0 B11R1.35 C=C(CN1C=CN=C1)C(=O)O MCULE-9361775395 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.35 CC(=O)C(N)CC1=CN=CN1 MCULE-6260192166 [0,0,0,0,0,0|1,0,0]=1 2 B11R1.35 CC(=O)C(N)CC1=CN=CN1 MCULE-9245260061 [0,0,0,0,0,0|1,0,0]=1 3 B11R1.35 CC(CC1=CC=CN1)C(=O)O MCULE-7927079223 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.35 CC(CC1=CC=CO1)C(=O)O MCULE-4967866488 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.35 CC(CC1=CC=CS1)C(=O)O MCULE-1903423673 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.35 CC(CC1=CN=CN1)C(=O)O MCULE-2039778007 [0,0,0,0,0,0|1,0,0]=1 7 B11R1.35 CC(CC1=CN=CN1)C(=O)O MCULE-8694921132 [0,0,0,0,0,0|1,0,0]=1 8 B11R1.35 CC(CC1=CSC=C1)C(=O)O MCULE-9064961209 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.35 CC(CN1C=CC=N1)C(=O)O MCULE-5293945141 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.35 CC(CN1C=CN=C1)C(=O)O MCULE-3369493356 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.35 CC(CN1C=CN=C1)C(=O)O MCULE-8150283325 [0,0,0,0,0,0|3,0,0]=3 12 B11R1.35 CC(CN1C=NC=N1)C(=O)O MCULE-5941102084 [0,0,0,0,0,0|2,0,1]=3 13 B11R1.35 CC(SC1=CC=CS1)C(=O)O MCULE-5785755939 [0,0,0,0,0,0|4,0,0]=4 14 B11R1.35 CC(SC1=NC=NN1)C(=O)O MCULE-2004966643 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.35 CC(SC1=NN=NN1)C(=O)O MCULE-6144732752 [0,0,0,0,0,0|4,0,0]=4 16 B11R1.35 C[C@H](NC1=CC=CO1)C(=O)O MCULE-9956836124 [0,0,0,0,0,0|4,0,0]=4 17 B11R1.35 C[C@H](NC1=CSC=C1)C(=O)O MCULE-2855153207 [0,0,0,0,0,0|4,0,0]=4 18 B11R1.35 C[C@H](NC1=CSC=N1)C(=O)O MCULE-5434211661 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.35 NC(=O)C(N)CC1=CN=CN1 MCULE-3271168780 [0,0,0,0,0,0|1,0,0]=1 20 B11R1.35 NC(=O)C(N)CC1=CN=CN1 MCULE-8656151994 [0,0,0,0,0,0|1,0,0]=1 21 B11R1.35 NC(=O)C(N)CN1C=CC=N1 MCULE-8350079593 [0,0,0,0,0,0|3,0,1]=4 22 B11R1.35 NC(=O)C(N)CN1C=CN=C1 MCULE-5591969646 [0,0,0,0,0,0|3,0,0]=3 23 B11R1.35 NC(=O)[C@@H](N)CC1=CN=CN1 MCULE-6359300232 [0,0,0,0,0,0|1,0,0]=1 24 B11R1.35 NC(=O)[C@@H](N)CC1=CN=CN1 MCULE-8961824149 [0,0,0,0,0,0|1,0,0]=1 25 B11R1.35 NC(=O)[C@@H](N)CC1=CNC=N1 MCULE-4694791114 [0,0,0,0,0,0|1,0,2]=3 26 B11R1.35 NC(=O)[C@@H](N)CC1=CNC=N1 MCULE-8086406127 [0,0,0,0,0,0|1,0,2]=3 27 B11R1.35 NC(CC1=CC=CN1)C(=O)O MCULE-2621735129 [0,0,0,0,0,0|1,0,0]=1 28 B11R1.35 NC(CC1=CC=CO1)C(=O)O MCULE-2615027072 [0,0,0,0,0,0|2,0,0]=2 29 B11R1.35 NC(CC1=CC=CO1)C(=O)O MCULE-5961212744 [0,0,0,0,0,0|2,0,0]=2 30 B11R1.35 NC(CC1=CC=CS1)C(=O)O MCULE-3785172886 [0,0,0,0,0,0|2,0,0]=2 31 B11R1.35 NC(CC1=CC=CS1)C(=O)O MCULE-8923550765 [0,0,0,0,0,0|2,0,0]=2 32 B11R1.35 NC(CC1=CCCC1)C(=O)O MCULE-1666440268 [0,0,0,0,0,0|2,0,1]=3 33 B11R1.35 NC(CC1=CN=CN1)C(=O)O MCULE-2221977105 [0,0,0,0,0,0|0,0,0]=0 34 B11R1.35 NC(CC1=CN=CN1)C(=O)O MCULE-4252889481 [0,0,0,0,0,0|0,0,0]=0 35 B11R1.35 NC(CC1=CN=CS1)C(=O)O MCULE-3561723067 [0,0,0,0,0,0|1,0,0]=1 36 B11R1.35 NC(CC1=CN=CS1)C(=O)O MCULE-7849285080 [0,0,0,0,0,0|1,0,0]=1 37 B11R1.35 NC(CC1=CN=CS1)C(=O)O MCULE-8240594688 [0,0,0,0,0,0|1,0,0]=1 38 B11R1.35 NC(CC1=CNC=C1)C(=O)O MCULE-9864992308 [0,0,0,0,0,0|1,0,1]=2 39 B11R1.35 NC(CC1=CNC=N1)C(=O)O MCULE-2923626784 [0,0,0,0,0,0|0,0,2]=2 40 B11R1.35 NC(CC1=CNC=N1)C(=O)O MCULE-6787534916 [0,0,0,0,0,0|0,0,2]=2 41 B11R1.35 NC(CC1=CNC=N1)C(=O)O MCULE-7525765487 [0,0,0,0,0,0|0,0,2]=2 42 B11R1.35 NC(CC1=COC=C1)C(=O)O MCULE-9216668765 [0,0,0,0,0,0|2,0,0]=2 43 B11R1.35 NC(CC1=CSC=C1)C(=O)O MCULE-9320828043 [0,0,0,0,0,0|2,0,0]=2 44 B11R1.35 NC(CC1=CSC=C1)C(=O)O MCULE-9372566296 [0,0,0,0,0,0|2,0,0]=2 45 B11R1.35 NC(CC1=CSC=N1)C(=O)O MCULE-2390356050 [0,0,0,0,0,0|1,0,1]=2 46 B11R1.35 NC(CC1=CSC=N1)C(=O)O MCULE-6340376441 [0,0,0,0,0,0|1,0,1]=2 47 B11R1.35 NC(CC1=CSC=N1)C(=O)O MCULE-7084475028 [0,0,0,0,0,0|1,0,1]=2 48 B11R1.35 NC(CC1=NC=CS1)C(=O)O MCULE-2355445124 [0,0,0,0,0,0|2,0,1]=3 49 B11R1.35 NC(CC1=NC=CS1)C(=O)O MCULE-8413492225 [0,0,0,0,0,0|2,0,1]=3 50 B11R1.35 NC(CC1=NN=CN1)C(=O)O MCULE-9972656521 [0,0,0,0,0,0|1,0,0]=1 51 B11R1.35 NC(CC1=NNC=C1)C(=O)O MCULE-8341443044 [0,0,0,0,0,0|2,0,1]=3 52 B11R1.35 NC(CC1=NNC=C1)C(=O)O MCULE-9363176690 [0,0,0,0,0,0|2,0,1]=3 53 B11R1.35 NC(CC1=NNC=N1)C(=O)O MCULE-8826640392 [0,0,0,0,0,0|1,0,2]=3 54 B11R1.35 NC(CN1C=CC=C1)C(=O)O MCULE-6420960159 [0,0,0,0,0,0|3,0,0]=3 55 B11R1.35 NC(CN1C=CC=N1)C(=O)O MCULE-3059611601 [0,0,0,0,0,0|2,0,1]=3 56 B11R1.35 NC(CN1C=CC=N1)C(=O)O MCULE-9483519317 [0,0,0,0,0,0|2,0,1]=3 57 B11R1.35 NC(CN1C=CN=C1)C(=O)O MCULE-2613680512 [0,0,0,0,0,0|2,0,0]=2 58 B11R1.35 NC(CN1C=NC=N1)C(=O)O MCULE-4430137430 [0,0,0,0,0,0|1,0,1]=2 59 B11R1.35 NC(CN1C=NC=N1)C(=O)O MCULE-7109186760 [0,0,0,0,0,0|1,0,1]=2 60 B11R1.35 NC(CN1N=CN=N1)C(=O)O MCULE-1580681279 [0,0,0,0,0,0|2,0,1]=3 61 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O MCULE-2369724288 [0,0,0,0,0,0|2,0,0]=2 62 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O MCULE-5803182238 [0,0,0,0,0,0|2,0,0]=2 63 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O MCULE-5920888333 [0,0,0,0,0,0|2,0,0]=2 64 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O MCULE-9717464601 [0,0,0,0,0,0|2,0,0]=2 65 B11R1.35 N[C@@H](CC1=CC=CS1)C(=O)O MCULE-3425714606 [0,0,0,0,0,0|2,0,0]=2 66 B11R1.35 N[C@@H](CC1=CC=CS1)C(=O)O MCULE-7666246740 [0,0,0,0,0,0|2,0,0]=2 67 B11R1.35 N[C@@H](CC1=CC=CS1)C(=O)O MCULE-8908733986 [0,0,0,0,0,0|2,0,0]=2 68 B11R1.35 N[C@@H](CC1=CCCC1)C(=O)O MCULE-1528714518 [0,0,0,0,0,0|2,0,1]=3 69 B11R1.35 N[C@@H](CC1=CCCC1)C(=O)O MCULE-5537876142 [0,0,0,0,0,0|2,0,1]=3 70 B11R1.35 N[C@@H](CC1=CN=CN1)C(=O)O MCULE-2087791673 [0,0,0,0,0,0|0,0,0]=0 71 B11R1.35 N[C@@H](CC1=CNC=C1)C(=O)O MCULE-7031820503 [0,0,0,0,0,0|1,0,1]=2 72 B11R1.35 N[C@@H](CC1=CNC=N1)C(=O)O MCULE-1155454458 [0,0,0,0,0,0|0,0,2]=2 73 B11R1.35 N[C@@H](CC1=CNC=N1)C(=O)O MCULE-4083000888 [0,0,0,0,0,0|0,0,2]=2 74 B11R1.35 N[C@@H](CC1=CNC=N1)C(=O)O MCULE-5599456266 [0,0,0,0,0,0|0,0,2]=2 75 B11R1.35 N[C@@H](CC1=CNC=N1)C(=O)O MCULE-7458236044 [0,0,0,0,0,0|0,0,2]=2 76 B11R1.35 N[C@@H](CC1=CNC=N1)C(=O)O MCULE-9282849595 [0,0,0,0,0,0|0,0,2]=2 77 B11R1.35 N[C@@H](CC1=CNC=N1)C(=O)O MCULE-9753735240 [0,0,0,0,0,0|0,0,2]=2 78 B11R1.35 N[C@@H](CC1=COC=C1)C(=O)O MCULE-1840395119 [0,0,0,0,0,0|2,0,0]=2 79 B11R1.35 N[C@@H](CC1=COC=C1)C(=O)O MCULE-2068883490 [0,0,0,0,0,0|2,0,0]=2 80 B11R1.35 N[C@@H](CC1=COC=C1)C(=O)O MCULE-2075437924 [0,0,0,0,0,0|2,0,0]=2 81 B11R1.35 N[C@@H](CC1=COC=C1)C(=O)O MCULE-5577531277 [0,0,0,0,0,0|2,0,0]=2 82 B11R1.35 N[C@@H](CC1=CSC=C1)C(=O)O MCULE-1834983933 [0,0,0,0,0,0|2,0,0]=2 83 B11R1.35 N[C@@H](CC1=CSC=N1)C(=O)O MCULE-2668036247 [0,0,0,0,0,0|1,0,1]=2 84 B11R1.35 N[C@@H](CC1=CSC=N1)C(=O)O MCULE-5714524091 [0,0,0,0,0,0|1,0,1]=2 85 B11R1.35 N[C@@H](CN1C=CC=N1)C(=O)O MCULE-1297692188 [0,0,0,0,0,0|2,0,1]=3 86 B11R1.35 N[C@@H](CN1C=CC=N1)C(=O)O MCULE-1796607981 [0,0,0,0,0,0|2,0,1]=3 87 B11R1.35 N[C@@H](CN1C=CC=N1)C(=O)O MCULE-3328462551 [0,0,0,0,0,0|2,0,1]=3 88 B11R1.35 N[C@@H](CN1C=CC=N1)C(=O)O MCULE-6620872920 [0,0,0,0,0,0|2,0,1]=3 89 B11R1.35 N[C@@H](CN1C=CN=C1)C(=O)O MCULE-9858220492 [0,0,0,0,0,0|2,0,0]=2 90 B11R1.35 N[C@@H](CN1C=NN=N1)C(=O)O MCULE-4182756652 [0,0,0,0,0,0|2,0,1]=3 91 B11R1.35 N[C@H](CC1=CC=CN1)C(=O)O MCULE-8757725265 [0,0,0,0,0,0|1,0,0]=1 92 B11R1.35 N[C@H](CC1=CC=CO1)C(=O)O MCULE-2460207628 [0,0,0,0,0,0|2,0,0]=2 93 B11R1.35 N[C@H](CC1=CC=CO1)C(=O)O MCULE-6984530934 [0,0,0,0,0,0|2,0,0]=2 94 B11R1.35 N[C@H](CC1=CC=CS1)C(=O)O MCULE-6753547229 [0,0,0,0,0,0|2,0,0]=2 95 B11R1.35 N[C@H](CC1=CC=CS1)C(=O)O MCULE-9975284076 [0,0,0,0,0,0|2,0,0]=2 96 B11R1.35 N[C@H](CC1=CN=CS1)C(=O)O MCULE-8243476757 [0,0,0,0,0,0|1,0,0]=1 97 B11R1.35 N[C@H](CC1=CNC=C1)C(=O)O MCULE-9800775235 [0,0,0,0,0,0|1,0,1]=2 98 B11R1.35 N[C@H](CC1=CNC=N1)C(=O)O MCULE-2877373266 [0,0,0,0,0,0|0,0,2]=2 99 B11R1.35 N[C@H](CC1=CNC=N1)C(=O)O MCULE-4994851602 [0,0,0,0,0,0|0,0,2]=2 100 B11R1.35 N[C@H](CC1=CNC=N1)C(=O)O MCULE-9609124805 [0,0,0,0,0,0|0,0,2]=2 101 B11R1.35 N[C@H](CC1=COC=C1)C(=O)O MCULE-2930337657 [0,0,0,0,0,0|2,0,0]=2 102 B11R1.35 N[C@H](CC1=COC=C1)C(=O)O MCULE-3084219342 [0,0,0,0,0,0|2,0,0]=2 103 B11R1.35 N[C@H](CC1=COC=C1)C(=O)O MCULE-4905195149 [0,0,0,0,0,0|2,0,0]=2 104 B11R1.35 N[C@H](CC1=COC=C1)C(=O)O MCULE-5383024553 [0,0,0,0,0,0|2,0,0]=2 105 B11R1.35 N[C@H](CC1=CSC=C1)C(=O)O MCULE-1622837336 [0,0,0,0,0,0|2,0,0]=2 106 B11R1.35 N[C@H](CC1=CSC=C1)C(=O)O MCULE-4992429415 [0,0,0,0,0,0|2,0,0]=2 107 B11R1.35 N[C@H](CC1=CSC=C1)C(=O)O MCULE-8070611987 [0,0,0,0,0,0|2,0,0]=2 108 B11R1.35 N[C@H](CC1=CSC=C1)C(=O)O MCULE-8506384635 [0,0,0,0,0,0|2,0,0]=2 109 B11R1.35 N[C@H](CC1=CSC=N1)C(=O)O MCULE-1425018039 [0,0,0,0,0,0|1,0,1]=2 110 B11R1.35 N[C@H](CC1=CSC=N1)C(=O)O MCULE-9292185704 [0,0,0,0,0,0|1,0,1]=2 111 B11R1.35 N[C@H](CC1=NNC=N1)C(=O)O MCULE-2637030444 [0,0,0,0,0,0|1,0,2]=3 112 B11R1.35 N[C@H](CN1C=CN=C1)C(=O)O MCULE-2628582629 [0,0,0,0,0,0|2,0,0]=2 113 B11R1.35 O=C(O)C(=O)CC1=CC=CS1 MCULE-8806340356 [0,0,0,0,0,0|3,0,1]=4 114 B11R1.35 O=C(O)C(=O)CC1=CNC=N1 MCULE-3580978419 [0,0,0,0,0,0|1,0,3]=4 115 B11R1.35 O=C(O)C(Br)CC1=CN=CN1 MCULE-6042646005 [0,0,0,0,0,0|1,0,0]=1 116 B11R1.35 O=C(O)C(Cl)CN1C=CC=N1 MCULE-3448055509 [0,0,0,0,0,0|3,0,1]=4 117 B11R1.35 O=C(O)C(Cl)CN1C=NC=N1 MCULE-5595714575 [0,0,0,0,0,0|2,0,1]=3 118 B11R1.35 O=C(O)C(O)CC1=CC=CS1 MCULE-5295998672 [0,0,0,0,0,0|3,0,0]=3 119 B11R1.35 O=C(O)C(O)CC1=CN=CN1 MCULE-9405168040 [0,0,0,0,0,0|1,0,0]=1 120 B11R1.35 O=C(O)C(O)CN1C=CC=C1 MCULE-9216638920 [0,0,0,0,0,0|4,0,0]=4 121 B11R1.35 O=C(O)C(O)CN1C=CC=N1 MCULE-6573112131 [0,0,0,0,0,0|3,0,1]=4 122 B11R1.35 O=C(O)C(O)CN1C=CN=C1 MCULE-7247806406 [0,0,0,0,0,0|3,0,0]=3 123 B11R1.35 O=C(O)C(O)CN1C=NC=N1 MCULE-3781095446 [0,0,0,0,0,0|2,0,1]=3 124 B11R1.35 O=C(O)[C@@H](O)CC1=CNC=N1 MCULE-9508991160 [0,0,0,0,0,0|1,0,2]=3 125 B11R1.35 [C@H](N)(CC1=CSC=C1)C(=O)O MCULE-3699138278 [0,0,0,0,0,0|2,0,0]=2 126 B10R1.27 NC(CO)CC1=CC=CS1 MCULE-2524418000 [1,0,0,0,0,0|2,0,1]=4 127 B10R1.27 NC(CO)CC1=CC=CS1 MCULE-8198609380 [1,0,0,0,0,0|2,0,1]=4 128 B10R1.27 NC(CO)CC1=CN=CN1 MCULE-7235835981 [1,0,0,0,0,0|0,0,1]=2 129 B10R1.27 NC(CO)CC1=CN=CS1 MCULE-5544290114 [1,0,0,0,0,0|1,0,1]=3 130 B10R1.27 NC(CO)CC1=CN=CS1 MCULE-7214167079 [1,0,0,0,0,0|1,0,1]=3 131 B10R1.27 NC(CO)CC1=CNC=N1 MCULE-6372320124 [1,0,0,0,0,0|0,0,3]=4 132 B10R1.27 NC(CO)CC1=CNC=N1 MCULE-6514676641 [1,0,0,0,0,0|0,0,3]=4 133 B10R1.27 NC(CO)CC1=CNC=N1 MCULE-7997190567 [1,0,0,0,0,0|0,0,3]=4 134 B10R1.27 NC(CO)CC1=CNC=N1 MCULE-9281041619 [1,0,0,0,0,0|0,0,3]=4 135 B10R1.27 NC(CO)CN1C=CN=C1 MCULE-5503394613 [1,0,0,0,0,0|2,0,1]=4 136 B10R1.27 NC(CO)CN1C=NC=N1 MCULE-6917159148 [1,0,0,0,0,0|1,0,2]=4 137 B10R1.27 N[C@@H](CO)CC1=CNC=N1 MCULE-2195648856 [1,0,0,0,0,0|0,0,3]=4 138 B10R1.27 N[C@@H](CO)CC1=CNC=N1 MCULE-5523226969 [1,0,0,0,0,0|0,0,3]=4 139 B10R1.27 N[C@@H](CO)CC1=CNC=N1 MCULE-7842287861 [1,0,0,0,0,0|0,0,3]=4 140 B10R1.27 N[C@@H](CO)CC1=CNC=N1 MCULE-8131511898 [1,0,0,0,0,0|0,0,3]=4 141 B10R1.27 N[C@H](CO)CC1=CC=CS1 MCULE-8545709400 [1,0,0,0,0,0|2,0,1]=4 142 B10R1.27 N[C@H](CO)CC1=CN=CN1 MCULE-8732814122 [1,0,0,0,0,0|0,0,1]=2 143 B10R1.27 N[C@H](CO)CC1=CNC=N1 MCULE-4462090976 [1,0,0,0,0,0|0,0,3]=4 144 B10R1.27 N[C@H](CO)CC1=CNC=N1 MCULE-6352007011 [1,0,0,0,0,0|0,0,3]=4 145 B10R1.27 N[C@H](CO)CC1=CNC=N1 MCULE-7157632202 [1,0,0,0,0,0|0,0,3]=4 146 B10R1.27 N[C@H](CO)CC1=CNC=N1 MCULE-7447304629 [1,0,0,0,0,0|0,0,3]=4 147 B10R1.66 CC(=O)CCC1=CC=CO1 MCULE-2101099047 [1,0,0,0,0,0|3,0,0]=4 148 B10R1.66 CC(=O)CCC1=CSC=C1 MCULE-1818012086 [1,0,0,0,0,0|3,0,0]=4 149 B10R1.66 CC(=O)CCN1C=NC=N1 MCULE-7735668562 [1,0,0,0,0,0|2,0,1]=4 150 B10R1.66 NC(=O)CCN1C=CN=C1 MCULE-1329355900 [1,0,0,0,0,0|3,0,0]=4 151 B10R1.66 O=C(Cl)CCC1=CC=CS1 MCULE-7371256050 [1,0,0,0,0,0|3,0,0]=4 152 B10R1.66 O=C(O)/C=C/C1=CN=CS1 MCULE-7572472922 [1,0,0,0,0,0|1,0,2]=4 153 B10R1.66 O=C(O)/C=C\C1=CN=CN1 MCULE-7236014213 [1,0,0,0,0,0|0,0,2]=3 154 B10R1.66 O=C(O)C=CC1=CC=CN1 MCULE-5460570885 [1,0,0,0,0,0|1,0,2]=4 155 B10R1.66 O=C(O)C=CC1=CN=CS1 MCULE-7641560153 [1,0,0,0,0,0|1,0,2]=4 156 B10R1.66 O=C(O)CCC1=CC=CN1 MCULE-8495580718 [1,0,0,0,0,0|1,0,0]=2 157 B10R1.66 O=C(O)CCC1=CC=CO1 MCULE-3535606082 [1,0,0,0,0,0|2,0,0]=3 158 B10R1.66 O=C(O)CCC1=CC=CS1 MCULE-3548538547 [1,0,0,0,0,0|2,0,0]=3 159 B10R1.66 O=C(O)CCC1=CC=NO1 MCULE-2698728972 [1,0,0,0,0,0|2,0,0]=3 160 B10R1.66 O=C(O)CCC1=CN=CS1 MCULE-2668820713 [1,0,0,0,0,0|1,0,0]=2 161 B10R1.66 O=C(O)CCC1=CN=CS1 MCULE-7272215073 [1,0,0,0,0,0|1,0,0]=2 162 B10R1.66 O=C(O)CCC1=CNC=C1 MCULE-9116858435 [1,0,0,0,0,0|1,0,1]=3 163 B10R1.66 O=C(O)CCC1=CNC=N1 MCULE-3618491840 [1,0,0,0,0,0|0,0,2]=3 164 B10R1.66 O=C(O)CCC1=CNC=N1 MCULE-8133590347 [1,0,0,0,0,0|0,0,2]=3 165 B10R1.66 O=C(O)CCC1=CNN=C1 MCULE-1705333891 [1,0,0,0,0,0|2,0,0]=3 166 B10R1.66 O=C(O)CCC1=CNN=C1 MCULE-4996856052 [1,0,0,0,0,0|2,0,0]=3 167 B10R1.66 O=C(O)CCC1=CNN=N1 MCULE-2306529453 [1,0,0,0,0,0|1,0,2]=4 168 B10R1.66 O=C(O)CCC1=CNN=N1 MCULE-3429425016 [1,0,0,0,0,0|1,0,2]=4 169 B10R1.66 O=C(O)CCC1=COC=C1 MCULE-6225332803 [1,0,0,0,0,0|2,0,0]=3 170 B10R1.66 O=C(O)CCC1=CON=C1 MCULE-7141916112 [1,0,0,0,0,0|2,0,0]=3 171 B10R1.66 O=C(O)CCC1=CSC=C1 MCULE-5919306548 [1,0,0,0,0,0|2,0,0]=3 172 B10R1.66 O=C(O)CCC1=CSC=N1 MCULE-3188158342 [1,0,0,0,0,0|1,0,1]=3 173 B10R1.66 O=C(O)CCC1=NC=CN1 MCULE-8831721107 [1,0,0,0,0,0|2,0,0]=3 174 B10R1.66 O=C(O)CCC1=NC=CN1 MCULE-8898977198 [1,0,0,0,0,0|2,0,0]=3 175 B10R1.66 O=C(O)CCC1=NC=CO1 MCULE-8621379865 [1,0,0,0,0,0|2,0,1]=4 176 B10R1.66 O=C(O)CCC1=NC=CS1 MCULE-2473180013 [1,0,0,0,0,0|2,0,1]=4 177 B10R1.66 O=C(O)CCC1=NN=CN1 MCULE-9236882970 [1,0,0,0,0,0|1,0,0]=2 178 B10R1.66 O=C(O)CCC1=NN=NN1 MCULE-6294034422 [1,0,0,0,0,0|2,0,0]=3 179 B10R1.66 O=C(O)CCC1=NOC=C1 MCULE-7542127444 [1,0,0,0,0,0|2,0,1]=4 180 B10R1.66 O=C(O)CCN1C=CC=C1 MCULE-8640172862 [1,0,0,0,0,0|3,0,0]=4 181 B10R1.66 O=C(O)CCN1C=CC=N1 MCULE-3245420562 [1,0,0,0,0,0|2,0,1]=4 182 B10R1.66 O=C(O)CCN1C=CC=N1 MCULE-7345461411 [1,0,0,0,0,0|2,0,1]=4 183 B10R1.66 O=C(O)CCN1C=CN=C1 MCULE-9380136310 [1,0,0,0,0,0|2,0,0]=3 184 B10R1.66 O=C(O)CCN1C=CN=N1 MCULE-4035524586 [1,0,0,0,0,0|3,0,0]=4 185 B10R1.66 O=C(O)CCN1C=CN=N1 MCULE-9295640009 [1,0,0,0,0,0|3,0,0]=4 186 B10R1.66 O=C(O)CCN1C=C[NH+]=C1 MCULE-7376823159 [1,0,0,0,0,0|2,0,1]=4 187 B10R1.66 O=C(O)CCN1C=NC=N1 MCULE-5526368399 [1,0,0,0,0,0|1,0,1]=3 188 B10R1.66 O=C(O)CCN1C=NN=C1 MCULE-5584916896 [1,0,0,0,0,0|3,0,0]=4 189 B10R1.66 O=C(O)CCN1C=NN=C1 MCULE-6356200855 [1,0,0,0,0,0|3,0,0]=4 190 B10R1.66 O=C(O)CCN1C=NN=N1 MCULE-9989601118 [1,0,0,0,0,0|2,0,1]=4 191 B10R1.66 O=C(O)CNC1=CSC=C1 MCULE-7792185653 [1,0,0,0,0,0|3,0,0]=4 192 B10R1.66 O=C(O)COC1=CSC=C1 MCULE-1973135166 [1,0,0,0,0,0|3,0,0]=4 193 B10R1.66 O=C(O)CSC1=CC=CS1 MCULE-4950567579 [1,0,0,0,0,0|3,0,0]=4 194 B10R1.66 O=C(O)CSC1=NN=CN1 MCULE-1264265063 [1,0,0,0,0,0|2,0,0]=3 195 B10R1.66 O=C(O)CSC1=NN=CS1 MCULE-1744708192 [1,0,0,0,0,0|3,0,0]=4 196 B12R1.104 CC(CC1=CC=C(S1)Cl)C(=O)O MCULE-8162537073 [0,1,0,0,0,0|3,0,0]=4 197 B12R1.104 CC(CC1=CN(N=C1)C)C(=O)O MCULE-9100374089 [0,1,0,0,0,0|3,0,0]=4 198 B12R1.104 CC(CN1C=NC(=N1)N)C(=O)O MCULE-1202772685 [0,1,0,0,0,0|2,0,1]=4 199 B12R1.104 CC1=CC=C(O1)CC(C)C(=O)O MCULE-9134789589 [0,1,0,0,0,0|3,0,0]=4 200 B12R1.104 CC1=CC=C(S1)CC(C)C(=O)O MCULE-3637404220 [0,1,0,0,0,0|3,0,0]=4 201 B12R1.104 CC1=CC=C(S1)CC(N)C(=O)O MCULE-7413117787 [0,1,0,0,0,0|2,0,0]=3 202 B12R1.104 CC1=CN(N=C1)CC(N)C(=O)O MCULE-3294035463 [0,1,0,0,0,0|2,0,1]=4 203 B12R1.104 CC1=CN(N=C1)CC(N)C(=O)O MCULE-6388981895 [0,1,0,0,0,0|2,0,1]=4 204 B12R1.104 CN1C=C(C=N1)CC(N)C(=O)O MCULE-1082285581 [0,1,0,0,0,0|2,0,0]=3 205 B12R1.104 CN1C=C(C=N1)CC(N)C(=O)O MCULE-2929142322 [0,1,0,0,0,0|2,0,0]=3 206 B12R1.104 CN1C=C(C=N1)CC(O)C(=O)O MCULE-7597905346 [0,1,0,0,0,0|3,0,0]=4 207 B12R1.104 CN1C=NC(=C1)CC(N)C(=O)O MCULE-5486079144 [0,1,0,0,0,0|0,0,2]=3 208 B12R1.104 CN1C=NC(=C1)C[C@@H](N)C(=O)O MCULE-3613192458 [0,1,0,0,0,0|0,0,2]=3 209 B12R1.104 CN1C=NC(=C1)C[C@@H](N)C(=O)O MCULE-8344880310 [0,1,0,0,0,0|0,0,2]=3 210 B12R1.104 CN1C=NC(=C1)C[C@@H](N)C(=O)O MCULE-8858003477 [0,1,0,0,0,0|0,0,2]=3 211 B12R1.104 CN1C=NC(=C1)C[C@H](N)C(=O)O MCULE-3965514306 [0,1,0,0,0,0|0,0,2]=3 212 B12R1.104 CN1C=NC(=C1)C[C@H](N)C(=O)O MCULE-4475333124 [0,1,0,0,0,0|0,0,2]=3 213 B12R1.104 CN1C=NC(=C1)C[C@H](N)C(=O)O MCULE-5149650387 [0,1,0,0,0,0|0,0,2]=3 214 B12R1.104 CN1C=NC(=C1)C[C@H](N)C(=O)O MCULE-9575114305 [0,1,0,0,0,0|0,0,2]=3 215 B12R1.104 NC(CC1=CC=C(S1)Br)C(=O)O MCULE-5965522969 [0,1,0,0,0,0|2,0,0]=3 216 B12R1.104 NC(CC1=CC=C(S1)Br)C(=O)O MCULE-6703511722 [0,1,0,0,0,0|2,0,0]=3 217 B12R1.104 NC(CC1=CN=C(N1)F)C(=O)O MCULE-4832311809 [0,1,0,0,0,0|0,0,0]=1 218 B12R1.104 NC(CC1=CNC(=N1)S)C(=O)O MCULE-9465947211 [0,1,0,0,0,0|0,0,2]=3 219 B12R1.104 NC(CC1=NC(=S)N=C1)C(=O)O MCULE-8976370172 [0,1,0,0,0,0|0,0,1]=2 220 B12R1.104 NC(CN1C=C(C=N1)Br)C(=O)O MCULE-1728546369 [0,1,0,0,0,0|2,0,1]=4 221 B12R1.104 NC(CN1C=C(C=N1)Br)C(=O)O MCULE-7283744620 [0,1,0,0,0,0|2,0,1]=4 222 B12R1.104 NC(CN1C=C(C=N1)Cl)C(=O)O MCULE-3067894787 [0,1,0,0,0,0|2,0,1]=4 223 B12R1.104 NC(CN1C=C(C=N1)Cl)C(=O)O MCULE-9192559156 [0,1,0,0,0,0|2,0,1]=4 224 B12R1.104 NC1=NC(=CN1)C[C@H](N)C(=O)O MCULE-6106532520 [0,1,0,0,0,0|0,0,2]=3 225 B12R1.104 N[C@@H](CC1=CC(=CS1)Br)C(=O)O MCULE-8498566253 [0,1,0,0,0,0|2,0,0]=3 226 B12R1.104 N[C@@H](CC1=CC=C(S1)Br)C(=O)O MCULE-3463438713 [0,1,0,0,0,0|2,0,0]=3 227 B12R1.104 N[C@@H](CC1=CC=C(S1)Br)C(=O)O MCULE-7727496077 [0,1,0,0,0,0|2,0,0]=3 228 B12R1.104 N[C@@H](CC1=CN=C(N1)F)C(=O)O MCULE-6234842384 [0,1,0,0,0,0|0,0,0]=1 229 B12R1.104 N[C@@H](CC1=CN=C(N1)I)C(=O)O MCULE-2987771351 [0,1,0,0,0,0|0,0,0]=1 230 B12R1.104 N[C@@H](CC1=CNC(=N1)O)C(=O)O MCULE-9186293071 [0,1,0,0,0,0|0,0,2]=3 231 B12R1.104 N[C@@H](CC1=CNC(=N1)S)C(=O)O MCULE-9093847859 [0,1,0,0,0,0|0,0,2]=3 232 B12R1.104 N[C@@H](CC1=CNC(=S)N1)C(=O)O MCULE-3988472498 [0,1,0,0,0,0|0,0,1]=2 233 B12R1.104 N[C@@H](CC1=NC(=S)N=C1)C(=O)O MCULE-9784169101 [0,1,0,0,0,0|0,0,1]=2 234 B12R1.104 N[C@H](CC1=CC=C(S1)Br)C(=O)O MCULE-3916316552 [0,1,0,0,0,0|2,0,0]=3 235 B12R1.104 N[C@H](CC1=CC=C(S1)Br)C(=O)O MCULE-9244913261 [0,1,0,0,0,0|2,0,0]=3 236 B12R1.104 N[C@H](CC1=CN=C(N1)F)C(=O)O MCULE-1359887597 [0,1,0,0,0,0|0,0,0]=1 237 B12R1.108 CNC(=O)[C@@H](N)CC1=CN=CN1 MCULE-5563608102 [0,1,0,0,0,0|1,0,0]=2 238 B12R1.108 CNC(=O)[C@@H](N)CC1=CNC=N1 MCULE-1233604567 [0,1,0,0,0,0|1,0,2]=4 239 B12R1.108 CNC(=O)[C@@H](N)CC1=CNC=N1 MCULE-8735746096 [0,1,0,0,0,0|1,0,2]=4 240 B12R1.108 COC(=O)C(C)CN1C=NC=N1 MCULE-4043694305 [0,1,0,0,0,0|2,0,1]=4 241 B12R1.108 COC(=O)C(C)SC1=NN=CN1 MCULE-9568326669 [0,1,0,0,0,0|3,0,0]=4 242 B12R1.108 COC(=O)C(N)CC1=CC=CO1 MCULE-7425094178 [0,1,0,0,0,0|2,0,0]=3 243 B12R1.108 COC(=O)C(N)CC1=CC=CS1 MCULE-6982143720 [0,1,0,0,0,0|2,0,0]=3 244 B12R1.108 COC(=O)C(N)CC1=CC=CS1 MCULE-8387363612 [0,1,0,0,0,0|2,0,0]=3 245 B12R1.108 COC(=O)C(N)CC1=CN=CS1 MCULE-5779450146 [0,1,0,0,0,0|1,0,0]=2 246 B12R1.108 COC(=O)C(N)CC1=CNC=N1 MCULE-1382272909 [0,1,0,0,0,0|0,0,2]=3 247 B12R1.108 COC(=O)C(N)CC1=CNC=N1 MCULE-9468241244 [0,1,0,0,0,0|0,0,2]=3 248 B12R1.108 COC(=O)C(N)CC1=CSC=N1 MCULE-4606210336 [0,1,0,0,0,0|1,0,1]=3 249 B12R1.108 COC(=O)C(N)CN1C=CC=N1 MCULE-8305136483 [0,1,0,0,0,0|2,0,1]=4 250 B12R1.108 COC(=O)C(N)CN1C=CC=N1 MCULE-9392205504 [0,1,0,0,0,0|2,0,1]=4 251 B12R1.108 COC(=O)C(N)CN1C=CN=C1 MCULE-8491062344 [0,1,0,0,0,0|2,0,0]=3 252 B12R1.108 COC(=O)C(N)CN1C=CN=C1 MCULE-9829482414 [0,1,0,0,0,0|2,0,0]=3 253 B12R1.108 COC(=O)C(N)CN1C=NC=N1 MCULE-1301127688 [0,1,0,0,0,0|1,0,1]=3 254 B12R1.108 COC(=O)C(N)CN1C=NC=N1 MCULE-7826787752 [0,1,0,0,0,0|1,0,1]=3 255 B12R1.108 COC(=O)[C@@H](N)CC1=CC=CO1 MCULE-4575656185 [0,1,0,0,0,0|2,0,0]=3 256 B12R1.108 COC(=O)[C@@H](N)CC1=CC=CO1 MCULE-7970765227 [0,1,0,0,0,0|2,0,0]=3 257 B12R1.108 COC(=O)[C@@H](N)CC1=CC=CS1 MCULE-2835282356 [0,1,0,0,0,0|2,0,0]=3 258 B12R1.108 COC(=O)[C@@H](N)CC1=CC=CS1 MCULE-3294290797 [0,1,0,0,0,0|2,0,0]=3 259 B12R1.108 COC(=O)[C@@H](N)CC1=CC=CS1 MCULE-5652908593 [0,1,0,0,0,0|2,0,0]=3 260 B12R1.108 COC(=O)[C@@H](N)CC1=CC=CS1 MCULE-9022594551 [0,1,0,0,0,0|2,0,0]=3 261 B12R1.108 COC(=O)[C@@H](N)CC1=CNC=N1 MCULE-2089031152 [0,1,0,0,0,0|0,0,2]=3 262 B12R1.108 COC(=O)[C@@H](N)CC1=CNC=N1 MCULE-3117511084 [0,1,0,0,0,0|0,0,2]=3 263 B12R1.108 COC(=O)[C@@H](N)CC1=CNC=N1 MCULE-6830070848 [0,1,0,0,0,0|0,0,2]=3 264 B12R1.108 COC(=O)[C@@H](N)CC1=CNC=N1 MCULE-7101749470 [0,1,0,0,0,0|0,0,2]=3 265 B12R1.108 COC(=O)[C@@H](N)CC1=CNC=N1 MCULE-8175090296 [0,1,0,0,0,0|0,0,2]=3 266 B12R1.108 COC(=O)[C@@H](N)CC1=CNN=C1 MCULE-5389770220 [0,1,0,0,0,0|2,0,0]=3 267 B12R1.108 COC(=O)[C@@H](N)CC1=CSC=C1 MCULE-6133111889 [0,1,0,0,0,0|2,0,0]=3 268 B12R1.108 COC(=O)[C@@H](N)CC1=CSC=C1 MCULE-8476662966 [0,1,0,0,0,0|2,0,0]=3 269 B12R1.108 COC(=O)[C@@H](N)CC1=CSC=C1 MCULE-8593400048 [0,1,0,0,0,0|2,0,0]=3 270 B12R1.108 COC(=O)[C@@H](N)CC1=NC=CS1 MCULE-1408218386 [0,1,0,0,0,0|2,0,1]=4 271 B12R1.108 COC(=O)[C@H](N)CC1=CC=CS1 MCULE-4014114104 [0,1,0,0,0,0|2,0,0]=3 272 B12R1.108 COC(=O)[C@H](N)CC1=CNC=N1 MCULE-3243651519 [0,1,0,0,0,0|0,0,2]=3 273 B12R1.108 COC(=O)[C@H](N)CC1=CNC=N1 MCULE-5122189343 [0,1,0,0,0,0|0,0,2]=3 274 B12R1.108 COC(=O)[C@H](N)CC1=CNC=N1 MCULE-6260177060 [0,1,0,0,0,0|0,0,2]=3 275 B12R1.108 COC(=O)[C@H](N)CC1=CNC=N1 MCULE-8406890275 [0,1,0,0,0,0|0,0,2]=3 276 B12R1.108 COC(=O)[C@H](N)CC1=CNN=C1 MCULE-6535862144 [0,1,0,0,0,0|2,0,0]=3 277 B12R1.108 COC(=O)[C@H](N)CC1=CSC=C1 MCULE-1233246484 [0,1,0,0,0,0|2,0,0]=3 278 B12R1.108 COC(=O)[C@H](N)CC1=NC=CS1 MCULE-1914931563 [0,1,0,0,0,0|2,0,1]=4 279 B12R1.108 [C@@H](N)(CC1=CNC=N1)C(=O)OC MCULE-1504920942 [0,1,0,0,0,0|0,0,2]=3 280 B12R1.108 [C@@H](N)(CC1=CNC=N1)C(=O)OC MCULE-3487476144 [0,1,0,0,0,0|0,0,2]=3 281 B12R1.108 [NH2+]1C=NC(=C1)CC(C(=O)OC)[NH3+] MCULE-5080231571 [0,1,0,0,0,0|0,0,3]=4 282 B12R1.120 C(N)(C(=O)O)C(O)C1=CC=CS1 MCULE-5580590169 [0,1,0,0,0,0|2,0,0]=3 283 B12R1.120 NC(C(=O)O)C(O)C1=CC=CO1 MCULE-8288781221 [0,1,0,0,0,0|2,0,0]=3 284 B12R1.120 N[C@H](C(=O)O)C(O)C1=CC=CS1 MCULE-6901102382 [0,1,0,0,0,0|2,0,0]=3 285 B12R1.145 CC(SC1=NN=CN1C)C(=O)O MCULE-6207725939 [0,1,0,0,0,0|3,0,0]=4 286 B12R1.145 CC1=C(SC=C1)CC(N)C(=O)O MCULE-6046203051 [0,1,0,0,0,0|2,0,0]=3 287 B12R1.145 CC1=C(SC=N1)CC(N)C(=O)O MCULE-4057990716 [0,1,0,0,0,0|1,0,0]=2 288 B12R1.145 CC1=NC=CN1CC(C)C(=O)O MCULE-6668260000 [0,1,0,0,0,0|3,0,0]=4 289 B12R1.145 CC1=NC=CN1CC(C)C(=O)O MCULE-9745829470 [0,1,0,0,0,0|3,0,0]=4 290 B12R1.145 CN1C=CN=C1CC(N)C(=O)O MCULE-3034963823 [0,1,0,0,0,0|2,0,0]=3 291 B12R1.145 CN1C=NC=C1CC(N)C(=O)O MCULE-1761463456 [0,1,0,0,0,0|0,0,0]=1 292 B12R1.145 CN1C=NC=C1CC(N)C(=O)O MCULE-8928603063 [0,1,0,0,0,0|0,0,0]=1 293 B12R1.145 CN1C=NC=C1C[C@@H](N)C(=O)O MCULE-6549131401 [0,1,0,0,0,0|0,0,0]=1 294 B12R1.145 CN1C=NC=C1C[C@@H](N)C(=O)O MCULE-7888445981 [0,1,0,0,0,0|0,0,0]=1 295 B12R1.145 CN1C=NC=C1C[C@H](N)C(=O)O MCULE-4604416706 [0,1,0,0,0,0|0,0,0]=1 296 B12R1.145 CN1C=NC=C1C[C@H](N)C(=O)O MCULE-9852133553 [0,1,0,0,0,0|0,0,0]=1 297 B12R1.145 NC(CC1=C(N=CN1)F)C(=O)O MCULE-7082079488 [0,1,0,0,0,0|0,0,0]=1 298 B12R1.145 N[C@@H](CC1=C(N=CN1)F)C(=O)O MCULE-8451688674 [0,1,0,0,0,0|0,0,0]=1 299 B12R1.145 N[C@H](CC1=C(N=CN1)F)C(=O)O MCULE-6441017949 [0,1,0,0,0,0|0,0,0]=1 300 B12R1.298 CCC(CC1=CC=CO1)C(=O)O MCULE-7903666102 [0,1,0,0,0,0|3,0,0]=4 301 B12R1.298 CCC(CC1=CC=CS1)C(=O)O MCULE-9874298852 [0,1,0,0,0,0|3,0,0]=4 302 B12R1.298 CCC(CC1=CSC=C1)C(=O)O MCULE-1201084026 [0,1,0,0,0,0|3,0,0]=4 303 B12R1.298 CNC(CC1=CNC=N1)C(=O)O MCULE-3468413328 [0,1,0,0,0,0|0,0,2]=3 304 B12R1.298 CNC(CC1=CNC=N1)C(=O)O MCULE-5120111645 [0,1,0,0,0,0|0,0,2]=3 305 B12R1.298 CNC(CC1=CNC=N1)C(=O)O MCULE-9037833083 [0,1,0,0,0,0|0,0,2]=3 306 B12R1.298 CNC(CN1C=CC=N1)C(=O)O MCULE-2312037192 [0,1,0,0,0,0|2,0,1]=4 307 B12R1.298 CNC(CN1C=CN=C1)C(=O)O MCULE-9844325577 [0,1,0,0,0,0|2,0,0]=3 308 B12R1.298 CN[C@@H](CC1=CNC=N1)C(=O)O MCULE-2344748112 [0,1,0,0,0,0|0,0,2]=3 309 B12R1.298 CN[C@@H](CC1=CNC=N1)C(=O)O MCULE-3787836793 [0,1,0,0,0,0|0,0,2]=3 310 B12R1.298 CN[C@@H](CC1=CNC=N1)C(=O)O MCULE-4956436206 [0,1,0,0,0,0|0,0,2]=3 311 B12R1.298 CN[C@@H](CC1=CNC=N1)C(=O)O MCULE-6672172984 [0,1,0,0,0,0|0,0,2]=3 312 B12R1.298 CN[C@@H](CC1=CSC=N1)C(=O)O MCULE-4087378294 [0,1,0,0,0,0|1,0,1]=3 313 B12R1.298 CN[C@H](CC1=CNC=N1)C(=O)O MCULE-1286452065 [0,1,0,0,0,0|0,0,2]=3 314 B12R1.298 CN[C@H](CC1=CNC=N1)C(=O)O MCULE-6136956486 [0,1,0,0,0,0|0,0,2]=3 315 B12R1.298 CN[C@H](CC1=CNC=N1)C(=O)O MCULE-6660467173 [0,1,0,0,0,0|0,0,2]=3 316 B12R1.298 CN[C@H](CC1=CNC=N1)C(=O)O MCULE-8650714391 [0,1,0,0,0,0|0,0,2]=3 317 B12R1.298 COC(CN1C=CN=C1)C(=O)O MCULE-6983845546 [0,1,0,0,0,0|3,0,0]=4 318 B12R1.298 N#CC(CC1=CC=CS1)C(=O)O MCULE-6017135189 [0,1,0,0,0,0|2,0,1]=4 319 B12R1.298 NNC(CC1=CN=CN1)C(=O)O MCULE-2772979578 [0,1,0,0,0,0|0,0,0]=1 320 B12R1.1373 CC(Cl)(CN1C=NC=N1)C(=O)O MCULE-5156918483 [0,1,0,0,0,0|2,0,1]=4 321 B12R1.1373 CC(N)(CC1=CNC=N1)C(=O)O MCULE-3037820078 [0,1,0,0,0,0|0,0,2]=3 322 B12R1.1373 CC(N)(CC1=CNC=N1)C(=O)O MCULE-6308670546 [0,1,0,0,0,0|0,0,2]=3 323 B12R1.1373 CC(N)(CN1C=CC=N1)C(=O)O MCULE-5320054225 [0,1,0,0,0,0|2,0,1]=4 324 B12R1.1373 CC(N)(CN1C=CC=N1)C(=O)O MCULE-6617682254 [0,1,0,0,0,0|2,0,1]=4 325 B12R1.1373 CC(N)(CN1C=CN=C1)C(=O)N MCULE-7629964917 [0,1,0,0,0,0|3,0,0]=4 326 B12R1.1373 CC(N)(CN1C=CN=C1)C(=O)O MCULE-6884089127 [0,1,0,0,0,0|2,0,0]=3 327 B12R1.1373 CC(N)(CN1C=NC=N1)C(=O)O MCULE-1504258279 [0,1,0,0,0,0|1,0,1]=3 328 B12R1.1373 CC(N)(CN1C=NC=N1)C(=O)O MCULE-5903271495 [0,1,0,0,0,0|1,0,1]=3 329 B12R1.1373 CC(O)(CN1C=CN=C1)C(=O)O MCULE-9175267945 [0,1,0,0,0,0|3,0,0]=4 330 B12R2.252 O=C(O)C1=CC2=C(N1)N=CS2 MCULE-2978831614 [0,0,0,1,0,0|1,0,2]=4 331 B12R2.252 O=C(O)C1CC2=C(C1)SC=C2 MCULE-3558781460 [0,0,0,1,0,0|3,0,0]=4 332 B12R2.252 O=C(O)C1CC2=CNN=C2C1 MCULE-1728416617 [0,0,0,1,0,0|3,0,0]=4 333 B12R2.252 O=C(O)C1CC2=CSC=C2C1 MCULE-1981316561 [0,0,0,1,0,0|3,0,0]=4 334 B12R2.252 O=C(O)C1CC2=NC=CN2C1 MCULE-4199442684 [0,0,0,1,0,0|3,0,0]=4 335 B12R2.252 O=C(O)C1CC2=NC=CN2C1 MCULE-9791039063 [0,0,0,1,0,0|3,0,0]=4 336 B12R2.252 O=C(O)C1CC2=NN=CN2C1 MCULE-9772919041 [0,0,0,1,0,0|2,0,0]=3 337 B12R2.1354 O=C(O)C1CC1C2=CC=CO2 MCULE-6611007978 [0,0,0,1,0,0|3,0,0]=4 338 B12R2.1354 O=C(O)C1CC1C2=CC=CS2 MCULE-6134860704 [0,0,0,1,0,0|3,0,0]=4 339 B12R2.1354 O=C(O)C1CC1C2=CSC=C2 MCULE-2425985743 [0,0,0,1,0,0|3,0,0]=4 340 B12R2.1354 O=C(O)C1CC1C2=NN=CN2 MCULE-6259281330 [0,0,0,1,0,0|2,0,0]=3 341 B12R2.1354 O=C(O)[C@@H]1C[C@H]1C2=CC=CS2 MCULE-8767987097 [0,0,0,1,0,0|3,0,0]=4 342 B12R2.1354 O=C(O)[C@@H]1C[C@H]1C2=CNC=N2 MCULE-3430818972 [0,0,0,1,0,0|1,0,2]=4 343 B12R2.1354 O=C(O)[C@@H]1C[C@H]1C2=CNC=N2 MCULE-6157324496 [0,0,0,1,0,0|1,0,2]=4 344 B12R2.1354 O=C(O)[C@@H]1C[C@H]1C2=CSC=C2 MCULE-1268110497 [0,0,0,1,0,0|3,0,0]=4 345 B10R1.23 C(N)(C(=O)O)C1=CC=CS1 MCULE-1250665795 [0,0,0,0,1,0|2,0,0]=3 346 B10R1.23 CC(C(=O)O)C1=CC=CO1 MCULE-6443441937 [0,0,0,0,1,0|3,0,0]=4 347 B10R1.23 CC(C(=O)O)C1=CC=CS1 MCULE-4675409626 [0,0,0,0,1,0|3,0,0]=4 348 B10R1.23 CC(C(=O)O)C1=COC=C1 MCULE-4326585522 [0,0,0,0,1,0|3,0,0]=4 349 B10R1.23 CC(C(=O)O)C1=CSC=C1 MCULE-7049134758 [0,0,0,0,1,0|3,0,0]=4 350 B10R1.23 CC(C(=O)O)N1C=CN=C1 MCULE-6250259665 [0,0,0,0,1,0|3,0,0]=4 351 B10R1.23 CC(C(=O)O)N1C=CN=C1 MCULE-6265035276 [0,0,0,0,1,0|3,0,0]=4 352 B10R1.23 CC(C(=O)O)N1C=NC=N1 MCULE-6274245481 [0,0,0,0,1,0|2,0,1]=4 353 B10R1.23 CC(C(=O)O)N1C=NC=N1 MCULE-6656187000 [0,0,0,0,1,0|2,0,1]=4 354 B10R1.23 C[C@H](C(=O)O)N1C=CN=C1 MCULE-7676346166 [0,0,0,0,1,0|3,0,0]=4 355 B10R1.23 C[C@H](C(=O)O)N1C=CN=C1 MCULE-7919952873 [0,0,0,0,1,0|3,0,0]=4 356 B10R1.23 NC(=O)C(N)C1=CC=CS1 MCULE-8794248297 [0,0,0,0,1,0|3,0,0]=4 357 B10R1.23 NC(C(=O)O)C1=CC=CO1 MCULE-9043644841 [0,0,0,0,1,0|2,0,0]=3 358 B10R1.23 NC(C(=O)O)C1=CC=CS1 MCULE-2621741244 [0,0,0,0,1,0|2,0,0]=3 359 B10R1.23 NC(C(=O)O)C1=CC=NS1 MCULE-1938977249 [0,0,0,0,1,0|2,0,0]=3 360 B10R1.23 NC(C(=O)O)C1=CNN=C1 MCULE-5361903799 [0,0,0,0,1,0|2,0,0]=3 361 B10R1.23 NC(C(=O)O)C1=COC=C1 MCULE-7814394097 [0,0,0,0,1,0|2,0,0]=3 362 B10R1.23 NC(C(=O)O)C1=CSC=C1 MCULE-1102402224 [0,0,0,0,1,0|2,0,0]=3 363 B10R1.23 NC(C(=O)O)C1=CSC=C1 MCULE-6018523481 [0,0,0,0,1,0|2,0,0]=3 364 B10R1.23 NC(C(=O)O)C1=CSC=C1 MCULE-8080979991 [0,0,0,0,1,0|2,0,0]=3 365 B10R1.23 NC(C(=O)O)C1=NN=NN1 MCULE-8020392334 [0,0,0,0,1,0|2,0,0]=3 366 B10R1.23 N[C@@H](C(=O)O)C1=CC=CS1 MCULE-5616654577 [0,0,0,0,1,0|2,0,0]=3 367 B10R1.23 N[C@@H](C(=O)O)C1=CC=CS1 MCULE-8589130349 [0,0,0,0,1,0|2,0,0]=3 368 B10R1.23 N[C@@H](C(=O)O)C1=CSC=C1 MCULE-6987247145 [0,0,0,0,1,0|2,0,0]=3 369 B10R1.23 N[C@@H](C(=O)O)C1=CSC=C1 MCULE-8041766294 [0,0,0,0,1,0|2,0,0]=3 370 B10R1.23 N[C@H](C(=O)O)C1=CC=CS1 MCULE-6119385757 [0,0,0,0,1,0|2,0,0]=3 371 B10R1.23 N[C@H](C(=O)O)C1=CC=CS1 MCULE-8662100722 [0,0,0,0,1,0|2,0,0]=3 372 B10R1.23 N[C@H](C(=O)O)C1=CSC=C1 MCULE-3946730105 [0,0,0,0,1,0|2,0,0]=3 373 B10R1.23 N[C@H](C(=O)O)C1=CSC=C1 MCULE-5706986594 [0,0,0,0,1,0|2,0,0]=3 374 B10R1.23 O=C(O)C(=O)C1=CC=CN1 MCULE-9607086039 [0,0,0,0,1,0|2,0,1]=4 375 B10R1.23 O=C(O)C(F)C1=CC=CS1 MCULE-4401360218 [0,0,0,0,1,0|3,0,0]=4 376 B10R1.23 O=C(O)C(F)C1=CSC=C1 MCULE-5837038972 [0,0,0,0,1,0|3,0,0]=4 377 B10R1.23 O=C(O)C(O)C1=CC=CO1 MCULE-1444782782 [0,0,0,0,1,0|3,0,0]=4 378 B10R1.23 O=C(O)C(O)C1=CC=CS1 MCULE-2358633427 [0,0,0,0,1,0|3,0,0]=4 379 B10R1.23 O=C(O)C(O)C1=CNC=N1 MCULE-3158873766 [0,0,0,0,1,0|1,0,2]=4 380 B10R1.23 O=C(O)C(O)C1=CNC=N1 MCULE-5031403061 [0,0,0,0,1,0|1,0,2]=4 381 B10R1.23 O=C(O)C(O)C1=COC=C1 MCULE-3232908149 [0,0,0,0,1,0|3,0,0]=4 382 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 MCULE-4230256436 [0,0,0,0,0,1|3,0,0]=4 383 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 MCULE-7161249545 [0,0,0,0,0,1|3,0,0]=4 384 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O MCULE-7326511541 [0,0,0,0,0,1|3,0,0]=4 385 B12R1.43 CC(CC1=CC=CN=C1)C(=O)O MCULE-2945865799 [0,0,0,0,0,1|2,0,0]=3 386 B12R1.43 CC(CC1=CC=CN=C1)C(=O)O MCULE-5331249082 [0,0,0,0,0,1|2,0,0]=3 387 B12R1.43 CC(CC1=CC=NC=C1)C(=O)O MCULE-6152899620 [0,0,0,0,0,1|2,0,0]=3 388 B12R1.43 CC(CC1=CC=NC=N1)C(=O)O MCULE-5948691397 [0,0,0,0,0,1|1,0,1]=3 389 B12R1.43 CC(CC1=CN=CN=C1)C(=O)O MCULE-3850019109 [0,0,0,0,0,1|1,0,1]=3 390 B12R1.43 CC(CC1=NC=CC=C1)C(=O)O MCULE-6566847057 [0,0,0,0,0,1|2,0,1]=4 391 B12R1.43 CC(CC1=NC=CC=N1)C(=O)O MCULE-9423018015 [0,0,0,0,0,1|2,0,1]=4 392 B12R1.43 CC(NC1=CC=CN=C1)C(=O)O MCULE-7829627263 [0,0,0,0,0,1|3,0,0]=4 393 B12R1.43 CC(OC1=CN=CC=C1)C(=O)O MCULE-9438736579 [0,0,0,0,0,1|3,0,0]=4 394 B12R1.43 CC(SC1=CC=NC=C1)C(=O)O MCULE-6570780253 [0,0,0,0,0,1|3,0,0]=4 395 B12R1.43 CC(SC1=NC=CN=C1)C(=O)O MCULE-1556190570 [0,0,0,0,0,1|2,0,1]=4 396 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-2382098458 [0,0,0,0,0,1|3,0,0]=4 397 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-3028530630 [0,0,0,0,0,1|3,0,0]=4 398 B12R1.43 C[C@H](CC1=CC=CC=C1)C(=O)O MCULE-5116283906 [0,0,0,0,0,1|3,0,0]=4 399 B12R1.43 C[C@H](NC1=CC=NC=C1)C(=O)O MCULE-6289170240 [0,0,0,0,0,1|3,0,0]=4 400 B12R1.43 C[C@H](NC1=CC=NC=C1)C(=O)O MCULE-7122084450 [0,0,0,0,0,1|3,0,0]=4 401 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-2161822841 [0,0,0,0,0,1|3,0,0]=4 402 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-2610261909 [0,0,0,0,0,1|3,0,0]=4 403 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-9345667353 [0,0,0,0,0,1|3,0,0]=4 404 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-9732246414 [0,0,0,0,0,1|3,0,0]=4 405 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-6548337580 [0,0,0,0,0,1|3,0,0]=4 406 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-7119612436 [0,0,0,0,0,1|3,0,0]=4 407 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-9635114334 [0,0,0,0,0,1|3,0,0]=4 408 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-3676093786 [0,0,0,0,0,1|3,0,0]=4 409 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-5027501057 [0,0,0,0,0,1|3,0,0]=4 410 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-5946837057 [0,0,0,0,0,1|3,0,0]=4 411 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-8948644005 [0,0,0,0,0,1|3,0,0]=4 412 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O MCULE-4509365715 [0,0,0,0,0,1|2,0,0]=3 413 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O MCULE-9481096822 [0,0,0,0,0,1|2,0,0]=3 414 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O MCULE-3369503748 [0,0,0,0,0,1|1,0,0]=2 415 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O MCULE-4500681212 [0,0,0,0,0,1|1,0,0]=2 416 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-3037053990 [0,0,0,0,0,1|1,0,0]=2 417 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-3740298834 [0,0,0,0,0,1|1,0,0]=2 418 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-4165068673 [0,0,0,0,0,1|1,0,0]=2 419 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-8377448441 [0,0,0,0,0,1|1,0,0]=2 420 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-9526041825 [0,0,0,0,0,1|1,0,0]=2 421 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O MCULE-2658135318 [0,0,0,0,0,1|1,0,0]=2 422 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O MCULE-4065287784 [0,0,0,0,0,1|1,0,0]=2 423 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O MCULE-4169399134 [0,0,0,0,0,1|1,0,0]=2 424 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O MCULE-2466401514 [0,0,0,0,0,1|1,0,1]=3 425 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O MCULE-7994000866 [0,0,0,0,0,1|1,0,1]=3 426 B12R1.43 NC(CC1=NC=CC=N1)C(=O)O MCULE-3988060033 [0,0,0,0,0,1|1,0,1]=3 427 B12R1.43 NC(CC1=NC=CC=N1)C(=O)O MCULE-6011199658 [0,0,0,0,0,1|1,0,1]=3 428 B12R1.43 NC(CC1=NC=NC=C1)C(=O)O MCULE-3627790030 [0,0,0,0,0,1|0,0,1]=2 429 B12R1.43 NC(CC1=NC=NC=C1)C(=O)O MCULE-8971528550 [0,0,0,0,0,1|0,0,1]=2 430 B12R1.43 NC(CC1=NN=CC=C1)C(=O)O MCULE-3486949364 [0,0,0,0,0,1|1,0,1]=3 431 B12R1.43 NC(CC1=NN=CC=C1)C(=O)O MCULE-9714711796 [0,0,0,0,0,1|1,0,1]=3 432 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-1311765992 [0,0,0,0,0,1|2,0,0]=3 433 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-4249753593 [0,0,0,0,0,1|2,0,0]=3 434 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-5960921520 [0,0,0,0,0,1|2,0,0]=3 435 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9410526237 [0,0,0,0,0,1|2,0,0]=3 436 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-1318776684 [0,0,0,0,0,1|1,0,0]=2 437 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-2756511850 [0,0,0,0,0,1|1,0,0]=2 438 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-6450114631 [0,0,0,0,0,1|1,0,0]=2 439 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-6451205573 [0,0,0,0,0,1|1,0,0]=2 440 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-6819782094 [0,0,0,0,0,1|1,0,0]=2 441 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-7779462392 [0,0,0,0,0,1|1,0,0]=2 442 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-1319584746 [0,0,0,0,0,1|1,0,0]=2 443 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-4038860269 [0,0,0,0,0,1|1,0,0]=2 444 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-5445835001 [0,0,0,0,0,1|1,0,0]=2 445 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-9469765262 [0,0,0,0,0,1|1,0,0]=2 446 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O MCULE-1225994987 [0,0,0,0,0,1|1,0,1]=3 447 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O MCULE-1559053573 [0,0,0,0,0,1|1,0,1]=3 448 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O MCULE-2320178150 [0,0,0,0,0,1|1,0,1]=3 449 B12R1.43 N[C@@H](CC1=NN=CC=C1)C(=O)O MCULE-1359394268 [0,0,0,0,0,1|1,0,1]=3 450 B12R1.43 N[C@@H](CC1=NN=CC=C1)C(=O)O MCULE-2088497949 [0,0,0,0,0,1|1,0,1]=3 451 B12R1.43 N[C@@H](CC1=NN=CC=C1)C(=O)O MCULE-3144048553 [0,0,0,0,0,1|1,0,1]=3 452 B12R1.43 N[C@@H](CC1=NN=CC=C1)C(=O)O MCULE-6040113143 [0,0,0,0,0,1|1,0,1]=3 453 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2148272872 [0,0,0,0,0,1|2,0,0]=3 454 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2197316791 [0,0,0,0,0,1|2,0,0]=3 455 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2827782619 [0,0,0,0,0,1|2,0,0]=3 456 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-3011969403 [0,0,0,0,0,1|2,0,0]=3 457 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-3394687698 [0,0,0,0,0,1|1,0,0]=2 458 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-4997997022 [0,0,0,0,0,1|1,0,0]=2 459 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-5673410743 [0,0,0,0,0,1|1,0,0]=2 460 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-8503334355 [0,0,0,0,0,1|1,0,0]=2 461 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-9702283993 [0,0,0,0,0,1|1,0,0]=2 462 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-1530965630 [0,0,0,0,0,1|1,0,0]=2 463 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-2261526216 [0,0,0,0,0,1|1,0,0]=2 464 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-5458063668 [0,0,0,0,0,1|1,0,0]=2 465 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-8584771604 [0,0,0,0,0,1|1,0,0]=2 466 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-2767701043 [0,0,0,0,0,1|1,0,1]=3 467 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-3184854322 [0,0,0,0,0,1|1,0,1]=3 468 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-5316652497 [0,0,0,0,0,1|1,0,1]=3 469 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-8407561976 [0,0,0,0,0,1|1,0,1]=3 470 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 MCULE-1864489061 [0,0,0,0,0,1|3,0,0]=4 471 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 MCULE-5141593227 [0,0,0,0,0,1|3,0,0]=4 472 B12R1.43 O=C(O)C(F)CC1=CC=CC=C1 MCULE-9166012619 [0,0,0,0,0,1|3,0,0]=4 473 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 MCULE-8315491131 [0,0,0,0,0,1|3,0,0]=4 474 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 MCULE-9508817950 [0,0,0,0,0,1|3,0,0]=4 475 B12R1.43 O=C(O)C(O)CC1=CC=CN=C1 MCULE-6280644145 [0,0,0,0,0,1|2,0,0]=3 476 B12R1.43 O=C(O)C(S)CC1=CC=CC=C1 MCULE-2786315780 [0,0,0,0,0,1|3,0,0]=4 477 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 MCULE-4327885480 [0,0,0,0,0,1|3,0,0]=4 478 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 MCULE-7060788630 [0,0,0,0,0,1|3,0,0]=4 479 B12R1.43 O=C(O)[C@@H](Cl)CC1=CC=CC=C1 MCULE-1955124001 [0,0,0,0,0,1|3,0,0]=4 480 B12R1.43 O=C(O)[C@@H](Cl)CC1=CC=CC=C1 MCULE-2054040205 [0,0,0,0,0,1|3,0,0]=4 481 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 MCULE-1839486703 [0,0,0,0,0,1|3,0,0]=4 482 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 MCULE-4919076158 [0,0,0,0,0,1|3,0,0]=4 483 B12R1.43 O=C(O)[C@H](Br)CC1=CC=CC=C1 MCULE-7765977229 [0,0,0,0,0,1|3,0,0]=4 484 B12R1.43 O=C(O)[C@H](Br)CC1=CC=CC=C1 MCULE-9087197160 [0,0,0,0,0,1|3,0,0]=4 485 B12R1.43 O=C(O)[C@H](Cl)CC1=CC=CC=C1 MCULE-1353432482 [0,0,0,0,0,1|3,0,0]=4 486 B12R1.43 O=C(O)[C@H](Cl)CC1=CC=CC=C1 MCULE-5962224015 [0,0,0,0,0,1|3,0,0]=4 487 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 MCULE-2910632779 [0,0,0,0,0,1|3,0,0]=4 488 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 MCULE-9829239357 [0,0,0,0,0,1|3,0,0]=4 489 B12R1.43 O=C(O)[C@H](S)CC1=CC=CC=C1 MCULE-6360971092 [0,0,0,0,0,1|3,0,0]=4 490 B12R1.43 [C@@H](C)(NC1=CC=CN=C1)C(=O)O MCULE-1618208931 [0,0,0,0,0,1|3,0,0]=4 491 B12R1.43 [C@H](N)(CC1=CC=CC=C1)C(=O)N MCULE-5599449655 [0,0,0,0,0,1|3,0,0]=4 492 B12R1.260 CN(CC(=O)O)CC1=CN=CS1 MCULE-4344396964 [0,0,0,0,0,1|3,0,0]=4 493 B12R1.260 NC(CC(=O)O)CC1=CC=CO1 MCULE-4305476704 [0,0,0,0,0,1|2,0,0]=3 494 B12R1.260 NC(CC(=O)O)CC1=CC=CS1 MCULE-1845608833 [0,0,0,0,0,1|2,0,0]=3 495 B12R1.260 NC(CC(=O)O)CC1=CC=CS1 MCULE-9790060982 [0,0,0,0,0,1|2,0,0]=3 496 B12R1.260 NC(CC(=O)O)CC1=CSC=C1 MCULE-2015108408 [0,0,0,0,0,1|2,0,0]=3 497 B12R1.260 NC(CC(=O)O)CC1=CSC=C1 MCULE-3927224923 [0,0,0,0,0,1|2,0,0]=3 498 B12R1.260 N[C@@H](CC(=O)O)CC1=CC=CO1 MCULE-2795775303 [0,0,0,0,0,1|2,0,0]=3 499 B12R1.260 N[C@@H](CC(=O)O)CC1=CC=CS1 MCULE-1088707523 [0,0,0,0,0,1|2,0,0]=3 500 B12R1.260 N[C@@H](CC(=O)O)CC1=CC=CS1 MCULE-3654310109 [0,0,0,0,0,1|2,0,0]=3 501 B12R1.260 N[C@@H](CC(=O)O)CC1=CC=CS1 MCULE-8289125524 [0,0,0,0,0,1|2,0,0]=3 502 B12R1.260 N[C@@H](CC(=O)O)CC1=CC=CS1 MCULE-8671246375 [0,0,0,0,0,1|2,0,0]=3 503 B12R1.260 N[C@@H](CC(=O)O)CC1=CSC=C1 MCULE-2108707344 [0,0,0,0,0,1|2,0,0]=3 504 B12R1.260 N[C@@H](CC(=O)O)CC1=CSC=C1 MCULE-3736456892 [0,0,0,0,0,1|2,0,0]=3 505 B12R1.260 N[C@@H](CC(=O)O)CC1=CSC=C1 MCULE-4800211250 [0,0,0,0,0,1|2,0,0]=3 506 B12R1.260 N[C@@H](CC(=O)O)CC1=CSC=C1 MCULE-5605183606 [0,0,0,0,0,1|2,0,0]=3 507 B12R1.260 N[C@H](CC(=O)O)CC1=CC=CO1 MCULE-3040009628 [0,0,0,0,0,1|2,0,0]=3 508 B12R1.260 N[C@H](CC(=O)O)CC1=CC=CO1 MCULE-6537016762 [0,0,0,0,0,1|2,0,0]=3 509 B12R1.260 N[C@H](CC(=O)O)CC1=CC=CO1 MCULE-7106321565 [0,0,0,0,0,1|2,0,0]=3 510 B12R1.260 N[C@H](CC(=O)O)CC1=CC=CS1 MCULE-1090315375 [0,0,0,0,0,1|2,0,0]=3 511 B12R1.260 N[C@H](CC(=O)O)CC1=CC=CS1 MCULE-1963711592 [0,0,0,0,0,1|2,0,0]=3 512 B12R1.260 N[C@H](CC(=O)O)CC1=CC=CS1 MCULE-2441525494 [0,0,0,0,0,1|2,0,0]=3 513 B12R1.260 N[C@H](CC(=O)O)CC1=CC=CS1 MCULE-5323841763 [0,0,0,0,0,1|2,0,0]=3 514 B12R1.260 N[C@H](CC(=O)O)CC1=CSC=C1 MCULE-1375949973 [0,0,0,0,0,1|2,0,0]=3 515 B12R1.260 N[C@H](CC(=O)O)CC1=CSC=C1 MCULE-1481519275 [0,0,0,0,0,1|2,0,0]=3 516 B12R1.260 N[C@H](CC(=O)O)CC1=CSC=C1 MCULE-1711849337 [0,0,0,0,0,1|2,0,0]=3 517 B12R1.260 N[C@H](CC(=O)O)CC1=CSC=C1 MCULE-6560082822 [0,0,0,0,0,1|2,0,0]=3 518 B12R1.264 CC(CCC1=CC=CS1)C(=O)O MCULE-3548866690 [0,0,0,0,0,1|3,0,0]=4 519 B12R1.264 CC(SCC1=CC=CO1)C(=O)O MCULE-4549363559 [0,0,0,0,0,1|3,0,0]=4 520 B12R1.264 NC(CSC1=CC=CS1)C(=O)O MCULE-1034881546 [0,0,0,0,0,1|2,0,0]=3 521 B12R1.264 NC(CSC1=NC=CS1)C(=O)O MCULE-4673937684 [0,0,0,0,0,1|2,0,1]=4 522 B9R0.42 CNC(=O)CC(N)C(=O)O MCULE-1910017583 [1,0,1,0,0,0|1,0,1]=4 523 B9R0.42 CNC(=O)CC(N)C(=O)O MCULE-2273353640 [1,0,1,0,0,0|1,0,1]=4 524 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O MCULE-6316771422 [1,0,1,0,0,0|1,0,1]=4 525 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O MCULE-8833942582 [1,0,1,0,0,0|1,0,1]=4 526 B9R0.42 CNC(=O)C[C@H](N)C(=O)O MCULE-7953918935 [1,0,1,0,0,0|1,0,1]=4 527 B9R0.42 CNC(=O)C[C@H](N)C(=O)O MCULE-9595811834 [1,0,1,0,0,0|1,0,1]=4 528 B9R0.42 N[C@@H](CC(=O)NO)C(=O)O MCULE-2694436901 [1,0,1,0,0,0|2,0,0]=4 529 B9R0.47 C/C=C/SC[C@H](N)C(=O)O MCULE-2540874981 [1,0,1,0,0,0|2,0,0]=4 530 B9R0.47 C=CCCCC(N)C(=O)O MCULE-3707920281 [1,0,1,0,0,0|1,0,1]=4 531 B9R0.47 C=CCCCC(N)C(=O)O MCULE-5939027667 [1,0,1,0,0,0|1,0,1]=4 532 B9R0.47 C=CCCCC(N)C(=O)O MCULE-6095387409 [1,0,1,0,0,0|1,0,1]=4 533 B9R0.47 C=CCCC[C@@H](N)C(=O)O MCULE-2101628204 [1,0,1,0,0,0|1,0,1]=4 534 B9R0.47 C=CCCC[C@@H](N)C(=O)O MCULE-7328150693 [1,0,1,0,0,0|1,0,1]=4 535 B9R0.47 C=CCCC[C@H](N)C(=O)O MCULE-1162071877 [1,0,1,0,0,0|1,0,1]=4 536 B9R0.47 C=CCCC[C@H](N)C(=O)O MCULE-7245809917 [1,0,1,0,0,0|1,0,1]=4 537 B9R0.47 C=CCSCC(N)C(=O)O MCULE-6058548878 [1,0,1,0,0,0|2,0,0]=4 538 B9R0.47 C=CCSCC(N)C(=O)O MCULE-9209051108 [1,0,1,0,0,0|2,0,0]=4 539 B9R0.47 C=CCSC[C@@H](N)C(=O)O MCULE-8305031365 [1,0,1,0,0,0|2,0,0]=4 540 B9R0.47 C=CCSC[C@@H](N)C(=O)O MCULE-9911064679 [1,0,1,0,0,0|2,0,0]=4 541 B9R0.47 C=CCSC[C@H](N)C(=O)O MCULE-8106938913 [1,0,1,0,0,0|2,0,0]=4 542 B9R0.47 C=CCSC[C@H](N)C(=O)O MCULE-8215284816 [1,0,1,0,0,0|2,0,0]=4 543 B9R0.47 C=CCSC[C@H](N)C(=O)O MCULE-9415243514 [1,0,1,0,0,0|2,0,0]=4 544 B9R0.47 C=CSCC[C@H](N)C(=O)O MCULE-2736074137 [1,0,1,0,0,0|1,0,1]=4 545 B9R0.47 CC=CSC[C@H](N)C(=O)O MCULE-2840170360 [1,0,1,0,0,0|2,0,0]=4 546 B9R0.47 N/N=C/NC[C@H](N)C(=O)O MCULE-5611888169 [1,0,1,0,0,0|1,0,0]=3 547 B9R0.47 N/N=C/NC[C@H](N)C(=O)O MCULE-6448566029 [1,0,1,0,0,0|1,0,0]=3 548 B9R0.47 NCC=CCC(N)C(=O)O MCULE-9924781011 [1,0,1,0,0,0|0,0,1]=3 549 B9R0.48 N#C/C=C(\N)/CCC(=O)O MCULE-9325480359 [1,0,1,0,0,0|2,0,0]=4 550 B9R1.12 CNCCC1=CN=CN1 MCULE-1969177253 [2,0,0,0,0,0|2,0,0]=4 551 B9R1.12 CNCCC1=CN=CN1 MCULE-3535842550 [2,0,0,0,0,0|2,0,0]=4 552 B9R1.12 CNCCC1=CN=CN1 MCULE-9440994149 [2,0,0,0,0,0|2,0,0]=4 553 B9R1.12 O=CCCC1=CON=C1 MCULE-1987555329 [2,0,0,0,0,0|2,0,0]=4 554 B9R1.12 O=CCCC1=CSC=C1 MCULE-6196067591 [2,0,0,0,0,0|2,0,0]=4 555 B9R1.12 OCCCC1=CN=CS1 MCULE-9607601938 [2,0,0,0,0,0|1,0,1]=4 556 B9R1.13 CC(N)CC1=CC=CN1 MCULE-3993757072 [2,0,0,0,0,0|1,0,1]=4 557 B9R1.13 C[C@@H](N)CC1=CN=CN1 MCULE-7314917866 [2,0,0,0,0,0|0,0,1]=3 558 B9R1.13 O=C(O)CC1=CN=CN1 MCULE-4462983491 [2,0,0,0,0,0|1,0,1]=4 559 B11R0.29 NC(=NCCC[C@H](N)C(=O)O)N MCULE-6159466147 [0,1,1,0,0,0|0,0,2]=4 560 B11R0.42 N[C@@H](CCN/C=N/NO)C(=O)O MCULE-2146073118 [0,1,1,0,0,0|1,0,1]=4 561 B11R0.42 N[C@@H](CCN/C=N/NO)C(=O)O MCULE-7924873020 [0,1,1,0,0,0|1,0,1]=4 562 B11R0.109 N/C(=N\O)/NCC[C@H](N)C(=O)O MCULE-6818477347 [0,1,1,0,0,0|1,0,1]=4 563 B11R1.136 NC(Br)(CO)CC1=CN=CN1 MCULE-8460195731 [1,1,0,0,0,0|0,0,1]=3 564 B11R1.25 COC(=O)C=CC1=CN=CN1 MCULE-8998006253 [1,1,0,0,0,0|0,0,2]=4 565 B11R1.25 COC(=O)CCC1=CC=CN1 MCULE-3378177183 [1,1,0,0,0,0|1,0,0]=3 566 B11R1.25 COC(=O)CCC1=CC=CS1 MCULE-2290836142 [1,1,0,0,0,0|2,0,0]=4 567 B11R1.25 COC(=O)CCC1=CN=NN1 MCULE-4375908797 [1,1,0,0,0,0|1,0,0]=3 568 B11R1.25 COC(=O)CCC1=CNC=N1 MCULE-4772939579 [1,1,0,0,0,0|0,0,2]=4 569 B11R1.25 COC(=O)CCC1=CNC=N1 MCULE-6123767498 [1,1,0,0,0,0|0,0,2]=4 570 B11R1.25 COC(=O)CCC1=CSC=C1 MCULE-3462905030 [1,1,0,0,0,0|2,0,0]=4 571 B11R1.25 COC(=O)CCN1C=CN=C1 MCULE-4061518161 [1,1,0,0,0,0|2,0,0]=4 572 B11R1.25 COC(=O)CCN1C=NC=N1 MCULE-2294931505 [1,1,0,0,0,0|1,0,1]=4 573 B11R1.25 COC(=O)CCN1C=NC=N1 MCULE-8599582384 [1,1,0,0,0,0|1,0,1]=4 574 B11R1.75 CC1=CC=C(O1)CCC(=O)O MCULE-6067365329 [1,1,0,0,0,0|2,0,0]=4 575 B11R1.75 CC1=CC=C(S1)CCC(=O)O MCULE-1322543612 [1,1,0,0,0,0|2,0,0]=4 576 B11R1.75 CC1=CN=C(N1)CCC(=O)O MCULE-3730863195 [1,1,0,0,0,0|2,0,0]=4 577 B11R1.75 CC1=CSC(=C1)CCC(=O)O MCULE-9487444949 [1,1,0,0,0,0|2,0,0]=4 578 B11R1.75 CC1=NC(=CN1)CCC(=O)O MCULE-4312521330 [1,1,0,0,0,0|0,0,2]=4 579 B11R1.75 CC1=NC(=CS1)CCC(=O)O MCULE-6201333243 [1,1,0,0,0,0|1,0,1]=4 580 B11R1.75 CC1=NC(=CS1)CCC(=O)O MCULE-7724457432 [1,1,0,0,0,0|1,0,1]=4 581 B11R1.75 CC1=NC=C(S1)CCC(=O)O MCULE-3350399518 [1,1,0,0,0,0|1,0,0]=3 582 B11R1.75 CC1=NN=C(N1)SCC(=O)O MCULE-6319735870 [1,1,0,0,0,0|2,0,0]=4 583 B11R1.75 CC1=NN=C(N1)SCC(=O)O MCULE-7254350345 [1,1,0,0,0,0|2,0,0]=4 584 B11R1.75 CC1=NN=C(O1)CCC(=O)O MCULE-6891585294 [1,1,0,0,0,0|2,0,0]=4 585 B11R1.75 CC1=NN=C(S1)CCC(=O)O MCULE-6765716317 [1,1,0,0,0,0|2,0,0]=4 586 B11R1.75 CC1=NNC(=C1)CCC(=O)O MCULE-6612442548 [1,1,0,0,0,0|2,0,0]=4 587 B11R1.75 CC1=NOC(=C1)CCC(=O)O MCULE-6454692713 [1,1,0,0,0,0|2,0,0]=4 588 B11R1.75 CC1=NOC(=N1)CCC(=O)O MCULE-7249470330 [1,1,0,0,0,0|1,0,1]=4 589 B11R1.75 CN1C=C(C=N1)CCC(=O)O MCULE-1627544656 [1,1,0,0,0,0|2,0,0]=4 590 B11R1.75 CN1C=CC(=C1)CCC(=O)O MCULE-4623817123 [1,1,0,0,0,0|1,0,1]=4 591 B11R1.75 CN1N=CC(=N1)CCC(=O)O MCULE-7086018325 [1,1,0,0,0,0|1,0,1]=4 592 B11R1.75 NC1=NC(=CS1)CCC(=O)O MCULE-1519545014 [1,1,0,0,0,0|1,0,1]=4 593 B11R1.75 NC1=NC(=CS1)CCC(=O)O MCULE-2497158466 [1,1,0,0,0,0|1,0,1]=4 594 B11R1.75 NC1=NC(=CS1)CCC(=O)O MCULE-5882922452 [1,1,0,0,0,0|1,0,1]=4 595 B11R1.75 NC1=NC=C(S1)CCC(=O)O MCULE-1788897200 [1,1,0,0,0,0|1,0,0]=3 596 B11R1.75 NC1=NN(C=N1)CCC(=O)O MCULE-1018777365 [1,1,0,0,0,0|1,0,1]=4 597 B11R1.75 NC1=NN(C=N1)CCC(=O)O MCULE-3401110238 [1,1,0,0,0,0|1,0,1]=4 598 B11R1.75 NC1=NN=C(N1)SCC(=O)O MCULE-2819326774 [1,1,0,0,0,0|2,0,0]=4 599 B11R1.75 NC1=NN=C(S1)CCC(=O)O MCULE-4126907880 [1,1,0,0,0,0|2,0,0]=4 600 B11R1.75 O=C(O)CCC1=CC(=CS1)Br MCULE-2009432961 [1,1,0,0,0,0|2,0,0]=4 601 B11R1.75 O=C(O)CCC1=CC(=CS1)Cl MCULE-3702716997 [1,1,0,0,0,0|2,0,0]=4 602 B11R1.75 O=C(O)CCC1=CC(=NO1)Br MCULE-2306740292 [1,1,0,0,0,0|2,0,0]=4 603 B11R1.75 O=C(O)CCC1=CC(=NO1)Cl MCULE-8953796559 [1,1,0,0,0,0|2,0,0]=4 604 B11R1.75 O=C(O)CCC1=CC=C(S1)Br MCULE-1504750189 [1,1,0,0,0,0|2,0,0]=4 605 B11R1.75 O=C(O)CCC1=CC=C(S1)Cl MCULE-8046412357 [1,1,0,0,0,0|2,0,0]=4 606 B11R1.75 O=C(O)CCC1=CN=C(S1)Br MCULE-8659303793 [1,1,0,0,0,0|1,0,0]=3 607 B11R1.75 O=C(O)CCC1=CNC(=O)N1 MCULE-2706002292 [1,1,0,0,0,0|0,0,1]=3 608 B11R1.75 O=C(O)CCC1=CNC(=S)N1 MCULE-3837669031 [1,1,0,0,0,0|0,0,1]=3 609 B11R1.75 O=C(O)CCC1=CSC(=C1)Br MCULE-4727002489 [1,1,0,0,0,0|2,0,0]=4 610 B11R1.75 O=C(O)CCC1=NC(=NN1)Br MCULE-2497610514 [1,1,0,0,0,0|1,0,1]=4 611 B11R1.75 O=C(O)CCC1=NC(=NN1)Cl MCULE-8602954248 [1,1,0,0,0,0|1,0,1]=4 612 B11R1.75 O=C(O)CCC1=NC(=NN1)O MCULE-9401453115 [1,1,0,0,0,0|1,0,1]=4 613 B11R1.75 O=C(O)CCC1=NNC(=S)N1 MCULE-7271934363 [1,1,0,0,0,0|1,0,1]=4 614 B11R1.75 O=C(O)CCN1C=NC(=N1)Br MCULE-4827338309 [1,1,0,0,0,0|1,0,1]=4 615 B11R1.75 O=C(O)CCN1C=NC(=N1)Cl MCULE-8372291578 [1,1,0,0,0,0|1,0,1]=4 616 B11R1.75 O=C(O)CCN1C=NC(=N1)O MCULE-8774445732 [1,1,0,0,0,0|1,0,1]=4 617 B11R1.77 CC(CC(=O)O)C1=CC=CO1 MCULE-1929187509 [1,1,0,0,0,0|2,0,0]=4 618 B11R1.77 CC(CC(=O)O)C1=CC=CS1 MCULE-4589142714 [1,1,0,0,0,0|2,0,0]=4 619 B11R1.77 CC(CC(=O)O)N1C=CN=C1 MCULE-4128219937 [1,1,0,0,0,0|2,0,0]=4 620 B11R1.77 CC(CC(=O)O)N1C=CN=C1 MCULE-6129328815 [1,1,0,0,0,0|2,0,0]=4 621 B11R1.77 CC(CC(=O)O)N1C=NC=N1 MCULE-2925779009 [1,1,0,0,0,0|1,0,1]=4 622 B11R1.77 NC(CC(=O)O)C1=CC=CO1 MCULE-4837417792 [1,1,0,0,0,0|2,0,0]=4 623 B11R1.77 NC(CC(=O)O)C1=CC=CO1 MCULE-4958340543 [1,1,0,0,0,0|2,0,0]=4 624 B11R1.77 NC(CC(=O)O)C1=CC=CS1 MCULE-4310408967 [1,1,0,0,0,0|2,0,0]=4 625 B11R1.77 NC(CC(=O)O)C1=CC=CS1 MCULE-4515895911 [1,1,0,0,0,0|2,0,0]=4 626 B11R1.77 NC(CC(=O)O)C1=CC=CS1 MCULE-8010171040 [1,1,0,0,0,0|2,0,0]=4 627 B11R1.77 NC(CC(=O)O)C1=COC=C1 MCULE-6837342366 [1,1,0,0,0,0|2,0,0]=4 628 B11R1.77 NC(CC(=O)O)C1=CSC=C1 MCULE-6863038462 [1,1,0,0,0,0|2,0,0]=4 629 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CO1 MCULE-3487071362 [1,1,0,0,0,0|2,0,0]=4 630 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CO1 MCULE-6738812017 [1,1,0,0,0,0|2,0,0]=4 631 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CO1 MCULE-6817919574 [1,1,0,0,0,0|2,0,0]=4 632 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CS1 MCULE-5396701536 [1,1,0,0,0,0|2,0,0]=4 633 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CS1 MCULE-6166848611 [1,1,0,0,0,0|2,0,0]=4 634 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CS1 MCULE-7980073440 [1,1,0,0,0,0|2,0,0]=4 635 B11R1.77 N[C@@H](CC(=O)O)C1=CC=CS1 MCULE-9153700407 [1,1,0,0,0,0|2,0,0]=4 636 B11R1.77 N[C@@H](CC(=O)O)C1=COC=C1 MCULE-1944262956 [1,1,0,0,0,0|2,0,0]=4 637 B11R1.77 N[C@@H](CC(=O)O)C1=CSC=C1 MCULE-2001475870 [1,1,0,0,0,0|2,0,0]=4 638 B11R1.77 N[C@@H](CC(=O)O)C1=CSC=C1 MCULE-7065799451 [1,1,0,0,0,0|2,0,0]=4 639 B11R1.77 N[C@H](CC(=O)O)C1=CC=CO1 MCULE-1644247813 [1,1,0,0,0,0|2,0,0]=4 640 B11R1.77 N[C@H](CC(=O)O)C1=CC=CO1 MCULE-3339059246 [1,1,0,0,0,0|2,0,0]=4 641 B11R1.77 N[C@H](CC(=O)O)C1=CC=CO1 MCULE-9235419752 [1,1,0,0,0,0|2,0,0]=4 642 B11R1.77 N[C@H](CC(=O)O)C1=CC=CO1 MCULE-9295639672 [1,1,0,0,0,0|2,0,0]=4 643 B11R1.77 N[C@H](CC(=O)O)C1=CC=CS1 MCULE-3827031042 [1,1,0,0,0,0|2,0,0]=4 644 B11R1.77 N[C@H](CC(=O)O)C1=CC=CS1 MCULE-7126396520 [1,1,0,0,0,0|2,0,0]=4 645 B11R1.77 N[C@H](CC(=O)O)C1=CSC=C1 MCULE-3280793536 [1,1,0,0,0,0|2,0,0]=4 646 B11R1.77 N[C@H](CC(=O)O)C1=CSC=C1 MCULE-5136787808 [1,1,0,0,0,0|2,0,0]=4 647 B11R1.90 CC1=C(NC=N1)/C=C/C(=O)O MCULE-9497599005 [1,1,0,0,0,0|0,0,2]=4 648 B11R1.90 CC1=C(SC=C1)CCC(=O)O MCULE-6164958609 [1,1,0,0,0,0|2,0,0]=4 649 B11R1.90 CC1=C(SC=N1)CCC(=O)O MCULE-5922966332 [1,1,0,0,0,0|1,0,0]=3 650 B11R1.90 CC1=CN=CN1CCC(=O)O MCULE-5806413010 [1,1,0,0,0,0|2,0,0]=4 651 B11R1.90 CC1=NC=CN1CCC(=O)O MCULE-7339303371 [1,1,0,0,0,0|2,0,0]=4 652 B11R1.90 CC1=NC=CN1CCC(=O)O MCULE-8620388546 [1,1,0,0,0,0|2,0,0]=4 653 B11R1.90 CN1C=CC=C1CCC(=O)O MCULE-2837121735 [1,1,0,0,0,0|1,0,0]=3 654 B11R1.90 CN1C=CN=C1CCC(=O)O MCULE-7010355695 [1,1,0,0,0,0|2,0,0]=4 655 B11R1.90 CN1C=CN=C1CCC(=O)O MCULE-9754415146 [1,1,0,0,0,0|2,0,0]=4 656 B11R1.90 CN1C=NC=C1C=CC(=O)O MCULE-7025934558 [1,1,0,0,0,0|0,0,2]=4 657 B11R1.90 CN1C=NC=C1CCC(=O)O MCULE-6757787886 [1,1,0,0,0,0|0,0,0]=2 658 B11R1.90 CN1C=NC=C1CCC(=O)O MCULE-9165044655 [1,1,0,0,0,0|0,0,0]=2 659 B11R1.90 CN1C=NN=C1CCC(=O)O MCULE-6891508749 [1,1,0,0,0,0|1,0,0]=3 660 B11R1.90 CN1C=NN=C1SCC(=O)O MCULE-4248617687 [1,1,0,0,0,0|2,0,0]=4 661 B11R1.90 CN1N=CC=C1CCC(=O)O MCULE-9654508612 [1,1,0,0,0,0|2,0,0]=4 662 B11R1.90 NN1C=NN=C1SCC(=O)O MCULE-8738307654 [1,1,0,0,0,0|2,0,0]=4 663 B11R1.90 O=C(O)CCC1=C(C=CS1)Br MCULE-6201800612 [1,1,0,0,0,0|2,0,0]=4 664 B11R1.90 O=C(O)CCC1=C(SC=C1)Br MCULE-2144738859 [1,1,0,0,0,0|2,0,0]=4 665 B11R1.90 O=C(O)CCC1=CSC=C1Br MCULE-7023777453 [1,1,0,0,0,0|2,0,0]=4 666 B11R1.90 O=C(O)CCN1N=CN=C1Br MCULE-5219669873 [1,1,0,0,0,0|1,0,1]=4 667 B11R1.90 O=C(O)CCN1N=CN=C1Cl MCULE-7800669688 [1,1,0,0,0,0|1,0,1]=4 668 B11R1.89 CC1=C(NC=N1)[C@H](N)C(=O)O MCULE-9548760808 [0,1,0,0,1,0|0,0,0]=2 669 B11R1.89 CC1=C(SC=C1)C(N)C(=O)O MCULE-5383112400 [0,1,0,0,1,0|2,0,0]=4 670 B11R1.89 CC1=C(SC=N1)C(N)C(=O)O MCULE-5986966626 [0,1,0,0,1,0|1,0,0]=3 671 B11R1.89 CN1C=CN=C1C(N)C(=O)O MCULE-1792986363 [0,1,0,0,1,0|2,0,0]=4 672 B11R1.89 CN1C=NC=C1C(O)C(=O)O MCULE-2154756852 [0,1,0,0,1,0|1,0,0]=3 673 B11R1.89 CN1C=NC=C1C(O)C(=O)O MCULE-4173861560 [0,1,0,0,1,0|1,0,0]=3 674 B11R1.89 CN1N=CC=C1C(N)C(=O)O MCULE-9588355519 [0,1,0,0,1,0|2,0,0]=4 675 B11R1.89 CN1N=CC=C1C(N)C(=O)O MCULE-9641985239 [0,1,0,0,1,0|2,0,0]=4 676 B11R1.173 CC(N)(C(=O)O)C1=CC=CO1 MCULE-1585679619 [0,1,0,0,1,0|2,0,0]=4 677 B11R1.173 CC(N)(C(=O)O)C1=CC=CS1 MCULE-9404385881 [0,1,0,0,1,0|2,0,0]=4 678 B11R1.173 C[C@](N)(C(=O)O)C1=CC=CO1 MCULE-1980010432 [0,1,0,0,1,0|2,0,0]=4 679 B11R1.173 C[C@](N)(C(=O)O)C1=CC=CS1 MCULE-4767708238 [0,1,0,0,1,0|2,0,0]=4 680 B11R1.173 O=C(O)C(F)(F)C1=CN=CS1 MCULE-7748890477 [0,1,0,0,1,0|2,0,0]=4 681 B11R1.298 CNC(C(=O)O)C1=CC=CS1 MCULE-7262084049 [0,1,0,0,1,0|2,0,0]=4 682 B11R1.298 CNC(C(=O)O)C1=CC=CS1 MCULE-9149972598 [0,1,0,0,1,0|2,0,0]=4 683 B11R1.314 CC1=CC=C(S1)C(N)C(=O)O MCULE-9803888253 [0,1,0,0,1,0|2,0,0]=4 684 B11R1.314 CN1C=C(C=N1)C(N)C(=O)O MCULE-2913985038 [0,1,0,0,1,0|2,0,0]=4 685 B11R1.314 NC(C(=O)O)C1=CC(=CS1)Br MCULE-1427984761 [0,1,0,0,1,0|2,0,0]=4 686 B11R1.314 NC(C(=O)O)C1=CSC(=C1)Br MCULE-2671506137 [0,1,0,0,1,0|2,0,0]=4 687 B13R1.133 CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-5938013882 [0,1,0,0,0,1|2,0,0]=4 688 B13R1.133 CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-5941415626 [0,1,0,0,0,1|2,0,0]=4 689 B13R1.133 CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-4074563438 [0,1,0,0,0,1|2,0,0]=4 690 B13R1.133 CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-6283014667 [0,1,0,0,0,1|2,0,0]=4 691 B13R1.133 CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-4426041269 [0,1,0,0,0,1|2,0,0]=4 692 B13R1.133 CC1=CC=C(C=N1)CC(N)C(=O)O MCULE-7515109915 [0,1,0,0,0,1|1,0,0]=3 693 B13R1.133 CC1=CC=C(C=N1)CC(N)C(=O)O MCULE-7970126746 [0,1,0,0,0,1|1,0,0]=3 694 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]=3 695 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]=3 696 B13R1.133 CC1=CN=C(C=C1)CC(N)C(=O)O MCULE-9990775207 [0,1,0,0,0,1|1,0,1]=4 697 B13R1.133 CC1=NC=C(C=C1)CC(C)C(=O)O MCULE-3690219579 [0,1,0,0,0,1|2,0,0]=4 698 B13R1.133 NC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-1775451572 [0,1,0,0,0,1|2,0,0]=4 699 B13R1.133 NC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-7470720579 [0,1,0,0,0,1|2,0,0]=4 700 B13R1.133 NC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-2078281838 [0,1,0,0,0,1|2,0,0]=4 701 B13R1.133 NC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3147443800 [0,1,0,0,0,1|2,0,0]=4 702 B13R1.133 NC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-6446437625 [0,1,0,0,0,1|2,0,0]=4 703 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-1002354431 [0,1,0,0,0,1|2,0,0]=4 704 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-3057881279 [0,1,0,0,0,1|2,0,0]=4 705 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-3274733318 [0,1,0,0,0,1|2,0,0]=4 706 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-9271769862 [0,1,0,0,0,1|2,0,0]=4 707 B13R1.133 NC(CC1=CC=C(C=C1)I)C(=O)O MCULE-3082140157 [0,1,0,0,0,1|2,0,0]=4 708 B13R1.133 NC(CC1=CC=C(C=C1)I)C(=O)O MCULE-8666804898 [0,1,0,0,0,1|2,0,0]=4 709 B13R1.133 NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-1694199256 [0,1,0,0,0,1|2,0,0]=4 710 B13R1.133 NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-3703416768 [0,1,0,0,0,1|2,0,0]=4 711 B13R1.133 NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-6898017610 [0,1,0,0,0,1|2,0,0]=4 712 B13R1.133 NC(CC1=CC=C(C=N1)Cl)C(=O)O MCULE-3104561565 [0,1,0,0,0,1|1,0,1]=4 713 B13R1.133 NC(CC1=CN=C(C=C1)Cl)C(=O)O MCULE-6144527889 [0,1,0,0,0,1|1,0,0]=3 714 B13R1.133 NC(CC1=NC=C(C=C1)Br)C(=O)O MCULE-1184762054 [0,1,0,0,0,1|1,0,1]=4 715 B13R1.133 NC(CC1=NC=C(C=C1)Br)C(=O)O MCULE-3401635049 [0,1,0,0,0,1|1,0,1]=4 716 B13R1.133 NC(CC1=NC=C(C=C1)Cl)C(=O)O MCULE-7003179779 [0,1,0,0,0,1|1,0,1]=4 717 B13R1.133 NC1=CC=C(C=C1)CC(N)C(=O)O MCULE-3239737488 [0,1,0,0,0,1|2,0,0]=4 718 B13R1.133 NC1=CC=C(C=C1)CC(N)C(=O)O MCULE-6150381462 [0,1,0,0,0,1|2,0,0]=4 719 B13R1.133 NC1=CC=C(C=C1)CC(N)C(=O)O MCULE-9416228233 [0,1,0,0,0,1|2,0,0]=4 720 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-1451751780 [0,1,0,0,0,1|2,0,0]=4 721 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-2816716756 [0,1,0,0,0,1|2,0,0]=4 722 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-6139445410 [0,1,0,0,0,1|2,0,0]=4 723 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-9266819464 [0,1,0,0,0,1|2,0,0]=4 724 B13R1.133 NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-2156725008 [0,1,0,0,0,1|2,0,0]=4 725 B13R1.133 NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-3637255624 [0,1,0,0,0,1|2,0,0]=4 726 B13R1.133 NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-4975962563 [0,1,0,0,0,1|2,0,0]=4 727 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-7143135740 [0,1,0,0,0,1|2,0,0]=4 728 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-8089296783 [0,1,0,0,0,1|2,0,0]=4 729 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-4387611400 [0,1,0,0,0,1|2,0,0]=4 730 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-7124632876 [0,1,0,0,0,1|2,0,0]=4 731 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-7237411145 [0,1,0,0,0,1|2,0,0]=4 732 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-9545997189 [0,1,0,0,0,1|2,0,0]=4 733 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-1704209264 [0,1,0,0,0,1|2,0,0]=4 734 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-4577062521 [0,1,0,0,0,1|2,0,0]=4 735 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-8737892544 [0,1,0,0,0,1|2,0,0]=4 736 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-8976470347 [0,1,0,0,0,1|2,0,0]=4 737 B13R1.133 N[C@@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-2723914313 [0,1,0,0,0,1|2,0,0]=4 738 B13R1.133 N[C@@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-6302870801 [0,1,0,0,0,1|2,0,0]=4 739 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-2932088896 [0,1,0,0,0,1|2,0,0]=4 740 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-2973514450 [0,1,0,0,0,1|2,0,0]=4 741 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-6154244493 [0,1,0,0,0,1|2,0,0]=4 742 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-8059108702 [0,1,0,0,0,1|2,0,0]=4 743 B13R1.133 N[C@@H](CC1=CC=C(C=N1)Cl)C(=O)O MCULE-8852055943 [0,1,0,0,0,1|1,0,1]=4 744 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]=3 745 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]=3 746 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]=3 747 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]=3 748 B13R1.133 N[C@@H](CC1=NC=C(C=C1)Br)C(=O)O MCULE-5841875025 [0,1,0,0,0,1|1,0,1]=4 749 B13R1.133 N[C@@H](CC1=NC=C(C=C1)Br)C(=O)O MCULE-8825878130 [0,1,0,0,0,1|1,0,1]=4 750 B13R1.133 N[C@@H](CC1=NC=C(C=C1)Cl)C(=O)O MCULE-7695251719 [0,1,0,0,0,1|1,0,1]=4 751 B13R1.133 N[C@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-4875394682 [0,1,0,0,0,1|2,0,0]=4 752 B13R1.133 N[C@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-8335788231 [0,1,0,0,0,1|2,0,0]=4 753 B13R1.133 N[C@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-8515191610 [0,1,0,0,0,1|2,0,0]=4 754 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-2834745731 [0,1,0,0,0,1|2,0,0]=4 755 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3982277557 [0,1,0,0,0,1|2,0,0]=4 756 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-4128938211 [0,1,0,0,0,1|2,0,0]=4 757 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-6437321299 [0,1,0,0,0,1|2,0,0]=4 758 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-1442650276 [0,1,0,0,0,1|2,0,0]=4 759 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-3700362961 [0,1,0,0,0,1|2,0,0]=4 760 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-8139852905 [0,1,0,0,0,1|2,0,0]=4 761 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-9312923607 [0,1,0,0,0,1|2,0,0]=4 762 B13R1.133 N[C@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-2177794046 [0,1,0,0,0,1|2,0,0]=4 763 B13R1.133 N[C@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-2766032223 [0,1,0,0,0,1|2,0,0]=4 764 B13R1.133 N[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-6003337645 [0,1,0,0,0,1|2,0,0]=4 765 B13R1.133 N[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-7719741497 [0,1,0,0,0,1|2,0,0]=4 766 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)C)C(=O)O MCULE-6439185943 [0,1,0,0,0,1|2,0,0]=4 767 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)N)C(=O)O MCULE-5291387050 [0,1,0,0,0,1|2,0,0]=4 768 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)N)C(=O)O MCULE-6099117172 [0,1,0,0,0,1|2,0,0]=4 769 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)N)C(=O)O MCULE-7165201455 [0,1,0,0,0,1|2,0,0]=4 770 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 MCULE-2582237555 [0,1,0,0,0,1|2,0,0]=4 771 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 MCULE-3332878876 [0,1,0,0,0,1|2,0,0]=4 772 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 MCULE-8835211261 [0,1,0,0,0,1|2,0,0]=4 773 B13R1.135 COC(=O)C(N)CC1=CC=CN=C1 MCULE-7706046290 [0,1,0,0,0,1|1,0,0]=3 774 B13R1.135 COC(=O)C(N)CC1=CC=NC=C1 MCULE-2976855251 [0,1,0,0,0,1|1,0,0]=3 775 B13R1.135 COC(=O)C(N)CC1=CC=NC=C1 MCULE-5373720754 [0,1,0,0,0,1|1,0,0]=3 776 B13R1.135 COC(=O)C(N)CC1=CN=CC=C1 MCULE-3627205617 [0,1,0,0,0,1|1,0,0]=3 777 B13R1.135 COC(=O)C(N)CC1=CN=CC=C1 MCULE-7012025618 [0,1,0,0,0,1|1,0,0]=3 778 B13R1.135 COC(=O)C(N)CC1=CN=CN=C1 MCULE-3079670999 [0,1,0,0,0,1|0,0,1]=3 779 B13R1.135 COC(=O)C(N)CC1=CN=CN=C1 MCULE-9441093234 [0,1,0,0,0,1|0,0,1]=3 780 B13R1.135 COC(=O)C(N)CC1=NC=CC=C1 MCULE-1266368138 [0,1,0,0,0,1|1,0,1]=4 781 B13R1.135 COC(=O)C(N)CC1=NC=CC=C1 MCULE-2613909092 [0,1,0,0,0,1|1,0,1]=4 782 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-4108104134 [0,1,0,0,0,1|2,0,0]=4 783 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-5129708210 [0,1,0,0,0,1|2,0,0]=4 784 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-5580078035 [0,1,0,0,0,1|2,0,0]=4 785 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-8316158523 [0,1,0,0,0,1|2,0,0]=4 786 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CN=C1 MCULE-6632328194 [0,1,0,0,0,1|1,0,0]=3 787 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CN=C1 MCULE-9030456400 [0,1,0,0,0,1|1,0,0]=3 788 B13R1.135 COC(=O)[C@@H](N)CC1=CN=CC=C1 MCULE-7900774985 [0,1,0,0,0,1|1,0,0]=3 789 B13R1.135 COC(=O)[C@@H](N)CC1=CN=CN=C1 MCULE-5570117337 [0,1,0,0,0,1|0,0,1]=3 790 B13R1.135 COC(=O)[C@@H](N)CC1=NC=CC=C1 MCULE-1066367695 [0,1,0,0,0,1|1,0,1]=4 791 B13R1.135 COC(=O)[C@@H](N)CC1=NC=CC=N1 MCULE-5468945581 [0,1,0,0,0,1|1,0,1]=4 792 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-1447476278 [0,1,0,0,0,1|2,0,0]=4 793 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-2751110672 [0,1,0,0,0,1|2,0,0]=4 794 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-3397498089 [0,1,0,0,0,1|2,0,0]=4 795 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-7887773710 [0,1,0,0,0,1|2,0,0]=4 796 B13R1.135 COC(=O)[C@H](N)CC1=CC=CN=C1 MCULE-7992953998 [0,1,0,0,0,1|1,0,0]=3 797 B13R1.135 COC(=O)[C@H](N)CC1=CC=CN=C1 MCULE-9728277739 [0,1,0,0,0,1|1,0,0]=3 798 B13R1.135 COC(=O)[C@H](N)CC1=CN=CC=C1 MCULE-8391597596 [0,1,0,0,0,1|1,0,0]=3 799 B13R1.135 COC(=O)[C@H](N)CC1=CN=CC=C1 MCULE-8615923673 [0,1,0,0,0,1|1,0,0]=3 800 B13R1.135 COC(=O)[C@H](N)CC1=CN=CN=C1 MCULE-3279694287 [0,1,0,0,0,1|0,0,1]=3 801 B13R1.135 COC(=O)[C@H](N)CC1=NC=CC=C1 MCULE-1464248967 [0,1,0,0,0,1|1,0,1]=4 802 B13R1.135 COC(=O)[C@H](N)CC1=NC=CC=C1 MCULE-5048055396 [0,1,0,0,0,1|1,0,1]=4 803 B13R1.135 COC(=O)[C@H](N)CC1=NC=CC=N1 MCULE-4841067344 [0,1,0,0,0,1|1,0,1]=4 804 B13R1.148 CC1=CC(=CC=C1)CC(N)C(=O)O MCULE-1997175050 [0,1,0,0,0,1|2,0,0]=4 805 B13R1.148 CC1=CC(=CC=C1)CC(N)C(=O)O MCULE-9587136551 [0,1,0,0,0,1|2,0,0]=4 806 B13R1.148 CC1=CC(=CC=C1)C[C@@H](N)C(=O)O MCULE-8447730242 [0,1,0,0,0,1|2,0,0]=4 807 B13R1.148 CC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-5228247053 [0,1,0,0,0,1|2,0,0]=4 808 B13R1.148 CC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-8475369617 [0,1,0,0,0,1|2,0,0]=4 809 B13R1.148 CC1=CC=CC(=C1)CC(N)C(=O)O MCULE-1770281237 [0,1,0,0,0,1|2,0,0]=4 810 B13R1.148 CC1=CC=CC(=C1)C[C@@H](N)C(=O)O MCULE-8538987390 [0,1,0,0,0,1|2,0,0]=4 811 B13R1.148 NC(CC1=CC(=CC=C1)Br)C(=O)O MCULE-2348274001 [0,1,0,0,0,1|2,0,0]=4 812 B13R1.148 NC(CC1=CC(=CC=C1)Br)C(=O)O MCULE-6147884206 [0,1,0,0,0,1|2,0,0]=4 813 B13R1.148 NC(CC1=CC(=CC=C1)Cl)C(=O)O MCULE-1289187602 [0,1,0,0,0,1|2,0,0]=4 814 B13R1.148 NC(CC1=CC(=CC=C1)Cl)C(=O)O MCULE-8409034063 [0,1,0,0,0,1|2,0,0]=4 815 B13R1.148 NC(CC1=CC(=CC=C1)F)C(=O)O MCULE-3048081903 [0,1,0,0,0,1|2,0,0]=4 816 B13R1.148 NC(CC1=CC(=CC=C1)I)C(=O)O MCULE-4400986534 [0,1,0,0,0,1|2,0,0]=4 817 B13R1.148 NC(CC1=CC(=CC=C1)O)C(=O)O MCULE-1682126004 [0,1,0,0,0,1|2,0,0]=4 818 B13R1.148 NC(CC1=CC(=CC=C1)O)C(=O)O MCULE-1870924489 [0,1,0,0,0,1|2,0,0]=4 819 B13R1.148 NC(CC1=CC=CC(=C1)Br)C(=O)O MCULE-8007269772 [0,1,0,0,0,1|2,0,0]=4 820 B13R1.148 NC(CC1=CC=CC(=C1)Cl)C(=O)O MCULE-1743986990 [0,1,0,0,0,1|2,0,0]=4 821 B13R1.148 NC(CC1=CC=CC(=C1)Cl)C(=O)O MCULE-6477168764 [0,1,0,0,0,1|2,0,0]=4 822 B13R1.148 NC(CC1=CC=CC(=C1)F)C(=O)O MCULE-1037840303 [0,1,0,0,0,1|2,0,0]=4 823 B13R1.148 NC(CC1=CC=CC(=C1)F)C(=O)O MCULE-1978574097 [0,1,0,0,0,1|2,0,0]=4 824 B13R1.148 NC(CC1=CC=CC(=C1)O)C(=O)O MCULE-7197195437 [0,1,0,0,0,1|2,0,0]=4 825 B13R1.148 NC1=CC(=CC=C1)CC(N)C(=O)O MCULE-2467932131 [0,1,0,0,0,1|2,0,0]=4 826 B13R1.148 NC1=CC(=CC=C1)CC(N)C(=O)O MCULE-5537013080 [0,1,0,0,0,1|2,0,0]=4 827 B13R1.148 NC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-2052828414 [0,1,0,0,0,1|2,0,0]=4 828 B13R1.148 NC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-2924867217 [0,1,0,0,0,1|2,0,0]=4 829 B13R1.148 NC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-5878731697 [0,1,0,0,0,1|2,0,0]=4 830 B13R1.148 NC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-8248386535 [0,1,0,0,0,1|2,0,0]=4 831 B13R1.148 NC1=CC=CC(=C1)CC(N)C(=O)O MCULE-6788793962 [0,1,0,0,0,1|2,0,0]=4 832 B13R1.148 NC1=CC=CC(=C1)CC(N)C(=O)O MCULE-7989672916 [0,1,0,0,0,1|2,0,0]=4 833 B13R1.148 N[C@@H](CC1=CC(=CC=C1)Br)C(=O)O MCULE-3495438482 [0,1,0,0,0,1|2,0,0]=4 834 B13R1.148 N[C@@H](CC1=CC(=CC=C1)Cl)C(=O)O MCULE-9561585574 [0,1,0,0,0,1|2,0,0]=4 835 B13R1.148 N[C@@H](CC1=CC(=CC=C1)O)C(=O)O MCULE-2356956274 [0,1,0,0,0,1|2,0,0]=4 836 B13R1.148 N[C@@H](CC1=CC(=CN=C1)F)C(=O)O MCULE-1217529300 [0,1,0,0,0,1|1,0,0]=3 837 B13R1.148 N[C@@H](CC1=CC(=CN=C1)F)C(=O)O MCULE-6320059944 [0,1,0,0,0,1|1,0,0]=3 838 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-1686064373 [0,1,0,0,0,1|2,0,0]=4 839 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-4183003026 [0,1,0,0,0,1|2,0,0]=4 840 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-5029761730 [0,1,0,0,0,1|2,0,0]=4 841 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-6284927524 [0,1,0,0,0,1|2,0,0]=4 842 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-9100547203 [0,1,0,0,0,1|2,0,0]=4 843 B13R1.148 N[C@@H](CC1=CC=CC(=C1)F)C(=O)O MCULE-7481903657 [0,1,0,0,0,1|2,0,0]=4 844 B13R1.148 N[C@@H](CC1=CC=CC(=C1)F)C(=O)O MCULE-8671021032 [0,1,0,0,0,1|2,0,0]=4 845 B13R1.148 N[C@@H](CC1=CC=CC(=C1)I)C(=O)O MCULE-6787387564 [0,1,0,0,0,1|2,0,0]=4 846 B13R1.148 N[C@@H](CC1=CC=CC(=C1)I)C(=O)O MCULE-8633614286 [0,1,0,0,0,1|2,0,0]=4 847 B13R1.148 N[C@@H](CC1=CC=CC(=C1)O)C(=O)O MCULE-2174973339 [0,1,0,0,0,1|2,0,0]=4 848 B13R1.148 N[C@@H](CC1=CC=CC(=C1)O)C(=O)O MCULE-6923480945 [0,1,0,0,0,1|2,0,0]=4 849 B13R1.148 N[C@@H](CC1=CC=CC(=C1)O)C(=O)O MCULE-8483193639 [0,1,0,0,0,1|2,0,0]=4 850 B13R1.148 N[C@H](CC1=CC(=CC=C1)O)C(=O)O MCULE-4455335179 [0,1,0,0,0,1|2,0,0]=4 851 B13R1.148 N[C@H](CC1=CC(=CC=C1)O)C(=O)O MCULE-6512619298 [0,1,0,0,0,1|2,0,0]=4 852 B13R1.148 N[C@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-6055691240 [0,1,0,0,0,1|2,0,0]=4 853 B13R1.148 N[C@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-8797288798 [0,1,0,0,0,1|2,0,0]=4 854 B13R1.148 N[C@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-5153208600 [0,1,0,0,0,1|2,0,0]=4 855 B13R1.148 N[C@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-7991505295 [0,1,0,0,0,1|2,0,0]=4 856 B13R1.148 N[C@H](CC1=CC=CC(=C1)F)C(=O)O MCULE-2189181945 [0,1,0,0,0,1|2,0,0]=4 857 B13R1.148 N[C@H](CC1=CC=CC(=C1)F)C(=O)O MCULE-5152700511 [0,1,0,0,0,1|2,0,0]=4 858 B13R1.148 N[C@H](CC1=CC=CC(=C1)I)C(=O)O MCULE-1640787822 [0,1,0,0,0,1|2,0,0]=4 859 B13R1.148 N[C@H](CC1=CC=CC(=C1)I)C(=O)O MCULE-7721290088 [0,1,0,0,0,1|2,0,0]=4 860 B13R1.152 CC(C1=CC=CC=C1)C(N)C(=O)O MCULE-8491955673 [0,1,0,0,0,1|2,0,0]=4 861 B13R1.152 CC(C1=CC=CC=C1)C(N)C(=O)O MCULE-9701727761 [0,1,0,0,0,1|2,0,0]=4 862 B13R1.152 CC(C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-5202341879 [0,1,0,0,0,1|2,0,0]=4 863 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@@H](N)C(=O)O MCULE-3296564620 [0,1,0,0,0,1|2,0,0]=4 864 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@@H](N)C(=O)O MCULE-5770222064 [0,1,0,0,0,1|2,0,0]=4 865 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-8614292304 [0,1,0,0,0,1|2,0,0]=4 866 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-8697326618 [0,1,0,0,0,1|2,0,0]=4 867 B13R1.152 C[C@H](C1=CC=CC=C1)[C@@H](N)C(=O)O MCULE-8687654257 [0,1,0,0,0,1|2,0,0]=4 868 B13R1.152 C[C@H](C1=CC=CC=C1)[C@@H](N)C(=O)O MCULE-9499293392 [0,1,0,0,0,1|2,0,0]=4 869 B13R1.152 C[C@H](C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-1845048066 [0,1,0,0,0,1|2,0,0]=4 870 B13R1.152 C[C@H](C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-9752844525 [0,1,0,0,0,1|2,0,0]=4 871 B13R1.152 NC(C(=O)O)C(Cl)C1=CC=CC=C1 MCULE-2618772778 [0,1,0,0,0,1|2,0,0]=4 872 B13R1.152 NC(C(=O)O)C(O)C1=CC=CC=C1 MCULE-3348967519 [0,1,0,0,0,1|2,0,0]=4 873 B13R1.152 NC(C(=O)O)C(O)C1=CC=CC=C1 MCULE-4051921601 [0,1,0,0,0,1|2,0,0]=4 874 B13R1.152 NC(C(=O)O)C(O)C1=CN=CC=C1 MCULE-5411267363 [0,1,0,0,0,1|1,0,0]=3 875 B13R1.152 NC(C1=CC=CN=C1)C(O)C(=O)O MCULE-1719112007 [0,1,0,0,0,1|2,0,0]=4 876 B13R1.152 N[C@@H](C(=O)O)[C@@H](O)C1=CC=CC=C1 MCULE-6532492719 [0,1,0,0,0,1|2,0,0]=4 877 B13R1.152 N[C@@H](C(=O)O)[C@H](O)C1=CC=CC=C1 MCULE-7686375522 [0,1,0,0,0,1|2,0,0]=4 878 B13R1.152 N[C@H](C(=O)O)[C@@H](O)C1=CC=CC=C1 MCULE-3533562532 [0,1,0,0,0,1|2,0,0]=4 879 B13R1.152 N[C@H](C(=O)O)[C@H](O)C1=CC=CC=C1 MCULE-7276106585 [0,1,0,0,0,1|2,0,0]=4 880 B13R1.152 N[C@H](C(=O)O)[C@H](O)C1=CC=CC=C1 MCULE-7798579567 [0,1,0,0,0,1|2,0,0]=4 881 B13R1.202 CC1=C(C=CC=C1)CC(N)C(=O)O MCULE-3928457353 [0,1,0,0,0,1|2,0,0]=4 882 B13R1.202 CC1=C(C=CC=C1)CC(N)C(=O)O MCULE-4728915963 [0,1,0,0,0,1|2,0,0]=4 883 B13R1.202 CC1=C(C=CC=C1)CC(N)C(=O)O MCULE-9582945892 [0,1,0,0,0,1|2,0,0]=4 884 B13R1.202 CC1=C(C=CC=C1)C[C@@H](N)C(=O)O MCULE-7777290104 [0,1,0,0,0,1|2,0,0]=4 885 B13R1.202 CC1=C(C=CC=N1)CC(C)C(=O)O MCULE-6308639265 [0,1,0,0,0,1|2,0,0]=4 886 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]=3 887 B13R1.202 CC1=CC=CC=C1C[C@@H](N)C(=O)O MCULE-3139735845 [0,1,0,0,0,1|2,0,0]=4 888 B13R1.202 CC1=CC=CC=C1C[C@H](N)C(=O)O MCULE-4423394672 [0,1,0,0,0,1|2,0,0]=4 889 B13R1.202 CC1=CC=CC=C1C[C@H](N)C(=O)O MCULE-8459527082 [0,1,0,0,0,1|2,0,0]=4 890 B13R1.202 CC1=NC=CC=C1C[C@H](N)C(=O)O MCULE-1450162280 [0,1,0,0,0,1|1,0,0]=3 891 B13R1.202 CC1=NC=CC=C1C[C@H](N)C(=O)O MCULE-2509567482 [0,1,0,0,0,1|1,0,0]=3 892 B13R1.202 CC1=NC=CC=C1C[C@H](N)C(=O)O MCULE-3945955464 [0,1,0,0,0,1|1,0,0]=3 893 B13R1.202 NC(CC1=C(C=CC=C1)Br)C(=O)O MCULE-5724659686 [0,1,0,0,0,1|2,0,0]=4 894 B13R1.202 NC(CC1=C(C=CC=C1)Br)C(=O)O MCULE-8657034756 [0,1,0,0,0,1|2,0,0]=4 895 B13R1.202 NC(CC1=C(C=CC=C1)Cl)C(=O)O MCULE-1003643925 [0,1,0,0,0,1|2,0,0]=4 896 B13R1.202 NC(CC1=C(C=CC=C1)Cl)C(=O)O MCULE-5234125993 [0,1,0,0,0,1|2,0,0]=4 897 B13R1.202 NC(CC1=C(C=CC=C1)F)C(=O)O MCULE-1643139482 [0,1,0,0,0,1|2,0,0]=4 898 B13R1.202 NC(CC1=C(C=CC=C1)F)C(=O)O MCULE-8132487617 [0,1,0,0,0,1|2,0,0]=4 899 B13R1.202 NC(CC1=C(C=CC=C1)O)C(=O)O MCULE-2760582536 [0,1,0,0,0,1|2,0,0]=4 900 B13R1.202 NC(CC1=C(C=CC=C1)O)C(=O)O MCULE-3181624921 [0,1,0,0,0,1|2,0,0]=4 901 B13R1.202 NC(CC1=CC=CC=C1Br)C(=O)O MCULE-4720569207 [0,1,0,0,0,1|2,0,0]=4 902 B13R1.202 NC(CC1=CC=CC=C1I)C(=O)O MCULE-5831466387 [0,1,0,0,0,1|2,0,0]=4 903 B13R1.202 NC(CC1=CC=CC=C1O)C(=O)O MCULE-3693150441 [0,1,0,0,0,1|2,0,0]=4 904 B13R1.202 NC(CC1=CC=CC=C1O)C(=O)O MCULE-8522650891 [0,1,0,0,0,1|2,0,0]=4 905 B13R1.202 NC1=CC=CC=C1CC(N)C(=O)O MCULE-7465695275 [0,1,0,0,0,1|2,0,0]=4 906 B13R1.202 NC1=CC=CC=C1C[C@@H](N)C(=O)O MCULE-6308202600 [0,1,0,0,0,1|2,0,0]=4 907 B13R1.202 NC1=CC=CC=C1C[C@H](N)C(=O)O MCULE-2066886177 [0,1,0,0,0,1|2,0,0]=4 908 B13R1.202 N[C@@H](CC1=C(C=CC=C1)F)C(=O)O MCULE-5925880420 [0,1,0,0,0,1|2,0,0]=4 909 B13R1.202 N[C@@H](CC1=C(C=CC=C1)I)C(=O)O MCULE-5539213577 [0,1,0,0,0,1|2,0,0]=4 910 B13R1.202 N[C@@H](CC1=CC=CC=C1Br)C(=O)O MCULE-7720110968 [0,1,0,0,0,1|2,0,0]=4 911 B13R1.202 N[C@@H](CC1=CC=CC=C1Br)C(=O)O MCULE-8611213892 [0,1,0,0,0,1|2,0,0]=4 912 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-4843973004 [0,1,0,0,0,1|2,0,0]=4 913 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-6583454610 [0,1,0,0,0,1|2,0,0]=4 914 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-8729370801 [0,1,0,0,0,1|2,0,0]=4 915 B13R1.202 N[C@@H](CC1=CC=CC=C1F)C(=O)O MCULE-1023509436 [0,1,0,0,0,1|2,0,0]=4 916 B13R1.202 N[C@@H](CC1=CC=CC=C1I)C(=O)O MCULE-1271250491 [0,1,0,0,0,1|2,0,0]=4 917 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-3324530063 [0,1,0,0,0,1|2,0,0]=4 918 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-4252485679 [0,1,0,0,0,1|2,0,0]=4 919 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-8738209502 [0,1,0,0,0,1|2,0,0]=4 920 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-9497377193 [0,1,0,0,0,1|2,0,0]=4 921 B13R1.202 N[C@@H](CC1=NC=CC=C1Cl)C(=O)O MCULE-2291118366 [0,1,0,0,0,1|1,0,1]=4 922 B13R1.202 N[C@H](CC1=C(C=CC=C1)F)C(=O)O MCULE-2582515595 [0,1,0,0,0,1|2,0,0]=4 923 B13R1.202 N[C@H](CC1=CC=CC=C1Br)C(=O)O MCULE-1182640112 [0,1,0,0,0,1|2,0,0]=4 924 B13R1.202 N[C@H](CC1=CC=CC=C1Br)C(=O)O MCULE-7433575732 [0,1,0,0,0,1|2,0,0]=4 925 B13R1.202 N[C@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-2211654501 [0,1,0,0,0,1|2,0,0]=4 926 B13R1.202 N[C@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-7072462727 [0,1,0,0,0,1|2,0,0]=4 927 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O MCULE-2083626274 [0,1,0,0,0,1|2,0,0]=4 928 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O MCULE-3474904707 [0,1,0,0,0,1|2,0,0]=4 929 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O MCULE-4069544287 [0,1,0,0,0,1|2,0,0]=4 930 B13R1.202 N[C@H](CC1=CC=CC=C1I)C(=O)O MCULE-1367493363 [0,1,0,0,0,1|2,0,0]=4 931 B13R1.202 N[C@H](CC1=CC=CC=C1I)C(=O)O MCULE-5236102575 [0,1,0,0,0,1|2,0,0]=4 932 B13R1.202 N[C@H](CC1=CC=CC=C1O)C(=O)O MCULE-2348504704 [0,1,0,0,0,1|2,0,0]=4 933 B13R1.202 N[C@H](CC1=CC=CC=C1O)C(=O)O MCULE-8147742693 [0,1,0,0,0,1|2,0,0]=4 934 B13R1.202 N[C@H](CC1=NC=CC=C1Br)C(=O)O MCULE-3372881597 [0,1,0,0,0,1|1,0,1]=4 935 B13R1.202 N[C@H](CC1=NC=CC=C1F)C(=O)O MCULE-2506093240 [0,1,0,0,0,1|1,0,1]=4 936 B13R1.418 CCC(CC1=CN=CC=C1)C(=O)O MCULE-2499732491 [0,1,0,0,0,1|2,0,0]=4 937 B13R1.418 CCC(CC1=CN=CN=C1)C(=O)O MCULE-5344519385 [0,1,0,0,0,1|1,0,1]=4 938 B13R1.418 CNC(CC1=CC=CC=C1)C(=O)O MCULE-3842005714 [0,1,0,0,0,1|2,0,0]=4 939 B13R1.418 CNC(CC1=CC=CC=C1)C(=O)O MCULE-7025734622 [0,1,0,0,0,1|2,0,0]=4 940 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-5892127646 [0,1,0,0,0,1|2,0,0]=4 941 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6660510193 [0,1,0,0,0,1|2,0,0]=4 942 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-7617883459 [0,1,0,0,0,1|2,0,0]=4 943 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9210211125 [0,1,0,0,0,1|2,0,0]=4 944 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2038566174 [0,1,0,0,0,1|2,0,0]=4 945 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-8805615196 [0,1,0,0,0,1|2,0,0]=4 946 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-9690973894 [0,1,0,0,0,1|2,0,0]=4 947 B13R1.418 N#CC(CC1=CC=CN=C1)C(=O)O MCULE-6461806417 [0,1,0,0,0,1|1,0,1]=4 948 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-3435928554 [0,1,0,0,0,1|2,0,0]=4 949 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-4710137264 [0,1,0,0,0,1|2,0,0]=4 950 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-5594566401 [0,1,0,0,0,1|2,0,0]=4 951 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-7040954795 [0,1,0,0,0,1|2,0,0]=4 952 B13R1.418 NCC(CC1=CN=CC=C1)C(=O)O MCULE-4896890670 [0,1,0,0,0,1|1,0,0]=3 953 B13R1.418 NCC(CC1=CN=CC=C1)C(=O)O MCULE-7456176624 [0,1,0,0,0,1|1,0,0]=3 954 B13R1.418 NCC(CC1=NC=CC=C1)C(=O)O MCULE-1712969305 [0,1,0,0,0,1|1,0,1]=4 955 B13R1.418 NCC(CC1=NC=CC=C1)C(=O)O MCULE-4796581653 [0,1,0,0,0,1|1,0,1]=4 956 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-4543639508 [0,1,0,0,0,1|2,0,0]=4 957 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6429844971 [0,1,0,0,0,1|2,0,0]=4 958 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-7718503080 [0,1,0,0,0,1|2,0,0]=4 959 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9663366424 [0,1,0,0,0,1|2,0,0]=4 960 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-3343846707 [0,1,0,0,0,1|2,0,0]=4 961 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-4830325742 [0,1,0,0,0,1|2,0,0]=4 962 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-6363695814 [0,1,0,0,0,1|2,0,0]=4 963 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-8977991880 [0,1,0,0,0,1|2,0,0]=4 964 B13R1.418 NOC(CC1=CC=CC=C1)C(=O)O MCULE-2996535605 [0,1,0,0,0,1|2,0,0]=4 965 B13R1.418 NOC(CC1=CC=CC=C1)C(=O)O MCULE-3251573694 [0,1,0,0,0,1|2,0,0]=4 966 B13R1.418 NOC(CC1=CC=CC=C1)C(=O)O MCULE-5462822882 [0,1,0,0,0,1|2,0,0]=4 967 B13R1.418 NO[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-2535668835 [0,1,0,0,0,1|2,0,0]=4 968 B13R1.418 NO[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6514153575 [0,1,0,0,0,1|2,0,0]=4 969 B13R1.1073 CC(C)(CC1=CC=CN=C1)C(=O)O MCULE-1786635477 [0,1,0,0,0,1|2,0,0]=4 970 B13R1.1073 CC(C)(CC1=CC=NC=C1)C(=O)O MCULE-2392185420 [0,1,0,0,0,1|2,0,0]=4 971 B13R1.1073 CC(C)(CC1=CC=NC=C1)C(=O)O MCULE-7606943048 [0,1,0,0,0,1|2,0,0]=4 972 B13R1.1073 CC(N)(CC1=CC=CC=C1)C(=O)O MCULE-3264509800 [0,1,0,0,0,1|2,0,0]=4 973 B13R1.1073 CC(N)(CC1=CC=CC=C1)C(=O)O MCULE-8062918187 [0,1,0,0,0,1|2,0,0]=4 974 B13R1.1073 C[C@@](N)(CC1=CC=CC=C1)C(=O)O MCULE-6080134898 [0,1,0,0,0,1|2,0,0]=4 975 B13R1.1073 C[C@@](N)(CC1=CC=CC=C1)C(=O)O MCULE-8126155759 [0,1,0,0,0,1|2,0,0]=4 976 B13R1.1073 C[C@](N)(CC1=CC=CC=C1)C(=O)O MCULE-1833368325 [0,1,0,0,0,1|2,0,0]=4 977 B13R1.1073 C[C@](N)(CC1=CC=CC=C1)C(=O)O MCULE-7774485933 [0,1,0,0,0,1|2,0,0]=4 978 B13R1.1073 NC(O)(CC1=CC=CC=C1)C(=O)O MCULE-3023341284 [0,1,0,0,0,1|2,0,0]=4 979 B13R1.339 NC(CC(=O)C1=CC=CS1)C(=O)O MCULE-3001867467 [0,1,0,0,0,1|2,0,0]=4 980 B13R1.134 COC(=O)C(N)CC1=CN(C=N1)C MCULE-1161726679 [0,2,0,0,0,0|0,0,2]=4 981 B13R1.134 COC(=O)C(N)CC1=CN(C=N1)C MCULE-8450355930 [0,2,0,0,0,0|0,0,2]=4 982 B13R1.134 COC(=O)C(N)CC1=CN(N=C1)C MCULE-5900845921 [0,2,0,0,0,0|2,0,0]=4 983 B13R1.134 COC(=O)[C@@H](N)CC1=CC=C(S1)C MCULE-6848336004 [0,2,0,0,0,0|2,0,0]=4 984 B13R1.134 COC(=O)[C@@H](N)CC1=CC=C(S1)Cl MCULE-8685697536 [0,2,0,0,0,0|2,0,0]=4 985 B13R1.134 COC(=O)[C@@H](N)CC1=CN(C=N1)C MCULE-1729680041 [0,2,0,0,0,0|0,0,2]=4 986 B13R1.134 COC(=O)[C@@H](N)CC1=CN(C=N1)C MCULE-2938188839 [0,2,0,0,0,0|0,0,2]=4 987 B13R1.134 COC(=O)[C@@H](N)CC1=CN(C=N1)C MCULE-3472013655 [0,2,0,0,0,0|0,0,2]=4 988 B13R1.134 COC(=O)[C@@H](N)CC1=CN(C=N1)C MCULE-8175161010 [0,2,0,0,0,0|0,0,2]=4 989 B13R1.134 COC(=O)[C@@H](N)CC1=CN(N=C1)C MCULE-9312682694 [0,2,0,0,0,0|2,0,0]=4 990 B13R1.134 COC(=O)[C@H](N)CC1=CC=C(S1)C MCULE-5990308296 [0,2,0,0,0,0|2,0,0]=4 991 B13R1.134 COC(=O)[C@H](N)CC1=CC=C(S1)Cl MCULE-7062678935 [0,2,0,0,0,0|2,0,0]=4 992 B13R1.134 COC(=O)[C@H](N)CC1=CN(N=C1)C MCULE-9980173214 [0,2,0,0,0,0|2,0,0]=4 993 B13R1.3429 CC(N)(CC1=CC=C(S1)Br)C(=O)O MCULE-6460783832 [0,2,0,0,0,0|2,0,0]=4 994 B13R1.3481 CC1=NN(C(=C1)CC(N)C(=O)O)C MCULE-7052233785 [0,2,0,0,0,0|2,0,0]=4 995 B13R1.3481 CC1=NN(C(=C1)CC(N)C(=O)O)C MCULE-8229929653 [0,2,0,0,0,0|2,0,0]=4 996 B13R1.5896 CC1=C(C=NN1C)CC(N)C(=O)O MCULE-4268561975 [0,2,0,0,0,0|2,0,0]=4 997 B13R1.5896 CC1=C(ON=C1O)C[C@@H](N)C(=O)O MCULE-7614933775 [0,2,0,0,0,0|2,0,0]=4 998 B13R1.5896 CC1=C(ON=C1O)C[C@H](N)C(=O)O MCULE-8406387032 [0,2,0,0,0,0|2,0,0]=4 999 B13R1.66 CCOC(=O)C(C)CC1=CC=CN1 MCULE-7657841230 [0,2,0,0,0,0|2,0,0]=4 1000 B13R1.66 CCOC(=O)C(N)CC1=CNC=N1 MCULE-3872787530 [0,2,0,0,0,0|0,0,2]=4 1001 B13R1.66 CCOC(=O)C(N)CC1=CNC=N1 MCULE-8972710163 [0,2,0,0,0,0|0,0,2]=4 1002 B13R1.66 CCOC(=O)[C@@H](N)CC1=CNC=N1 MCULE-1557607999 [0,2,0,0,0,0|0,0,2]=4 1003 B13R1.66 CCOC(=O)[C@@H](N)CC1=CNC=N1 MCULE-3018944736 [0,2,0,0,0,0|0,0,2]=4 1004 B13R1.66 CCOC(=O)[C@@H](N)CC1=CNC=N1 MCULE-3309488051 [0,2,0,0,0,0|0,0,2]=4 1005 B13R1.66 CCOC(=O)[C@@H](N)CC1=CNC=N1 MCULE-3791539661 [0,2,0,0,0,0|0,0,2]=4 1006 B13R1.66 CCOC(=O)[C@@H](N)CC1=CNC=N1 MCULE-7039442133 [0,2,0,0,0,0|0,0,2]=4 1007 B13R1.704 COC(=O)C(N)CC1=CC=CN1C MCULE-4851742309 [0,2,0,0,0,0|1,0,0]=3 1008 B13R1.704 COC(=O)C(N)CC1=CN=CN1C MCULE-4041428391 [0,2,0,0,0,0|0,0,0]=2 1009 B13R1.704 COC(=O)C(N)CC1=CN=CN1C MCULE-4051657005 [0,2,0,0,0,0|0,0,0]=2 1010 B13R1.704 COC(=O)[C@@H](N)CC1=C(C=CS1)Br MCULE-2577651819 [0,2,0,0,0,0|2,0,0]=4 1011 B13R1.704 COC(=O)[C@@H](N)CC1=C(C=CS1)Br MCULE-8914759431 [0,2,0,0,0,0|2,0,0]=4 1012 B13R1.704 COC(=O)[C@@H](N)CC1=C(SC=C1)Cl MCULE-2304536711 [0,2,0,0,0,0|2,0,0]=4 1013 B13R1.704 COC(=O)[C@H](N)CC1=C(SC=C1)Cl MCULE-7797355306 [0,2,0,0,0,0|2,0,0]=4 1014 B13R1.721 CN[C@@H](CC1=CNC=N1)C(=O)OC MCULE-2405422259 [0,2,0,0,0,0|0,0,2]=4 1015 B13R1.721 CN[C@@H](CC1=CNC=N1)C(=O)OC MCULE-2881338467 [0,2,0,0,0,0|0,0,2]=4 1016 B13R1.721 CN[C@@H](CC1=CNC=N1)C(=O)OC MCULE-3895444667 [0,2,0,0,0,0|0,0,2]=4 1017 B13R1.721 CN[C@@H](CC1=CNC=N1)C(=O)OC MCULE-6334517045 [0,2,0,0,0,0|0,0,2]=4 1018 B13R1.1773 COC(=O)C(C)(N)CN1C=CN=C1 MCULE-8322165518 [0,2,0,0,0,0|2,0,0]=4 1019 B13R1.1773 COC(=O)C(C)(N)CN1C=NC=N1 MCULE-4711967984 [0,2,0,0,0,0|1,0,1]=4 1020 B13R1.421 CC1=C(SC=N1)CC(C#N)C(=O)O MCULE-7207249538 [0,2,0,0,0,0|1,0,1]=4 1021 B13R1.2801 CCN1C=NC=C1C[C@H](N)C(=O)O MCULE-6666594551 [0,2,0,0,0,0|0,0,0]=2 1022 B13R1.2801 CCN1C=NC=C1C[C@H](N)C(=O)O MCULE-6935214570 [0,2,0,0,0,0|0,0,0]=2 1023 B13R1.7553 CC1=C(C(=NO1)O)CC(N)C(=O)O MCULE-6459705040 [0,2,0,0,0,0|2,0,0]=4 1024 B13R1.7553 CC1=C(C(=NO1)O)CC(N)C(=O)O MCULE-8572875801 [0,2,0,0,0,0|2,0,0]=4 1025 B13R1.7553 CC1=C(C(=NO1)O)CC(N)C(=O)O MCULE-9236186759 [0,2,0,0,0,0|2,0,0]=4 1026 B13R1.7553 CC1=C(C(=NO1)O)C[C@@H](N)C(=O)O MCULE-7430023902 [0,2,0,0,0,0|2,0,0]=4 1027 B13R1.7553 CC1=C(C(=NO1)O)C[C@H](N)C(=O)O MCULE-5889895543 [0,2,0,0,0,0|2,0,0]=4 1028 B13R1.7553 CN1C=NC(=C1C[C@H](N)C(=O)O)S MCULE-4488531209 [0,2,0,0,0,0|0,0,0]=2 1029 B13R1.695 O=CNC(CC1=CNC=N1)C(=O)O MCULE-4799476247 [0,2,0,0,0,0|0,0,2]=4 1030 B13R1.695 O=CN[C@@H](CC1=CNC=N1)C(=O)O MCULE-2584720723 [0,2,0,0,0,0|0,0,2]=4 1031 B13R1.695 O=CN[C@@H](CC1=CNC=N1)C(=O)O MCULE-9092036879 [0,2,0,0,0,0|0,0,2]=4 1032 B13R1.3571 CN(C)C(CC1=CN=CN1)C(=O)O MCULE-2883407867 [0,2,0,0,0,0|0,0,0]=2 1033 B13R1.3571 CN(C)C(CN1C=CN=C1)C(=O)O MCULE-3585650550 [0,2,0,0,0,0|2,0,0]=4 1034 B13R1.3571 CN(C)C(CN1C=NC=N1)C(=O)O MCULE-4873734785 [0,2,0,0,0,0|1,0,1]=4 1035 B13R1.3571 CN(C)[C@@H](CC1=CN=CN1)C(=O)O MCULE-1439318444 [0,2,0,0,0,0|0,0,0]=2 1036 B13R1.3571 CN(C)[C@@H](CC1=CNC=N1)C(=O)O MCULE-7081821374 [0,2,0,0,0,0|0,0,2]=4 1037 B13R1.5639 CC(CN)(CC1=CC=CO1)C(=O)O MCULE-9614080255 [0,2,0,0,0,0|2,0,0]=4 1038 B13R1.5639 CNC(C)(CN1C=CN=C1)C(=O)O MCULE-9167046993 [0,2,0,0,0,0|2,0,0]=4 1039 B13R1.5639 N[C@@](CF)(CC1=CN=CN1)C(=O)O MCULE-4430215351 [0,2,0,0,0,0|0,0,0]=2 1040 B13R1.5639 N[C@@](CF)(CC1=CN=CN1)C(=O)O MCULE-8174293073 [0,2,0,0,0,0|0,0,0]=2 1041 B13R1.5639 N[C@@](CF)(CC1=CNC=N1)C(=O)O MCULE-3527928511 [0,2,0,0,0,0|0,0,2]=4 1042 B11R1.74 N=C1NC(=O)CC(S1)C(=O)O MCULE-5822428129 [0,0,1,1,0,0|2,0,0]=4 1043 B11R1.74 O=C1CC(NC(=O)N1)C(=O)O MCULE-8091289320 [0,0,1,1,0,0|2,0,0]=4 1044 B11R1.74 O=C1C[C@@H](NC(=O)N1)C(=O)O MCULE-4074220021 [0,0,1,1,0,0|2,0,0]=4 1045 B11R1.74 O=C1C[C@@H](NC(=O)N1)C(=O)O MCULE-7764195040 [0,0,1,1,0,0|2,0,0]=4 1046 B11R1.74 O=C1C[C@H](NC(=O)N1)C(=O)O MCULE-6513392402 [0,0,1,1,0,0|2,0,0]=4 1047 B11R1.74 O=C1C[C@H](NC(=O)N1)C(=O)O MCULE-7404763627 [0,0,1,1,0,0|2,0,0]=4 1048 B11R1.36 NC(C(=O)O)C1=CC=CN=C1 MCULE-1136849880 [0,0,1,1,0,0|1,0,1]=4 1049 B11R1.36 NC(C(=O)O)C1=CC=NC=C1 MCULE-2612527743 [0,0,1,1,0,0|1,0,1]=4 1050 B11R1.36 NC(C(=O)O)C1=CC=NC=C1 MCULE-7350629934 [0,0,1,1,0,0|1,0,1]=4 1051 B11R1.36 NC(C(=O)O)C1=CC=NC=C1 MCULE-8285204666 [0,0,1,1,0,0|1,0,1]=4 1052 B11R1.36 NC(C(=O)O)C1=CN=CC=C1 MCULE-8130952741 [0,0,1,1,0,0|1,0,1]=4 1053 B11R2.36 NC1CCN2C=NC=C2C1 MCULE-2183303133 [1,0,0,1,0,0|1,0,1]=4 1054 B11R2.36 NC1CCN2C=NC=C2C1 MCULE-7076033432 [1,0,0,1,0,0|1,0,1]=4 1055 B13R2.369 NC1CC2=CC=CN=C2NC1=O MCULE-3971600733 [0,0,0,1,0,1|2,0,0]=4 1056 B13R2.369 NC1CC2=CC=CN=C2NC1=O MCULE-8620358704 [0,0,0,1,0,1|2,0,0]=4 1057 B13R2.369 NC1CC2=CN=CC=C2NC1=O MCULE-5515582270 [0,0,0,1,0,1|2,0,0]=4 1058 B13R2.369 NC1CC2=CN=CC=C2NC1=O MCULE-6016305103 [0,0,0,1,0,1|2,0,0]=4 1059 B13R2.369 N[C@H]1CC2=C(N=CC=C2)NC1=O MCULE-1237241471 [0,0,0,1,0,1|2,0,0]=4 1060 B13R2.369 N[C@H]1CC2=C(N=CC=C2)NC1=O MCULE-4895114296 [0,0,0,1,0,1|2,0,0]=4 1061 B13R2.423 O=C(O)C1CC1C2=CC=NC=C2 MCULE-8765058862 [0,0,0,1,0,1|2,0,0]=4 1062 B13R2.423 O=C(O)C1CC1C2=CN=CC=C2 MCULE-6747176716 [0,0,0,1,0,1|2,0,0]=4 1063 B13R2.423 O=C(O)C1CC1C2=CN=CN=C2 MCULE-3291841753 [0,0,0,1,0,1|1,0,1]=4 1064 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 1065 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 1066 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 1067 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 1068 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 1069 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 1070 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 1071 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 1072 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 1073 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 1074 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 1075 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 1076 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 1077 B13R2.435 O=C(O)C1CC2=C(C1)C=NC=C2 MCULE-1316584114 [0,0,0,1,0,1|2,0,0]=4 1078 B13R2.435 O=C(O)C1CC2=C(C1)C=NC=C2 MCULE-4209278865 [0,0,0,1,0,1|2,0,0]=4 1079 B13R2.435 O=C(O)C1CC2=C(N1)C=CC=C2 MCULE-2562454412 [0,0,0,1,0,1|2,0,0]=4 1080 B13R2.435 O=C(O)C1CC2=C(N1)C=CC=C2 MCULE-7215841209 [0,0,0,1,0,1|2,0,0]=4 1081 B13R2.435 O=C(O)C1CC2=CC=CN=C2C1 MCULE-2688790100 [0,0,0,1,0,1|2,0,0]=4 1082 B13R2.435 O=C(O)C1CC2=CC=CN=C2C1 MCULE-3306473482 [0,0,0,1,0,1|2,0,0]=4 1083 B13R2.435 O=C(O)C1CC2=CC=CN=C2N1 MCULE-8537870180 [0,0,0,1,0,1|1,0,0]=3 1084 B13R2.435 O=C(O)[C@@H]1CC2=C(N1)C=CC=C2 MCULE-7672663112 [0,0,0,1,0,1|2,0,0]=4 1085 B13R2.435 O=C(O)[C@@H]1CC2=CC=CC=C2N1 MCULE-8181141847 [0,0,0,1,0,1|2,0,0]=4 1086 B13R2.435 O=C(O)[C@@H]1CC2=CC=CN=C2N1 MCULE-4315790053 [0,0,0,1,0,1|1,0,0]=3 1087 B13R2.435 O=C(O)[C@H]1CC2=C(N1)C=CC=C2 MCULE-1818842898 [0,0,0,1,0,1|2,0,0]=4 1088 B13R2.435 O=C(O)[C@H]1CC2=C(N1)C=CC=C2 MCULE-5551098234 [0,0,0,1,0,1|2,0,0]=4 1089 B13R2.430 O=C(O)C1CC2=C(CN1)NC=N2 MCULE-2794412069 [0,0,0,1,0,1|1,0,0]=3 1090 B13R2.430 O=C(O)C1CC2=C(CN1)NC=N2 MCULE-6656035496 [0,0,0,1,0,1|1,0,0]=3 1091 B13R2.430 O=C(O)C1CC2=C(CN1)NC=N2 MCULE-9394231655 [0,0,0,1,0,1|1,0,0]=3 1092 B13R2.430 O=C(O)C1CCC2=C(C1)N=CN2 MCULE-2502266097 [0,0,0,1,0,1|1,0,0]=3 1093 B13R2.430 O=C(O)C1CCC2=C(C1)N=CN2 MCULE-3060898750 [0,0,0,1,0,1|1,0,0]=3 1094 B13R2.430 O=C(O)C1CCC2=CN=CN2C1 MCULE-3102985110 [0,0,0,1,0,1|1,0,0]=3 1095 B13R2.430 O=C(O)C1CCC2=CN=CN2C1 MCULE-5865264817 [0,0,0,1,0,1|1,0,0]=3 1096 B13R2.430 O=C(O)C1CCC2=NN=CN2C1 MCULE-4377302580 [0,0,0,1,0,1|2,0,0]=4 1097 B13R2.430 O=C(O)C1CN2C=NN=C2CN1 MCULE-3312647876 [0,0,0,1,0,1|2,0,0]=4 1098 B13R2.430 O=C(O)C1CN2C=NN=C2CN1 MCULE-4172774230 [0,0,0,1,0,1|2,0,0]=4 1099 B13R2.430 O=C(O)[C@@H]1CC2=C(CN1)NC=N2 MCULE-1369331295 [0,0,0,1,0,1|1,0,0]=3 1100 B13R2.430 O=C(O)[C@@H]1CC2=C(CN1)NC=N2 MCULE-3393242863 [0,0,0,1,0,1|1,0,0]=3 1101 B13R2.430 O=C(O)[C@@H]1CC2=C(CN1)NC=N2 MCULE-3796625327 [0,0,0,1,0,1|1,0,0]=3 1102 B13R2.430 O=C(O)[C@@H]1CC2=C(CN1)NC=N2 MCULE-4955875244 [0,0,0,1,0,1|1,0,0]=3 1103 B13R2.430 O=C(O)[C@H]1CC2=C(CN1)NC=N2 MCULE-8729613474 [0,0,0,1,0,1|1,0,0]=3 1104 B13R2.5590 NC1(CC1C2=CC=CO2)C(=O)O MCULE-5497906551 [0,0,0,1,0,1|2,0,0]=4 1105 B13R2.5590 NC1(CC1C2=CC=CS2)C(=O)O MCULE-2058019854 [0,0,0,1,0,1|2,0,0]=4 1106 B13R2.3678 CC1=NN=C2N1CC(C2)C(=O)O MCULE-4885025527 [0,1,0,1,0,0|2,0,0]=4 1107 B13R2.3437 CN1C=CC=C1C2CC2C(=O)O MCULE-4282999741 [0,1,0,1,0,0|2,0,0]=4 1108 B9R1.11 C=C[C@@H](N)C1=CC=CN1 MCULE-2039273360 [1,0,0,0,1,0|2,0,0]=4 1109 B9R1.11 C=C[C@@H](N)C1=CC=CN1 MCULE-5563891659 [1,0,0,0,1,0|2,0,0]=4 1110 B9R1.11 C=C[C@H](N)C1=CC=CN1 MCULE-2024102559 [1,0,0,0,1,0|2,0,0]=4 1111 B9R1.11 C=C[C@H](N)C1=CC=CN1 MCULE-6215815299 [1,0,0,0,1,0|2,0,0]=4 1112 B9R1.11 N[C@@H](CO)C1=CC=CN1 MCULE-4254891194 [1,0,0,0,1,0|1,0,1]=4 1113 B9R1.11 N[C@@H](CO)C1=CC=CN1 MCULE-5205441111 [1,0,0,0,1,0|1,0,1]=4 1114 B9R1.11 N[C@H](CO)C1=CC=CN1 MCULE-3731213941 [1,0,0,0,1,0|1,0,1]=4 1115 B9R1.11 N[C@H](CO)C1=CC=CN1 MCULE-7131218904 [1,0,0,0,1,0|1,0,1]=4 1116 B11R1.40 NC(CO)CC1=CC=NC=C1 MCULE-7649552853 [1,0,0,0,0,1|1,0,1]=4 1117 B11R1.40 NC(CO)CC1=CC=NC=C1 MCULE-9792012975 [1,0,0,0,0,1|1,0,1]=4 1118 B11R1.40 NC(CO)CC1=CN=CC=C1 MCULE-5682317971 [1,0,0,0,0,1|1,0,1]=4 1119 B11R1.40 NC(CO)CC1=CN=CC=C1 MCULE-8457722347 [1,0,0,0,0,1|1,0,1]=4 1120 B11R1.91 CC(=O)CCC1=CN=CC=C1 MCULE-8978954109 [1,0,0,0,0,1|2,0,0]=4 1121 B11R1.91 NC(=O)CCC1=CC=CN=C1 MCULE-9563578514 [1,0,0,0,0,1|2,0,0]=4 1122 B11R1.91 NC(=O)CCC1=CC=NC=C1 MCULE-7075206346 [1,0,0,0,0,1|2,0,0]=4 1123 B11R1.91 NC(=O)CCC1=CC=NC=N1 MCULE-1725058959 [1,0,0,0,0,1|1,0,1]=4 1124 B11R1.91 O=C(Cl)CCC1=CN=CC=C1 MCULE-1586300353 [1,0,0,0,0,1|2,0,0]=4 1125 B11R1.91 O=C(O)CCC1=CC=CC=C1 MCULE-1670073750 [1,0,0,0,0,1|2,0,0]=4 1126 B11R1.91 O=C(O)CCC1=CC=CC=N1 MCULE-7798422459 [1,0,0,0,0,1|1,0,1]=4 1127 B11R1.91 O=C(O)CCC1=CC=NC=C1 MCULE-4931237552 [1,0,0,0,0,1|1,0,0]=3 1128 B11R1.91 O=C(O)CCC1=CC=NN=C1 MCULE-4137232331 [1,0,0,0,0,1|1,0,0]=3 1129 B11R1.91 O=C(O)CCC1=CN=CC=C1 MCULE-9809125467 [1,0,0,0,0,1|1,0,0]=3 1130 B11R1.91 O=C(O)CCC1=CN=CN=C1 MCULE-4847571821 [1,0,0,0,0,1|0,0,1]=3 1131 B11R1.91 O=C(O)CCC1=NC=CC=C1 MCULE-3850875705 [1,0,0,0,0,1|1,0,1]=4 1132 B11R1.91 O=C(O)CCC1=NC=CC=C1 MCULE-7947562908 [1,0,0,0,0,1|1,0,1]=4 1133 B11R1.91 O=C(O)CCC1=NC=CC=N1 MCULE-6402169801 [1,0,0,0,0,1|1,0,1]=4 1134 B11R1.91 O=C(O)CCC1=NC=CN=C1 MCULE-1475251267 [1,0,0,0,0,1|0,0,1]=3 1135 B11R1.91 O=C(O)CCC1=NC=NC=C1 MCULE-1053932202 [1,0,0,0,0,1|0,0,1]=3 1136 B11R1.91 O=C(O)CCC1=NN=CC=C1 MCULE-2530115442 [1,0,0,0,0,1|1,0,1]=4 1137 B11R1.91 O=C(O)CNC1=CC=CN=C1 MCULE-1578102322 [1,0,0,0,0,1|2,0,0]=4 1138 B11R1.91 O=C(O)CNC1=CC=CN=C1 MCULE-6139247264 [1,0,0,0,0,1|2,0,0]=4 1139 B11R1.91 O=C(O)CNC1=CC=NC=C1 MCULE-3150988193 [1,0,0,0,0,1|2,0,0]=4 1140 B11R1.91 O=C(O)CNC1=CC=NC=C1 MCULE-6561822983 [1,0,0,0,0,1|2,0,0]=4 1141 B11R1.91 O=C(O)COC1=CC=NC=C1 MCULE-5903809736 [1,0,0,0,0,1|2,0,0]=4 1142 B11R1.91 O=C(O)COC1=CN=CC=C1 MCULE-1733906903 [1,0,0,0,0,1|2,0,0]=4 1143 B11R1.91 O=C(O)COC1=CN=CC=C1 MCULE-2439507515 [1,0,0,0,0,1|2,0,0]=4 1144 B11R1.91 O=C(O)COC1=CN=CC=C1 MCULE-3978081968 [1,0,0,0,0,1|2,0,0]=4 1145 B11R1.91 O=C(O)CSC1=CC=NC=C1 MCULE-7699690938 [1,0,0,0,0,1|2,0,0]=4 1146 B11R1.91 O=C(O)CSC1=CC=NC=N1 MCULE-7593533042 [1,0,0,0,0,1|1,0,1]=4 1147 B11R1.172 O=C(O)CCCC1=CC=CS1 MCULE-2208395467 [1,0,0,0,0,1|2,0,0]=4 1148 B11R1.172 O=C(O)CCCC1=CNC=C1 MCULE-4973184677 [1,0,0,0,0,1|1,0,1]=4 1149 B11R1.172 O=C(O)CCCC1=CNN=C1 MCULE-7980026315 [1,0,0,0,0,1|2,0,0]=4 1150 B11R1.172 O=C(O)CCCC1=CSC=C1 MCULE-7269389456 [1,0,0,0,0,1|2,0,0]=4 1151 B11R1.172 O=C(O)CCCC1=NN=NN1 MCULE-7596772933 [1,0,0,0,0,1|2,0,0]=4 1152 B11R1.172 O=C(O)CCCN1C=CN=C1 MCULE-6680198252 [1,0,0,0,0,1|2,0,0]=4 1153 B11R1.172 O=C(O)CCCN1C=CN=C1 MCULE-9758855479 [1,0,0,0,0,1|2,0,0]=4 1154 B11R1.172 O=C(O)CCCN1C=NC=N1 MCULE-1527903167 [1,0,0,0,0,1|1,0,1]=4 1155 B11R1.172 O=C(O)CCCN1C=NC=N1 MCULE-5051326702 [1,0,0,0,0,1|1,0,1]=4 1156 B11R1.172 O=C(O)CCSC1=CC=CS1 MCULE-5358677561 [1,0,0,0,0,1|2,0,0]=4 1157 B11R1.172 O=C(O)CCSC1=NN=CN1 MCULE-1245155688 [1,0,0,0,0,1|1,0,0]=3 1158 B11R1.172 O=C(O)CNCC1=CC=CO1 MCULE-3294949215 [1,0,0,0,0,1|2,0,0]=4 1159 B11R1.172 O=C(O)CNCC1=CN=CS1 MCULE-2451110741 [1,0,0,0,0,1|1,0,0]=3 1160 B11R1.172 O=C(O)CNCC1=CSC=C1 MCULE-8463113169 [1,0,0,0,0,1|2,0,0]=4 1161 B11R1.172 O=C(O)COCC1=CC=CO1 MCULE-2722649918 [1,0,0,0,0,1|2,0,0]=4 1162 B11R1.172 O=C(O)CSCC1=CC=CO1 MCULE-2797657778 [1,0,0,0,0,1|2,0,0]=4 1163 B11R1.172 O=C(O)CSCC1=CC=CS1 MCULE-8336860516 [1,0,0,0,0,1|2,0,0]=4 1164 B11R1.172 O=C(O)CSCC1=CSC=C1 MCULE-2925169500 [1,0,0,0,0,1|2,0,0]=4 1165 B11R1.172 O=C(O)CSCC1=CSC=N1 MCULE-9430988131 [1,0,0,0,0,1|1,0,1]=4 1166 B11R1.172 O=C(O)CSCC1=NC=CN1 MCULE-2957999026 [1,0,0,0,0,1|2,0,0]=4 1167 B11R1.172 O=C(O)CSCC1=NC=CN1 MCULE-9921381731 [1,0,0,0,0,1|2,0,0]=4 1168 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 MCULE-7312149583 [0,0,0,0,0,2|2,0,0]=4 1169 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 MCULE-7562642812 [0,0,0,0,0,2|2,0,0]=4 1170 B13R1.348 NC(CC(=O)O)CC1=CC=CN=C1 MCULE-8199109170 [0,0,0,0,0,2|1,0,0]=3 1171 B13R1.348 NC(CC(=O)O)CC1=CC=CN=C1 MCULE-8652871170 [0,0,0,0,0,2|1,0,0]=3 1172 B13R1.348 NC(CC(=O)O)CC1=CC=NC=C1 MCULE-7399531153 [0,0,0,0,0,2|1,0,0]=3 1173 B13R1.348 NC(CC(=O)O)CC1=CC=NC=C1 MCULE-8042369673 [0,0,0,0,0,2|1,0,0]=3 1174 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 MCULE-1099480064 [0,0,0,0,0,2|2,0,0]=4 1175 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 MCULE-1511536989 [0,0,0,0,0,2|2,0,0]=4 1176 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 MCULE-3741596903 [0,0,0,0,0,2|2,0,0]=4 1177 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 MCULE-5386657741 [0,0,0,0,0,2|2,0,0]=4 1178 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CN=C1 MCULE-1669200894 [0,0,0,0,0,2|1,0,0]=3 1179 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CN=C1 MCULE-4996936193 [0,0,0,0,0,2|1,0,0]=3 1180 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CN=C1 MCULE-6763100819 [0,0,0,0,0,2|1,0,0]=3 1181 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CN=C1 MCULE-7308104054 [0,0,0,0,0,2|1,0,0]=3 1182 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=NC=C1 MCULE-4397380511 [0,0,0,0,0,2|1,0,0]=3 1183 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=NC=C1 MCULE-5096377673 [0,0,0,0,0,2|1,0,0]=3 1184 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=NC=C1 MCULE-5896724687 [0,0,0,0,0,2|1,0,0]=3 1185 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=NC=C1 MCULE-7505313222 [0,0,0,0,0,2|1,0,0]=3 1186 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 MCULE-1213190445 [0,0,0,0,0,2|2,0,0]=4 1187 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 MCULE-4947387639 [0,0,0,0,0,2|2,0,0]=4 1188 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 MCULE-7320146706 [0,0,0,0,0,2|2,0,0]=4 1189 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 MCULE-9110835818 [0,0,0,0,0,2|2,0,0]=4 1190 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CN=C1 MCULE-1844854356 [0,0,0,0,0,2|1,0,0]=3 1191 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CN=C1 MCULE-8941416281 [0,0,0,0,0,2|1,0,0]=3 1192 B13R1.348 N[C@H](CC(=O)O)CC1=CC=NC=C1 MCULE-1243262331 [0,0,0,0,0,2|1,0,0]=3 1193 B13R1.348 N[C@H](CC(=O)O)CC1=CC=NC=C1 MCULE-2389374075 [0,0,0,0,0,2|1,0,0]=3 1194 B13R1.351 CC(NCC1=CN=CC=C1)C(=O)O MCULE-3524985301 [0,0,0,0,0,2|2,0,0]=4 1195 B13R1.351 CC(NCC1=CN=CC=C1)C(=O)O MCULE-4281699262 [0,0,0,0,0,2|2,0,0]=4 1196 B13R1.351 CC(OCC1=CC=NC=C1)C(=O)O MCULE-5446888299 [0,0,0,0,0,2|2,0,0]=4 1197 B13R1.351 CC(OCC1=CC=NC=C1)C(=O)O MCULE-9564089350 [0,0,0,0,0,2|2,0,0]=4 1198 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O MCULE-5846714028 [0,0,0,0,0,2|2,0,0]=4 1199 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O MCULE-6298102909 [0,0,0,0,0,2|2,0,0]=4 1200 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O MCULE-6801867186 [0,0,0,0,0,2|2,0,0]=4 1201 B13R1.351 NC(CCC1=CC=CC=N1)C(=O)O MCULE-3457547807 [0,0,0,0,0,2|1,0,1]=4 1202 B13R1.351 NC(CCC1=CC=CC=N1)C(=O)O MCULE-8849197069 [0,0,0,0,0,2|1,0,1]=4 1203 B13R1.351 NC(CCC1=CC=NC=C1)C(=O)O MCULE-3830291208 [0,0,0,0,0,2|1,0,0]=3 1204 B13R1.351 NC(CCC1=CC=NC=C1)C(=O)O MCULE-7407312060 [0,0,0,0,0,2|1,0,0]=3 1205 B13R1.351 NC(CNC1=CC=CC=C1)C(=O)O MCULE-6123987164 [0,0,0,0,0,2|2,0,0]=4 1206 B13R1.351 NC(COC1=CC=CC=C1)C(=O)O MCULE-1983365366 [0,0,0,0,0,2|2,0,0]=4 1207 B13R1.351 NC(CSC1=CC=CC=C1)C(=O)O MCULE-1203820662 [0,0,0,0,0,2|2,0,0]=4 1208 B13R1.351 NC(CSC1=CC=CC=C1)C(=O)O MCULE-9787337080 [0,0,0,0,0,2|2,0,0]=4 1209 B13R1.351 NC(CSC1=CC=NC=C1)C(=O)O MCULE-7653730988 [0,0,0,0,0,2|1,0,0]=3 1210 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O MCULE-4559879821 [0,0,0,0,0,2|2,0,0]=4 1211 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O MCULE-6703664755 [0,0,0,0,0,2|2,0,0]=4 1212 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O MCULE-6919063042 [0,0,0,0,0,2|2,0,0]=4 1213 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O MCULE-8742414639 [0,0,0,0,0,2|2,0,0]=4 1214 B13R1.351 N[C@@H](CNC1=CC=CC=C1)C(=O)O MCULE-8235847783 [0,0,0,0,0,2|2,0,0]=4 1215 B13R1.351 N[C@@H](COC1=CC=CC=C1)C(=O)O MCULE-3653516384 [0,0,0,0,0,2|2,0,0]=4 1216 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O MCULE-3064974464 [0,0,0,0,0,2|2,0,0]=4 1217 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O MCULE-7600953452 [0,0,0,0,0,2|2,0,0]=4 1218 B13R1.351 N[C@@H](C[Se]C1=CC=CC=C1)C(=O)O MCULE-2645239845 [0,0,0,0,0,2|2,0,0]=4 1219 B13R1.351 N[C@@H](C[Se]C1=CC=CC=C1)C(=O)O MCULE-2650735200 [0,0,0,0,0,2|2,0,0]=4 1220 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O MCULE-4182463122 [0,0,0,0,0,2|2,0,0]=4 1221 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O MCULE-5087054270 [0,0,0,0,0,2|2,0,0]=4 1222 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O MCULE-7679113471 [0,0,0,0,0,2|2,0,0]=4 1223 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O MCULE-7791619414 [0,0,0,0,0,2|2,0,0]=4 1224 B13R1.351 N[C@H](COC1=CC=CC=C1)C(=O)O MCULE-1181768450 [0,0,0,0,0,2|2,0,0]=4 1225 B13R1.351 N[C@H](COC1=CC=CC=C1)C(=O)O MCULE-2658156823 [0,0,0,0,0,2|2,0,0]=4 1226 B13R1.351 N[C@H](CSC1=CC=CC=C1)C(=O)O MCULE-7999236192 [0,0,0,0,0,2|2,0,0]=4