0,2,0,0,0,0|2,0,0]=4 1366 B13R1.721 CN[C@@H](CC1=CNC=N1)C(=O)OC MCULE-2881338467 [0,2,0,0,0,0|2,0,0]=4 1367 B13R1.721 CN[C@@H](CC1=CNC=N1)C(=O)OC MCULE-3895444667 [0,2,0,0,0,0|2,0,0]=4 1368 B13R1.721 CN[C@@H](CC1=CNC=N1)C(=O)OC MCULE-6334517045 [0,2,0,0,0,0|2,0,0]=4 1369 B13R1.1773 COC(=O)C(C)(N)CN1C=CC=N1 MCULE-7822653204 [0,2,0,0,0,0|2,0,0]=4 1370 B13R1.1071 O=C(O)C(F)(F)C(O)C1=CC=CS1 MCULE-7788255118 [0,2,0,0,0,0|1,0,0]=3 1371 B13R1.421 CC1=C(SC=C1)CC(C#N)C(=O)O MCULE-3891582440 [0,2,0,0,0,0|0,0,1]=3 1372 B13R1.421 CC1=C(SC=N1)CC(C#N)C(=O)O MCULE-7207249538 [0,2,0,0,0,0|1,0,1]=4 1373 B13R1.2801 CCN1C=NC=C1C[C@H](N)C(=O)O MCULE-6666594551 [0,2,0,0,0,0|2,0,0]=4 1374 B13R1.2801 CCN1C=NC=C1C[C@H](N)C(=O)O MCULE-6935214570 [0,2,0,0,0,0|2,0,0]=4 1375 B13R1.7553 CN1C=NC(=C1C[C@H](N)C(=O)O)S MCULE-4488531209 [0,2,0,0,0,0|2,0,0]=4 1376 B13R1.695 O=CNC(CC1=CNC=N1)C(=O)O MCULE-4799476247 [0,2,0,0,0,0|2,0,0]=4 1377 B13R1.695 O=CN[C@@H](CC1=CNC=N1)C(=O)O MCULE-2584720723 [0,2,0,0,0,0|2,0,0]=4 1378 B13R1.695 O=CN[C@@H](CC1=CNC=N1)C(=O)O MCULE-9092036879 [0,2,0,0,0,0|2,0,0]=4 1379 B13R1.3571 CN(C)C(CC1=CN=CN1)C(=O)O MCULE-2883407867 [0,2,0,0,0,0|2,0,0]=4 1380 B13R1.3571 CN(C)C(CN1C=CC=N1)C(=O)O MCULE-4749863609 [0,2,0,0,0,0|2,0,0]=4 1381 B13R1.3571 CN(C)[C@@H](CC1=CN=CN1)C(=O)O MCULE-1439318444 [0,2,0,0,0,0|2,0,0]=4 1382 B13R1.3571 CN(C)[C@@H](CC1=CNC=N1)C(=O)O MCULE-7081821374 [0,2,0,0,0,0|2,0,0]=4 1383 B13R1.5639 CC(CN)(CC1=CC=CO1)C(=O)O MCULE-9614080255 [0,2,0,0,0,0|0,1,0]=3 1384 B13R1.5639 N[C@@](CF)(CC1=CN=CN1)C(=O)O MCULE-4430215351 [0,2,0,0,0,0|2,0,0]=4 1385 B13R1.5639 N[C@@](CF)(CC1=CN=CN1)C(=O)O MCULE-8174293073 [0,2,0,0,0,0|2,0,0]=4 1386 B13R1.5639 N[C@@](CF)(CC1=CNC=N1)C(=O)O MCULE-3527928511 [0,2,0,0,0,0|2,0,0]=4 1387 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 MCULE-1541760076 [0,0,1,1,0,0|1,0,1]=4 1388 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 MCULE-7084105095 [0,0,1,1,0,0|1,0,1]=4 1389 B11R1.36 NC(C(=O)O)C1=CC=CN=C1 MCULE-1136849880 [0,0,1,1,0,0|1,0,1]=4 1390 B11R1.36 NC(C(=O)O)C1=CN=CC=C1 MCULE-8130952741 [0,0,1,1,0,0|1,0,1]=4 1391 B11R1.36 NC(C(=O)O)C1=NC=CC=C1 MCULE-2491581165 [0,0,1,1,0,0|1,0,1]=4 1392 B11R1.36 NC(C(=O)O)C1=NC=CC=C1 MCULE-9805850696 [0,0,1,1,0,0|1,0,1]=4 1393 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-1151649771 [0,0,1,1,0,0|1,0,1]=4 1394 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-4882172946 [0,0,1,1,0,0|1,0,1]=4 1395 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-5961405650 [0,0,1,1,0,0|1,0,1]=4 1396 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-6391573296 [0,0,1,1,0,0|1,0,1]=4 1397 B11R1.36 N[C@@H](C(=O)O)C1=NC=CC=C1 MCULE-2178325430 [0,0,1,1,0,0|1,0,1]=4 1398 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 MCULE-6139481120 [0,0,1,1,0,0|1,0,1]=4 1399 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 MCULE-8262037456 [0,0,1,1,0,0|1,0,1]=4 1400 B11R2.8 O=C1C2=C(CC1Br)SC=C2 MCULE-3776773044 [1,0,0,1,0,0|1,0,0]=3 1401 B11R2.15 O=CC1=CC2=C(N1)C=CS2 MCULE-6003695539 [1,0,0,1,0,0|0,0,2]=4 1402 B11R2.32 OCC1CC1C2=CC=CS2 MCULE-7016226971 [1,0,0,1,0,0|1,0,1]=4 1403 B11R2.36 NC1CCC2=C(C1)SC=C2 MCULE-1240851931 [1,0,0,1,0,0|1,0,1]=4 1404 B11R2.36 NC1CCC2=C(C1)SC=C2 MCULE-1731656908 [1,0,0,1,0,0|1,0,1]=4 1405 B13R2.369 NC1CC2=C(C=CC=C2)NC1=O MCULE-3683073340 [0,0,0,1,0,1|2,0,0]=4 1406 B13R2.369 NC1CC2=C(C=CC=C2)NC1=O MCULE-7219110248 [0,0,0,1,0,1|2,0,0]=4 1407 B13R2.369 NC1CC2=CC=CC=C2NC1=O MCULE-4040080333 [0,0,0,1,0,1|2,0,0]=4 1408 B13R2.369 NC1CC2=CC=CN=C2NC1=O MCULE-3971600733 [0,0,0,1,0,1|2,0,0]=4 1409 B13R2.369 NC1CC2=CC=CN=C2NC1=O MCULE-8620358704 [0,0,0,1,0,1|2,0,0]=4 1410 B13R2.369 NC1CC2=CN=CC=C2NC1=O MCULE-5515582270 [0,0,0,1,0,1|2,0,0]=4 1411 B13R2.369 NC1CC2=CN=CC=C2NC1=O MCULE-6016305103 [0,0,0,1,0,1|2,0,0]=4 1412 B13R2.369 NC1CC2=NC=CC=C2NC1=O MCULE-9652711355 [0,0,0,1,0,1|2,0,0]=4 1413 B13R2.369 N[C@H]1CC2=C(N=CC=C2)NC1=O MCULE-1237241471 [0,0,0,1,0,1|2,0,0]=4 1414 B13R2.369 N[C@H]1CC2=C(N=CC=C2)NC1=O MCULE-4895114296 [0,0,0,1,0,1|2,0,0]=4 1415 B13R2.423 O=C(O)C1CC1C2=CC=CC=C2 MCULE-4945206002 [0,0,0,1,0,1|2,0,0]=4 1416 B13R2.423 O=C(O)C1CC1C2=CC=NC=C2 MCULE-8765058862 [0,0,0,1,0,1|2,0,0]=4 1417 B13R2.423 O=C(O)C1CC1C2=CN=CC=C2 MCULE-6747176716 [0,0,0,1,0,1|2,0,0]=4 1418 B13R2.423 O=C(O)C1CC1C2=NC=CC=C2 MCULE-2503142172 [0,0,0,1,0,1|2,0,0]=4 1419 B13R2.423 O=C(O)C1CC1C2=NC=CC=C2 MCULE-7309493546 [0,0,0,1,0,1|2,0,0]=4 1420 B13R2.423 O=C(O)C1OC1C2=CC=CC=C2 MCULE-3727767896 [0,0,0,1,0,1|2,0,0]=4 1421 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 MCULE-2192210615 [0,0,0,1,0,1|2,0,0]=4 1422 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 MCULE-2860569521 [0,0,0,1,0,1|2,0,0]=4 1423 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 MCULE-3348394121 [0,0,0,1,0,1|2,0,0]=4 1424 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CN=C2 MCULE-3563109221 [0,0,0,1,0,1|2,0,0]=4 1425 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=NC=C2 MCULE-1071043360 [0,0,0,1,0,1|2,0,0]=4 1426 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 MCULE-3210600666 [0,0,0,1,0,1|2,0,0]=4 1427 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 MCULE-4561189919 [0,0,0,1,0,1|2,0,0]=4 1428 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 MCULE-5985179860 [0,0,0,1,0,1|2,0,0]=4 1429 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CN=C2 MCULE-3365548011 [0,0,0,1,0,1|2,0,0]=4 1430 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=NC=C2 MCULE-6694994521 [0,0,0,1,0,1|2,0,0]=4 1431 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=NC=C2 MCULE-8962848406 [0,0,0,1,0,1|2,0,0]=4 1432 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CN=CC=C2 MCULE-3559760636 [0,0,0,1,0,1|2,0,0]=4 1433 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=NC=CC=C2 MCULE-2212295857 [0,0,0,1,0,1|2,0,0]=4 1434 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=NC=CC=C2 MCULE-9141439188 [0,0,0,1,0,1|2,0,0]=4 1435 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=NC=CC=C2 MCULE-9297304063 [0,0,0,1,0,1|2,0,0]=4 1436 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CC=C2 MCULE-1690730677 [0,0,0,1,0,1|2,0,0]=4 1437 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CC=C2 MCULE-6690615833 [0,0,0,1,0,1|2,0,0]=4 1438 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CN=C2 MCULE-1846240858 [0,0,0,1,0,1|2,0,0]=4 1439 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=NC=C2 MCULE-6745455131 [0,0,0,1,0,1|2,0,0]=4 1440 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=NC=C2 MCULE-8927910799 [0,0,0,1,0,1|2,0,0]=4 1441 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=NC=C2 MCULE-9920469869 [0,0,0,1,0,1|2,0,0]=4 1442 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=NC=CC=C2 MCULE-5798113353 [0,0,0,1,0,1|2,0,0]=4 1443 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=NC=CC=C2 MCULE-8864424633 [0,0,0,1,0,1|2,0,0]=4 1444 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=CC=C2 MCULE-1673792789 [0,0,0,1,0,1|2,0,0]=4 1445 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=CC=C2 MCULE-6444612585 [0,0,0,1,0,1|2,0,0]=4 1446 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=NC=C2 MCULE-3545210917 [0,0,0,1,0,1|2,0,0]=4 1447 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=NC=C2 MCULE-5265348026 [0,0,0,1,0,1|2,0,0]=4 1448 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=NC=C2 MCULE-8461287952 [0,0,0,1,0,1|2,0,0]=4 1449 B13R2.435 NC(=O)C1CC2=C(N1)C=CC=C2 MCULE-3871508317 [0,0,0,1,0,1|2,0,0]=4 1450 B13R2.435 NC(=O)[C@@H]1CC2=CC=CC=C2N1 MCULE-4568317333 [0,0,0,1,0,1|2,0,0]=4 1451 B13R2.435 O=C(O)C1CC2=C(C1)C=NC=C2 MCULE-1316584114 [0,0,0,1,0,1|2,0,0]=4 1452 B13R2.435 O=C(O)C1CC2=C(C1)C=NC=C2 MCULE-4209278865 [0,0,0,1,0,1|2,0,0]=4 1453 B13R2.435 O=C(O)C1CC2=C(N1)C=CC=C2 MCULE-2562454412 [0,0,0,1,0,1|1,0,0]=3 1454 B13R2.435 O=C(O)C1CC2=C(N1)C=CC=C2 MCULE-7215841209 [0,0,0,1,0,1|1,0,0]=3 1455 B13R2.435 O=C(O)C1CC2=CC=CC=C2C1 MCULE-3552591967 [0,0,0,1,0,1|2,0,0]=4 1456 B13R2.435 O=C(O)C1CC2=CC=CC=C2O1 MCULE-7206708690 [0,0,0,1,0,1|2,0,0]=4 1457 B13R2.435 O=C(O)C1CC2=CC=CC=C2S1 MCULE-1880873093 [0,0,0,1,0,1|2,0,0]=4 1458 B13R2.435 O=C(O)C1CC2=CC=CN=C2C1 MCULE-2688790100 [0,0,0,1,0,1|2,0,0]=4 1459 B13R2.435 O=C(O)C1CC2=CC=CN=C2C1 MCULE-3306473482 [0,0,0,1,0,1|2,0,0]=4 1460 B13R2.435 O=C(O)C1CC2=CC=CN=C2N1 MCULE-8537870180 [0,0,0,1,0,1|1,0,0]=3 1461 B13R2.435 O=C(O)[C@@H]1CC2=C(N1)C=CC=C2 MCULE-7672663112 [0,0,0,1,0,1|1,0,0]=3 1462 B13R2.435 O=C(O)[C@@H]1CC2=CC=CC=C2N1 MCULE-8181141847 [0,0,0,1,0,1|1,0,0]=3 1463 B13R2.435 O=C(O)[C@@H]1CC2=CC=CN=C2N1 MCULE-4315790053 [0,0,0,1,0,1|1,0,0]=3 1464 B13R2.435 O=C(O)[C@H]1CC2=C(N1)C=CC=C2 MCULE-1818842898 [0,0,0,1,0,1|1,0,0]=3 1465 B13R2.435 O=C(O)[C@H]1CC2=C(N1)C=CC=C2 MCULE-5551098234 [0,0,0,1,0,1|1,0,0]=3 1466 B13R2.142 OC1=NNC(=C1)CC2=CC=CS2 MCULE-4947074660 [0,0,0,1,0,1|1,0,1]=4 1467 B13R2.5590 NC1(CC1C2=CC=CO2)C(=O)O MCULE-5497906551 [0,0,0,1,0,1|0,1,0]=3 1468 B13R2.5590 NC1(CC1C2=CC=CS2)C(=O)O MCULE-2058019854 [0,0,0,1,0,1|0,0,0]=2 1469 B13R2.400 CC1=CC2=C(S1)C=C(N2)C(=O)O MCULE-3896964575 [0,1,0,1,0,0|0,0,2]=4 1470 B13R2.400 O=C(O)C1=CC2=C(N1)C=C(S2)Br MCULE-4073480429 [0,1,0,1,0,0|0,0,2]=4 1471 B13R2.400 O=C(O)C1=CC2=C(N1)C=C(S2)Cl MCULE-2499460773 [0,1,0,1,0,0|0,0,2]=4 1472 B13R2.2978 CC(=O)C1CC1C2=CC=C(S2)C MCULE-2023687467 [0,1,0,1,0,0|2,0,0]=4 1473 B13R2.2978 CC(=O)C1CC1C2=CC=C(S2)Cl MCULE-9546793913 [0,1,0,1,0,0|2,0,0]=4 1474 B13R2.2978 CC1=CC=C(O1)C2CC2C(=O)O MCULE-5556917355 [0,1,0,1,0,0|1,1,0]=4 1475 B13R2.2978 CC1=CC=C(S1)C2CC2C(=O)O MCULE-3542602957 [0,1,0,1,0,0|1,0,0]=3 1476 B13R2.2978 O=C(O)C1CC1C2=CC=C(S2)Br MCULE-9106706471 [0,1,0,1,0,0|1,0,0]=3 1477 B13R2.2978 O=C(O)C1CC1C2=CC=C(S2)Cl MCULE-6077816270 [0,1,0,1,0,0|1,0,0]=3 1478 B13R2.2978 O=C(O)[C@@H]1C[C@H]1C2=CC(=CS2)Br MCULE-6050364181 [0,1,0,1,0,0|1,0,0]=3 1479 B13R2.2978 O=C(O)[C@@H]1C[C@H]1C2=CC=C(S2)Cl MCULE-4610301915 [0,1,0,1,0,0|1,0,0]=3 1480 B13R2.2978 O=C(O)[C@H]1C[C@@H]1C2=CC=C(S2)Br MCULE-8420379838 [0,1,0,1,0,0|1,0,0]=3 1481 B13R2.2978 O=C(O)[C@H]1C[C@@H]1C2=CC=C(S2)Br MCULE-9456353243 [0,1,0,1,0,0|1,0,0]=3 1482 B13R2.2978 [C@H]1(C[C@H]1C2=CC=C(S2)Br)C(=O)O MCULE-7259374248 [0,1,0,1,0,0|1,0,0]=3 1483 B13R2.3678 CC1=CSC2=C1NC(=C2)C(=O)O MCULE-7490932911 [0,1,0,1,0,0|0,0,2]=4 1484 B13R2.3678 O=C(O)C1=CC2=C(N1)C(=CS2)Br MCULE-2535123020 [0,1,0,1,0,0|0,0,2]=4 1485 B13R2.3678 O=C(O)C1=CC2=C(N1)C(=CS2)Cl MCULE-9827381333 [0,1,0,1,0,0|0,0,2]=4 1486 B13R2.3678 O=C(O)C1=CC2=C(N1)C(=CS2)F MCULE-1297797905 [0,1,0,1,0,0|0,0,2]=4 1487 B13R2.531 COC(=O)C1=CC2=C(N1)C=CS2 MCULE-2308710588 [0,1,0,1,0,0|0,0,2]=4 1488 B13R2.2334 CC1=C(NC2=C1SC=C2)C(=O)O MCULE-4914182786 [0,1,0,1,0,0|0,0,2]=4 1489 B13R2.2334 CN1C(=CC2=C1C=CS2)C(=O)O MCULE-8913935769 [0,1,0,1,0,0|0,0,2]=4 1490 B13R2.5511 CC1(CC1C(=O)O)C2=CC=CS2 MCULE-3074951897 [0,1,0,1,0,0|1,0,0]=3 1491 B13R2.3437 CC1=C(SC=C1)[C@H]2C[C@H]2C(=O)O MCULE-1052831728 [0,1,0,1,0,0|1,0,0]=3 1492 B13R2.3437 CN1C=CC=C1C2CC2C(=O)O MCULE-4282999741 [0,1,0,1,0,0|2,0,0]=4 1493 B9R1.11 C=C[C@@H](N)C1=CC=CN1 MCULE-2039273360 [1,0,0,0,1,0|2,0,0]=4 1494 B9R1.11 C=C[C@@H](N)C1=CC=CN1 MCULE-5563891659 [1,0,0,0,1,0|2,0,0]=4 1495 B9R1.11 C=C[C@@H](N)C1=CC=CO1 MCULE-2998659581 [1,0,0,0,1,0|1,1,0]=4 1496 B9R1.11 C=C[C@@H](N)C1=CC=CO1 MCULE-4938527511 [1,0,0,0,1,0|1,1,0]=4 1497 B9R1.11 C=C[C@@H](N)C1=CC=CS1 MCULE-1954429131 [1,0,0,0,1,0|1,0,0]=3 1498 B9R1.11 C=C[C@@H](N)C1=CC=CS1 MCULE-7444111835 [1,0,0,0,1,0|1,0,0]=3 1499 B9R1.11 C=C[C@H](N)C1=CC=CN1 MCULE-2024102559 [1,0,0,0,1,0|2,0,0]=4 1500 B9R1.11 C=C[C@H](N)C1=CC=CN1 MCULE-6215815299 [1,0,0,0,1,0|2,0,0]=4 1501 B9R1.11 C=C[C@H](N)C1=CC=CO1 MCULE-1081781529 [1,0,0,0,1,0|1,1,0]=4 1502 B9R1.11 C=C[C@H](N)C1=CC=CO1 MCULE-6198096087 [1,0,0,0,1,0|1,1,0]=4 1503 B9R1.11 C=C[C@H](N)C1=CC=CS1 MCULE-1944091403 [1,0,0,0,1,0|1,0,0]=3 1504 B9R1.11 C=C[C@H](N)C1=CC=CS1 MCULE-6065409407 [1,0,0,0,1,0|1,0,0]=3 1505 B9R1.11 CC(NO)C1=CC=CS1 MCULE-2478046614 [1,0,0,0,1,0|2,0,0]=4 1506 B9R1.11 CCC(N)C1=CC=CS1 MCULE-1719425351 [1,0,0,0,1,0|1,0,1]=4 1507 B9R1.11 CCC(N)C1=CC=CS1 MCULE-4269187791 [1,0,0,0,1,0|1,0,1]=4 1508 B9R1.11 CC[C@@H](N)C1=CC=CS1 MCULE-1237769749 [1,0,0,0,1,0|1,0,1]=4 1509 B9R1.11 CC[C@@H](N)C1=CC=CS1 MCULE-2187042638 [1,0,0,0,1,0|1,0,1]=4 1510 B9R1.11 CC[C@H](N)C1=CC=CS1 MCULE-3995185457 [1,0,0,0,1,0|1,0,1]=4 1511 B9R1.11 CC[C@H](N)C1=CC=CS1 MCULE-8586745736 [1,0,0,0,1,0|1,0,1]=4 1512 B9R1.11 N#CC(N)C1=CC=CS1 MCULE-1677199571 [1,0,0,0,1,0|1,0,1]=4 1513 B9R1.11 N#CC(N)C1=CC=CS1 MCULE-5989541497 [1,0,0,0,1,0|1,0,1]=4 1514 B9R1.11 N/C(=N\O)/C1=CC=CS1 MCULE-6814860394 [1,0,0,0,1,0|1,0,1]=4 1515 B9R1.11 NC(CO)C1=CC=CO1 MCULE-8674475765 [1,0,0,0,1,0|0,1,1]=4 1516 B9R1.11 NC(CO)C1=CC=CS1 MCULE-4654722748 [1,0,0,0,1,0|0,0,1]=3 1517 B9R1.11 NC(CO)C1=CC=CS1 MCULE-6564477027 [1,0,0,0,1,0|0,0,1]=3 1518 B9R1.11 NC(CO)C1=NC=CS1 MCULE-3995097179 [1,0,0,0,1,0|1,0,1]=4 1519 B9R1.11 NC(CO)C1=NC=CS1 MCULE-6518033522 [1,0,0,0,1,0|1,0,1]=4 1520 B9R1.11 NCC(N)C1=CC=CS1 MCULE-2210711596 [1,0,0,0,1,0|1,0,1]=4 1521 B9R1.11 NC[C@@H](N)C1=CC=CS1 MCULE-1473868094 [1,0,0,0,1,0|1,0,1]=4 1522 B9R1.11 NC[C@@H](N)C1=CC=CS1 MCULE-3374700668 [1,0,0,0,1,0|1,0,1]=4 1523 B9R1.11 NC[C@H](N)C1=CC=CS1 MCULE-1116922890 [1,0,0,0,1,0|1,0,1]=4 1524 B9R1.11 NC[C@H](N)C1=CC=CS1 MCULE-4374533394 [1,0,0,0,1,0|1,0,1]=4 1525 B9R1.11 N[C@@H](CF)C1=CC=CS1 MCULE-3543324732 [1,0,0,0,1,0|1,0,1]=4 1526 B9R1.11 N[C@@H](CF)C1=CC=CS1 MCULE-4555930867 [1,0,0,0,1,0|1,0,1]=4 1527 B9R1.11 N[C@@H](CO)C1=CC=CN1 MCULE-4254891194 [1,0,0,0,1,0|1,0,1]=4 1528 B9R1.11 N[C@@H](CO)C1=CC=CN1 MCULE-5205441111 [1,0,0,0,1,0|1,0,1]=4 1529 B9R1.11 N[C@@H](CO)C1=CC=CO1 MCULE-6764436281 [1,0,0,0,1,0|0,1,1]=4 1530 B9R1.11 N[C@@H](CO)C1=CC=CO1 MCULE-9947497995 [1,0,0,0,1,0|0,1,1]=4 1531 B9R1.11 N[C@@H](CO)C1=CC=CS1 MCULE-8497977570 [1,0,0,0,1,0|0,0,1]=3 1532 B9R1.11 N[C@@H](CO)C1=CC=CS1 MCULE-9284174789 [1,0,0,0,1,0|0,0,1]=3 1533 B9R1.11 N[C@@H](CO)C1=NC=CS1 MCULE-2126936320 [1,0,0,0,1,0|1,0,1]=4 1534 B9R1.11 N[C@@H](CO)C1=NC=CS1 MCULE-5009480596 [1,0,0,0,1,0|1,0,1]=4 1535 B9R1.11 N[C@@H](CO)C1=NC=CS1 MCULE-7347996301 [1,0,0,0,1,0|1,0,1]=4 1536 B9R1.11 N[C@@H](CO)C1=NC=CS1 MCULE-7800124054 [1,0,0,0,1,0|1,0,1]=4 1537 B9R1.11 N[C@H](CF)C1=CC=CS1 MCULE-7521065496 [1,0,0,0,1,0|1,0,1]=4 1538 B9R1.11 N[C@H](CF)C1=CC=CS1 MCULE-9096259257 [1,0,0,0,1,0|1,0,1]=4 1539 B9R1.11 N[C@H](CO)C1=CC=CN1 MCULE-3731213941 [1,0,0,0,1,0|1,0,1]=4 1540 B9R1.11 N[C@H](CO)C1=CC=CN1 MCULE-7131218904 [1,0,0,0,1,0|1,0,1]=4 1541 B9R1.11 N[C@H](CO)C1=CC=CO1 MCULE-3411497399 [1,0,0,0,1,0|0,1,1]=4 1542 B9R1.11 N[C@H](CO)C1=CC=CO1 MCULE-7199825161 [1,0,0,0,1,0|0,1,1]=4 1543 B9R1.11 N[C@H](CO)C1=CC=CO1 MCULE-7944569773 [1,0,0,0,1,0|0,1,1]=4 1544 B9R1.11 N[C@H](CO)C1=CC=CO1 MCULE-9644078126 [1,0,0,0,1,0|0,1,1]=4 1545 B9R1.11 N[C@H](CO)C1=CC=CS1 MCULE-3080285583 [1,0,0,0,1,0|0,0,1]=3 1546 B9R1.11 N[C@H](CO)C1=CC=CS1 MCULE-3333591624 [1,0,0,0,1,0|0,0,1]=3 1547 B9R1.11 N[C@H](CO)C1=NC=CS1 MCULE-3729835795 [1,0,0,0,1,0|1,0,1]=4 1548 B9R1.11 N[C@H](CO)C1=NC=CS1 MCULE-7868626372 [1,0,0,0,1,0|1,0,1]=4 1549 B9R1.11 OCC(O)C1=CC=CS1 MCULE-4730293440 [1,0,0,0,1,0|1,0,1]=4 1550 B11R1.40 C=CC(N)CC1=CC=CC=C1 MCULE-7828922796 [1,0,0,0,0,1|2,0,0]=4 1551 B11R1.40 C=CC(N)CC1=CC=CC=C1 MCULE-9021694172 [1,0,0,0,0,1|2,0,0]=4 1552 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 MCULE-1510653630 [1,0,0,0,0,1|2,0,0]=4 1553 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 MCULE-5511006012 [1,0,0,0,0,1|2,0,0]=4 1554 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 MCULE-6738217568 [1,0,0,0,0,1|2,0,0]=4 1555 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 MCULE-8476744141 [1,0,0,0,0,1|2,0,0]=4 1556 B11R1.40 C=C[C@H](N)CC1=CC=CC=C1 MCULE-1276732233 [1,0,0,0,0,1|2,0,0]=4 1557 B11R1.40 C=C[C@H](N)CC1=CC=CC=C1 MCULE-1306744520 [1,0,0,0,0,1|2,0,0]=4 1558 B11R1.40 C=C[C@H](N)CC1=CC=CC=C1 MCULE-2277154559 [1,0,0,0,0,1|2,0,0]=4 1559 B11R1.40 C=C[C@H](N)CC1=CC=CC=C1 MCULE-7665846986 [1,0,0,0,0,1|2,0,0]=4 1560 B11R1.40 CC(C=O)CC1=CC=CC=C1 MCULE-6923755839 [1,0,0,0,0,1|2,0,0]=4 1561 B11R1.40 NC(CO)CC1=CC=CC=C1 MCULE-1704866264 [1,0,0,0,0,1|1,0,1]=4 1562 B11R1.40 NC(CO)CC1=CC=CC=C1 MCULE-2871230838 [1,0,0,0,0,1|1,0,1]=4 1563 B11R1.40 NC(CO)CC1=CC=NC=C1 MCULE-7649552853 [1,0,0,0,0,1|1,0,1]=4 1564 B11R1.40 NC(CO)CC1=CC=NC=C1 MCULE-9792012975 [1,0,0,0,0,1|1,0,1]=4 1565 B11R1.40 NC(CO)CC1=CN=CC=C1 MCULE-5682317971 [1,0,0,0,0,1|1,0,1]=4 1566 B11R1.40 NC(CO)CC1=CN=CC=C1 MCULE-8457722347 [1,0,0,0,0,1|1,0,1]=4 1567 B11R1.40 NC(CO)CC1=NC=CC=C1 MCULE-3610486856 [1,0,0,0,0,1|1,0,1]=4 1568 B11R1.40 NC(CO)CC1=NC=CC=C1 MCULE-7359951740 [1,0,0,0,0,1|1,0,1]=4 1569 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 MCULE-9689370748 [1,0,0,0,0,1|1,0,1]=4 1570 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 MCULE-9800128709 [1,0,0,0,0,1|1,0,1]=4 1571 B11R1.40 O=CC(Br)CC1=CC=CC=C1 MCULE-5469912045 [1,0,0,0,0,1|2,0,0]=4 1572 B11R1.40 [C@@H](N)(CO)CC1=CC=CC=C1 MCULE-6887535557 [1,0,0,0,0,1|1,0,1]=4 1573 B11R1.40 [C@H](N)(CO)CC1=CC=CC=C1 MCULE-5041919913 [1,0,0,0,0,1|1,0,1]=4 1574 B11R1.91 CC(=O)CCC1=CC=CC=C1 MCULE-1136231603 [1,0,0,0,0,1|2,0,0]=4 1575 B11R1.91 CC(=O)CCC1=CN=CC=C1 MCULE-8978954109 [1,0,0,0,0,1|2,0,0]=4 1576 B11R1.91 CC(=O)CCC1=NC=CC=C1 MCULE-2250801533 [1,0,0,0,0,1|2,0,0]=4 1577 B11R1.91 NC(=O)CCC1=CC=CC=C1 MCULE-3588566414 [1,0,0,0,0,1|2,0,0]=4 1578 B11R1.91 NC(=O)CCC1=CC=CN=C1 MCULE-9563578514 [1,0,0,0,0,1|2,0,0]=4 1579 B11R1.91 NC(=O)CCC1=CC=NC=C1 MCULE-7075206346 [1,0,0,0,0,1|2,0,0]=4 1580 B11R1.91 NC(=O)CCC1=CC=NC=N1 MCULE-1725058959 [1,0,0,0,0,1|2,0,0]=4 1581 B11R1.91 NC(=O)CCC1=NC=CC=C1 MCULE-8837139984 [1,0,0,0,0,1|2,0,0]=4 1582 B11R1.91 NC(=O)CCC1=NC=CC=N1 MCULE-3344072771 [1,0,0,0,0,1|2,0,0]=4 1583 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 MCULE-2895233000 [1,0,0,0,0,1|2,0,0]=4 1584 B11R1.91 O=C(Cl)CCC1=CN=CC=C1 MCULE-1586300353 [1,0,0,0,0,1|2,0,0]=4 1585 B11R1.91 O=C(O)CCC1=CC=CC=C1 MCULE-1670073750 [1,0,0,0,0,1|1,0,0]=3 1586 B11R1.91 O=C(O)CCC1=CC=CC=N1 MCULE-7798422459 [1,0,0,0,0,1|1,0,0]=3 1587 B11R1.91 O=C(O)CCC1=CC=NC=C1 MCULE-4931237552 [1,0,0,0,0,1|1,0,0]=3 1588 B11R1.91 O=C(O)CCC1=CC=NN=C1 MCULE-4137232331 [1,0,0,0,0,1|2,0,0]=4 1589 B11R1.91 O=C(O)CCC1=CN=CC=C1 MCULE-9809125467 [1,0,0,0,0,1|1,0,0]=3 1590 B11R1.91 O=C(O)CCC1=CN=CN=C1 MCULE-4847571821 [1,0,0,0,0,1|2,0,0]=4 1591 B11R1.91 O=C(O)CCC1=NC=CC=C1 MCULE-3850875705 [1,0,0,0,0,1|1,0,0]=3 1592 B11R1.91 O=C(O)CCC1=NC=CC=C1 MCULE-7947562908 [1,0,0,0,0,1|1,0,0]=3 1593 B11R1.91 O=C(O)CCC1=NC=CC=N1 MCULE-6402169801 [1,0,0,0,0,1|1,0,0]=3 1594 B11R1.91 O=C(O)CCC1=NC=CN=C1 MCULE-1475251267 [1,0,0,0,0,1|1,0,0]=3 1595 B11R1.91 O=C(O)CCC1=NC=NC=C1 MCULE-1053932202 [1,0,0,0,0,1|1,0,0]=3 1596 B11R1.91 O=C(O)CCC1=NN=CC=C1 MCULE-2530115442 [1,0,0,0,0,1|1,0,0]=3 1597 B11R1.91 O=C(O)CNC1=CC=CC=C1 MCULE-4813130378 [1,0,0,0,0,1|2,0,0]=4 1598 B11R1.91 O=C(O)CNC1=CC=CN=C1 MCULE-1578102322 [1,0,0,0,0,1|2,0,0]=4 1599 B11R1.91 O=C(O)CNC1=CC=CN=C1 MCULE-6139247264 [1,0,0,0,0,1|2,0,0]=4 1600 B11R1.91 O=C(O)CNC1=CC=NC=C1 MCULE-3150988193 [1,0,0,0,0,1|2,0,0]=4 1601 B11R1.91 O=C(O)CNC1=CC=NC=C1 MCULE-6561822983 [1,0,0,0,0,1|2,0,0]=4 1602 B11R1.91 O=C(O)CNC1=NC=CC=C1 MCULE-5066813794 [1,0,0,0,0,1|2,0,0]=4 1603 B11R1.91 O=C(O)CNC1=NC=CC=C1 MCULE-5626569031 [1,0,0,0,0,1|2,0,0]=4 1604 B11R1.91 O=C(O)CNC1=NC=CC=N1 MCULE-1554989372 [1,0,0,0,0,1|2,0,0]=4 1605 B11R1.91 O=C(O)COC1=CC=CC=C1 MCULE-5625991303 [1,0,0,0,0,1|2,0,0]=4 1606 B11R1.91 O=C(O)COC1=CC=CC=N1 MCULE-4844717094 [1,0,0,0,0,1|2,0,0]=4 1607 B11R1.91 O=C(O)COC1=CC=NC=C1 MCULE-5903809736 [1,0,0,0,0,1|2,0,0]=4 1608 B11R1.91 O=C(O)COC1=CN=CC=C1 MCULE-1733906903 [1,0,0,0,0,1|2,0,0]=4 1609 B11R1.91 O=C(O)COC1=CN=CC=C1 MCULE-2439507515 [1,0,0,0,0,1|2,0,0]=4 1610 B11R1.91 O=C(O)COC1=CN=CC=C1 MCULE-3978081968 [1,0,0,0,0,1|2,0,0]=4 1611 B11R1.91 O=C(O)COC1=NC=CC=C1 MCULE-2958185004 [1,0,0,0,0,1|2,0,0]=4 1612 B11R1.91 O=C(O)COC1=NC=CC=N1 MCULE-4203130703 [1,0,0,0,0,1|2,0,0]=4 1613 B11R1.91 O=C(O)COC1=NN=CC=C1 MCULE-3500815204 [1,0,0,0,0,1|2,0,0]=4 1614 B11R1.91 O=C(O)CSC1=CC=CC=C1 MCULE-4616509502 [1,0,0,0,0,1|2,0,0]=4 1615 B11R1.91 O=C(O)CSC1=CC=NC=C1 MCULE-7699690938 [1,0,0,0,0,1|2,0,0]=4 1616 B11R1.91 O=C(O)CSC1=CC=NC=N1 MCULE-7593533042 [1,0,0,0,0,1|2,0,0]=4 1617 B11R1.91 O=C(O)CSC1=NC=CC=C1 MCULE-3224679092 [1,0,0,0,0,1|2,0,0]=4 1618 B11R1.91 O=C(O)CSC1=NC=CC=N1 MCULE-2881527695 [1,0,0,0,0,1|2,0,0]=4 1619 B11R1.91 O=C(O)CSC1=NN=CC=C1 MCULE-1473695413 [1,0,0,0,0,1|2,0,0]=4 1620 B11R1.91 O=C([O-])CCC1=CC=CC=C1 MCULE-5708877330 [1,0,0,0,0,1|1,0,1]=4 1621 B11R1.172 CC(=O)CSCC1=CC=CO1 MCULE-8946739392 [1,0,0,0,0,1|1,1,0]=4 1622 B11R1.172 N=C(N)NCCC1=CC=CS1 MCULE-3348293064 [1,0,0,0,0,1|2,0,0]=4 1623 B11R1.172 NC(=O)NCCC1=CC=CS1 MCULE-3023710976 [1,0,0,0,0,1|1,0,0]=3 1624 B11R1.172 NC(=S)NCCC1=CC=CS1 MCULE-3516975011 [1,0,0,0,0,1|1,1,0]=4 1625 B11R1.172 O=C(O)CCCC1=CC=CS1 MCULE-2208395467 [1,0,0,0,0,1|0,0,0]=2 1626 B11R1.172 O=C(O)CCCC1=CNC=C1 MCULE-4973184677 [1,0,0,0,0,1|2,0,0]=4 1627 B11R1.172 O=C(O)CCCC1=CSC=C1 MCULE-7269389456 [1,0,0,0,0,1|2,0,0]=4 1628 B11R1.172 O=C(O)CCCC1=NC=CS1 MCULE-4740417622 [1,0,0,0,0,1|1,0,0]=3 1629 B11R1.172 O=C(O)CCCN1C=CC=C1 MCULE-6376119109 [1,0,0,0,0,1|2,0,0]=4 1630 B11R1.172 O=C(O)CCCN1C=CC=N1 MCULE-6299075182 [1,0,0,0,0,1|2,0,0]=4 1631 B11R1.172 O=C(O)CCNC1=NC=CS1 MCULE-9400156266 [1,0,0,0,0,1|1,0,0]=3 1632 B11R1.172 O=C(O)CCSC1=CC=CS1 MCULE-5358677561 [1,0,0,0,0,1|0,0,0]=2 1633 B11R1.172 O=C(O)CNCC1=CC=CO1 MCULE-3294949215 [1,0,0,0,0,1|0,1,0]=3 1634 B11R1.172 O=C(O)CNCC1=CN=CS1 MCULE-2451110741 [1,0,0,0,0,1|1,0,0]=3 1635 B11R1.172 O=C(O)CNCC1=CSC=C1 MCULE-8463113169 [1,0,0,0,0,1|2,0,0]=4 1636 B11R1.172 O=C(O)COCC1=CC=CO1 MCULE-2722649918 [1,0,0,0,0,1|0,1,0]=3 1637 B11R1.172 O=C(O)CSCC1=CC=CO1 MCULE-2797657778 [1,0,0,0,0,1|0,1,0]=3 1638 B11R1.172 O=C(O)CSCC1=CC=CS1 MCULE-8336860516 [1,0,0,0,0,1|0,0,0]=2 1639 B11R1.172 O=C(O)CSCC1=CSC=C1 MCULE-2925169500 [1,0,0,0,0,1|2,0,0]=4 1640 B11R1.172 O=C(O)CSCC1=CSC=N1 MCULE-9430988131 [1,0,0,0,0,1|2,0,0]=4 1641 B11R1.172 O=C(O)CSCC1=NC=CN1 MCULE-2957999026 [1,0,0,0,0,1|2,0,0]=4 1642 B11R1.172 O=C(O)CSCC1=NC=CN1 MCULE-9921381731 [1,0,0,0,0,1|2,0,0]=4 1643 B11R1.172 O=C([O-])CCCC1=NC=CS1 MCULE-6427120144 [1,0,0,0,0,1|1,0,1]=4 1644 B11R1.172 O=C([O-])COCC1=CC=CO1 MCULE-3260300210 [1,0,0,0,0,1|0,1,1]=4 1645 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 MCULE-7312149583 [0,0,0,0,0,2|1,0,0]=3 1646 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 MCULE-7562642812 [0,0,0,0,0,2|1,0,0]=3 1647 B13R1.348 NC(CC(=O)O)CC1=CC=CN=C1 MCULE-8199109170 [0,0,0,0,0,2|1,0,0]=3 1648 B13R1.348 NC(CC(=O)O)CC1=CC=CN=C1 MCULE-8652871170 [0,0,0,0,0,2|1,0,0]=3 1649 B13R1.348 NC(CC(=O)O)CC1=CC=NC=C1 MCULE-7399531153 [0,0,0,0,0,2|1,0,0]=3 1650 B13R1.348 NC(CC(=O)O)CC1=CC=NC=C1 MCULE-8042369673 [0,0,0,0,0,2|1,0,0]=3 1651 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 MCULE-1099480064 [0,0,0,0,0,2|1,0,0]=3 1652 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 MCULE-1511536989 [0,0,0,0,0,2|1,0,0]=3 1653 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 MCULE-3741596903 [0,0,0,0,0,2|1,0,0]=3 1654 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 MCULE-5386657741 [0,0,0,0,0,2|1,0,0]=3 1655 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CN=C1 MCULE-1669200894 [0,0,0,0,0,2|1,0,0]=3 1656 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CN=C1 MCULE-4996936193 [0,0,0,0,0,2|1,0,0]=3 1657 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CN=C1 MCULE-6763100819 [0,0,0,0,0,2|1,0,0]=3 1658 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CN=C1 MCULE-7308104054 [0,0,0,0,0,2|1,0,0]=3 1659 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=NC=C1 MCULE-4397380511 [0,0,0,0,0,2|1,0,0]=3 1660 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=NC=C1 MCULE-5096377673 [0,0,0,0,0,2|1,0,0]=3 1661 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=NC=C1 MCULE-5896724687 [0,0,0,0,0,2|1,0,0]=3 1662 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=NC=C1 MCULE-7505313222 [0,0,0,0,0,2|1,0,0]=3 1663 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 MCULE-1213190445 [0,0,0,0,0,2|1,0,0]=3 1664 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 MCULE-4947387639 [0,0,0,0,0,2|1,0,0]=3 1665 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 MCULE-7320146706 [0,0,0,0,0,2|1,0,0]=3 1666 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 MCULE-9110835818 [0,0,0,0,0,2|1,0,0]=3 1667 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CN=C1 MCULE-1844854356 [0,0,0,0,0,2|1,0,0]=3 1668 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CN=C1 MCULE-8941416281 [0,0,0,0,0,2|1,0,0]=3 1669 B13R1.348 N[C@H](CC(=O)O)CC1=CC=NC=C1 MCULE-1243262331 [0,0,0,0,0,2|1,0,0]=3 1670 B13R1.348 N[C@H](CC(=O)O)CC1=CC=NC=C1 MCULE-2389374075 [0,0,0,0,0,2|1,0,0]=3 1671 B13R1.348 O=C(O)CC(O)CC1=CC=CC=C1 MCULE-8990071495 [0,0,0,0,0,2|2,0,0]=4 1672 B13R1.351 CC(CCC1=CC=CC=C1)C(=O)O MCULE-7379407319 [0,0,0,0,0,2|2,0,0]=4 1673 B13R1.351 CC(COC1=CC=CC=C1)C(=O)O MCULE-9503504513 [0,0,0,0,0,2|2,0,0]=4 1674 B13R1.351 CC(CSC1=CC=CC=C1)C(=O)O MCULE-5686565762 [0,0,0,0,0,2|2,0,0]=4 1675 B13R1.351 CC(NCC1=CC=CC=C1)C(=O)O MCULE-8047591178 [0,0,0,0,0,2|2,0,0]=4 1676 B13R1.351 CC(NCC1=CC=CC=C1)C(=O)O MCULE-9112844841 [0,0,0,0,0,2|2,0,0]=4 1677 B13R1.351 CC(NCC1=CN=CC=C1)C(=O)O MCULE-3524985301 [0,0,0,0,0,2|2,0,0]=4 1678 B13R1.351 CC(NCC1=CN=CC=C1)C(=O)O MCULE-4281699262 [0,0,0,0,0,2|2,0,0]=4 1679 B13R1.351 CC(NCC1=NC=CC=C1)C(=O)O MCULE-2277977761 [0,0,0,0,0,2|2,0,0]=4 1680 B13R1.351 CC(OCC1=CC=CC=C1)C(=O)O MCULE-7789298081 [0,0,0,0,0,2|2,0,0]=4 1681 B13R1.351 CC(OCC1=CC=CC=C1)C(=O)O MCULE-8485315352 [0,0,0,0,0,2|2,0,0]=4 1682 B13R1.351 CC(OCC1=CC=NC=C1)C(=O)O MCULE-5446888299 [0,0,0,0,0,2|2,0,0]=4 1683 B13R1.351 CC(OCC1=CC=NC=C1)C(=O)O MCULE-9564089350 [0,0,0,0,0,2|2,0,0]=4 1684 B13R1.351 CC(SCC1=CC=CC=C1)C(=O)O MCULE-3001042921 [0,0,0,0,0,2|2,0,0]=4 1685 B13R1.351 C[C@@H](OCC1=CC=CC=C1)C(=O)O MCULE-4434459617 [0,0,0,0,0,2|2,0,0]=4 1686 B13R1.351 C[C@@H](OCC1=CC=CC=C1)C(=O)O MCULE-7168308206 [0,0,0,0,0,2|2,0,0]=4 1687 B13R1.351 C[C@H](NCC1=CC=CC=C1)C(=O)O MCULE-6038689952 [0,0,0,0,0,2|2,0,0]=4 1688 B13R1.351 C[C@H](NCC1=CC=CC=C1)C(=O)O MCULE-8390998499 [0,0,0,0,0,2|2,0,0]=4 1689 B13R1.351 C[C@H](NCC1=CC=CC=C1)C(=O)O MCULE-9525640847 [0,0,0,0,0,2|2,0,0]=4 1690 B13R1.351 C[C@H](OCC1=CC=CC=C1)C(=O)O MCULE-7749356438 [0,0,0,0,0,2|2,0,0]=4 1691 B13R1.351 C[C@H](OCC1=CC=CC=C1)C(=O)O MCULE-8451141700 [0,0,0,0,0,2|2,0,0]=4 1692 B13R1.351 NC(=O)C(N)CCC1=CC=CC=C1 MCULE-9732082867 [0,0,0,0,0,2|2,0,0]=4 1693 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O MCULE-5846714028 [0,0,0,0,0,2|1,0,0]=3 1694 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O MCULE-6298102909 [0,0,0,0,0,2|1,0,0]=3 1695 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O MCULE-6801867186 [0,0,0,0,0,2|1,0,0]=3 1696 B13R1.351 NC(CCC1=CC=CC=N1)C(=O)O MCULE-3457547807 [0,0,0,0,0,2|1,0,0]=3 1697 B13R1.351 NC(CCC1=CC=CC=N1)C(=O)O MCULE-8849197069 [0,0,0,0,0,2|1,0,0]=3 1698 B13R1.351 NC(CCC1=CC=NC=C1)C(=O)O MCULE-3830291208 [0,0,0,0,0,2|1,0,0]=3 1699 B13R1.351 NC(CCC1=CC=NC=C1)C(=O)O MCULE-7407312060 [0,0,0,0,0,2|1,0,0]=3 1700 B13R1.351 NC(CNC1=CC=CC=C1)C(=O)O MCULE-6123987164 [0,0,0,0,0,2|1,0,0]=3 1701 B13R1.351 NC(COC1=CC=CC=C1)C(=O)O MCULE-1983365366 [0,0,0,0,0,2|1,0,0]=3 1702 B13R1.351 NC(CSC1=CC=CC=C1)C(=O)O MCULE-1203820662 [0,0,0,0,0,2|1,0,0]=3 1703 B13R1.351 NC(CSC1=CC=CC=C1)C(=O)O MCULE-9787337080 [0,0,0,0,0,2|1,0,0]=3 1704 B13R1.351 NC(CSC1=CC=NC=C1)C(=O)O MCULE-7653730988 [0,0,0,0,0,2|1,0,0]=3 1705 B13R1.351 N[C@@H](/C=C/C1=CC=CC=C1)C(=O)O MCULE-2838025018 [0,0,0,0,0,2|1,0,1]=4 1706 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O MCULE-4559879821 [0,0,0,0,0,2|1,0,0]=3 1707 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O MCULE-6703664755 [0,0,0,0,0,2|1,0,0]=3 1708 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O MCULE-6919063042 [0,0,0,0,0,2|1,0,0]=3 1709 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O MCULE-8742414639 [0,0,0,0,0,2|1,0,0]=3 1710 B13R1.351 N[C@@H](CNC1=CC=CC=C1)C(=O)O MCULE-8235847783 [0,0,0,0,0,2|1,0,0]=3 1711 B13R1.351 N[C@@H](COC1=CC=CC=C1)C(=O)O MCULE-3653516384 [0,0,0,0,0,2|1,0,0]=3 1712 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O MCULE-3064974464 [0,0,0,0,0,2|1,0,0]=3 1713 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O MCULE-7600953452 [0,0,0,0,0,2|1,0,0]=3 1714 B13R1.351 N[C@@H](C[Se]C1=CC=CC=C1)C(=O)O MCULE-2645239845 [0,0,0,0,0,2|1,0,0]=3 1715 B13R1.351 N[C@@H](C[Se]C1=CC=CC=C1)C(=O)O MCULE-2650735200 [0,0,0,0,0,2|1,0,0]=3 1716 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O MCULE-4182463122 [0,0,0,0,0,2|1,0,0]=3 1717 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O MCULE-5087054270 [0,0,0,0,0,2|1,0,0]=3 1718 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O MCULE-7679113471 [0,0,0,0,0,2|1,0,0]=3 1719 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O MCULE-7791619414 [0,0,0,0,0,2|1,0,0]=3 1720 B13R1.351 N[C@H](COC1=CC=CC=C1)C(=O)O MCULE-1181768450 [0,0,0,0,0,2|1,0,0]=3 1721 B13R1.351 N[C@H](COC1=CC=CC=C1)C(=O)O MCULE-2658156823 [0,0,0,0,0,2|1,0,0]=3 1722 B13R1.351 N[C@H](CSC1=CC=CC=C1)C(=O)O MCULE-7999236192 [0,0,0,0,0,2|1,0,0]=3 1723 B13R1.351 O=C(O)C(Br)CCC1=CC=CC=C1 MCULE-5292402211 [0,0,0,0,0,2|2,0,0]=4 1724 B13R1.351 O=C(O)C(O)CCC1=CC=CC=C1 MCULE-4257585560 [0,0,0,0,0,2|2,0,0]=4 1725 B13R1.351 O=C(O)C(O)CCC1=CC=CC=C1 MCULE-5664756838 [0,0,0,0,0,2|2,0,0]=4 1726 B13R1.351 O=C(O)[C@@H](O)CCC1=CC=CC=C1 MCULE-5061224318 [0,0,0,0,0,2|2,0,0]=4 1727 B13R1.351 O=C(O)[C@@H](O)CCC1=CC=CC=C1 MCULE-8347273271 [0,0,0,0,0,2|2,0,0]=4 1728 B13R1.351 O=C(O)[C@H](O)CCC1=CC=CC=C1 MCULE-2268613096 [0,0,0,0,0,2|2,0,0]=4 1729 B13R1.351 O=C(O)[C@H](O)CCC1=CC=CC=C1 MCULE-9835086512 [0,0,0,0,0,2|2,0,0]=4