0 B14R2.2 C=C(Br)CN1C=NC2=CC=CC=C12 MCULE-1295614907 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.2 C=C(C)CN1C=NC2=CC=CC=C12 MCULE-1888599617 [0,0,0,0,0,0|3,0,1]=4 2 B14R2.2 C=C(C)CN1C=NC2=CC=CC=C12 MCULE-7151975525 [0,0,0,0,0,0|3,0,1]=4 3 B14R2.2 CC(=O)/C=C/1\OCC2=C1C=CC=C2 MCULE-7640594872 [0,0,0,0,0,0|3,0,1]=4 4 B14R2.2 CC(=O)C=C1OCC2=C1C=CC=C2 MCULE-7798317748 [0,0,0,0,0,0|3,0,1]=4 5 B14R2.2 CC(=O)CC1=CNC2=CC=CC=C12 MCULE-4629595835 [0,0,0,0,0,0|1,0,0]=1 6 B14R2.2 CC(=O)CC1=COC2=C1C=CC=C2 MCULE-3973293992 [0,0,0,0,0,0|2,0,0]=2 7 B14R2.2 CC(=O)CN1C=NC2=CC=CC=C12 MCULE-3832574750 [0,0,0,0,0,0|2,0,1]=3 8 B14R2.2 CC(=O)CN1N=NC2=C1C=CC=C2 MCULE-9224724754 [0,0,0,0,0,0|3,0,1]=4 9 B14R2.2 CC(=O)NC1=COC2=C1C=CC=C2 MCULE-9807063985 [0,0,0,0,0,0|3,0,0]=3 10 B14R2.2 CC(=O)NC1=CSC2=C1C=CC=C2 MCULE-7792331332 [0,0,0,0,0,0|3,0,0]=3 11 B14R2.2 CC(=O)OC1=CNC2=C1C=CC=C2 MCULE-7756909848 [0,0,0,0,0,0|2,0,0]=2 12 B14R2.2 CC(=O)OC1=CNC2=NC=CC=C12 MCULE-5449366993 [0,0,0,0,0,0|3,0,0]=3 13 B14R2.2 CC(=O)OC1=COC2=CC=CC=C12 MCULE-4744302330 [0,0,0,0,0,0|3,0,0]=3 14 B14R2.2 CC(=O)OC1=CSC2=CC=CC=C12 MCULE-3834495045 [0,0,0,0,0,0|3,0,0]=3 15 B14R2.2 CC(=O)OC1=NNC2=C1C=CC=C2 MCULE-2085686123 [0,0,0,0,0,0|3,0,0]=3 16 B14R2.2 CC(N)CC1=C2C=CC=CN2N=C1 MCULE-1832618235 [0,0,0,0,0,0|2,0,2]=4 17 B14R2.2 CC(N)CC1=CN=C2N1C=CC=C2 MCULE-2735315278 [0,0,0,0,0,0|2,0,2]=4 18 B14R2.2 CC(N)CC1=CN=C2N1C=CC=C2 MCULE-8841847852 [0,0,0,0,0,0|2,0,2]=4 19 B14R2.2 CC(N)CC1=CNC2=CC=CC=C12 MCULE-6417482430 [0,0,0,0,0,0|1,0,1]=2 20 B14R2.2 CC(N)CC1=CSC2=CC=CC=C12 MCULE-6169331711 [0,0,0,0,0,0|2,0,1]=3 21 B14R2.2 CC(N)CN1C=CC2=C1C=CC=C2 MCULE-1413579656 [0,0,0,0,0,0|3,0,1]=4 22 B14R2.2 CC(O)CC1=CNC2=CC=CC=C12 MCULE-4095237423 [0,0,0,0,0,0|1,0,2]=3 23 B14R2.2 CC([NH3+])CC1=CNC2=C1C=CC=C2 MCULE-6948366681 [0,0,0,0,0,0|1,0,2]=3 24 B14R2.2 CN(C)CC1=CNC2=C1C=CC=C2 MCULE-6015845238 [0,0,0,0,0,0|3,0,0]=3 25 B14R2.2 CN(C)CC1=CNC2=CC=CC=C12 MCULE-3643815953 [0,0,0,0,0,0|3,0,0]=3 26 B14R2.2 CN(C)CC1=CNC2=NC=CC=C12 MCULE-5826370064 [0,0,0,0,0,0|4,0,0]=4 27 B14R2.2 CN(C)CC1=NNC2=C1C=CC=C2 MCULE-7229788604 [0,0,0,0,0,0|4,0,0]=4 28 B14R2.2 C[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-8293811191 [0,0,0,0,0,0|1,0,1]=2 29 B14R2.2 N=C(N)CC1=CNC2=C1C=CC=C2 MCULE-5882898867 [0,0,0,0,0,0|1,0,0]=1 30 B14R2.2 N=C(N)CC1=CNC2=C1C=CC=C2 MCULE-6089875221 [0,0,0,0,0,0|1,0,0]=1 31 B14R2.2 N=C(N)SC1=CNC2=C1C=CC=C2 MCULE-1473276166 [0,0,0,0,0,0|2,0,0]=2 32 B14R2.2 N=C(N)SC1=CNC2=C1C=CC=C2 MCULE-3116269276 [0,0,0,0,0,0|2,0,0]=2 33 B14R2.2 NC(=O)CC1=CN=C2N1C=CC=C2 MCULE-4842584047 [0,0,0,0,0,0|1,0,1]=2 34 B14R2.2 NC(=O)CC1=CNC2=CC=CC=C12 MCULE-8683047927 [0,0,0,0,0,0|0,0,0]=0 35 B14R2.2 NC(=O)CC1=COC2=CC=CC=C12 MCULE-3382342505 [0,0,0,0,0,0|1,0,0]=1 36 B14R2.2 NC(=O)CC1=NOC2=C1C=CC=C2 MCULE-8439447087 [0,0,0,0,0,0|2,0,0]=2 37 B14R2.2 NC(=O)CN1C=CC2=C1C=CC=C2 MCULE-8299376429 [0,0,0,0,0,0|2,0,0]=2 38 B14R2.2 NC(=O)CN1C=NC2=CC=CC=C12 MCULE-9778164593 [0,0,0,0,0,0|1,0,1]=2 39 B14R2.2 NC(=O)CN1N=NC2=C1C=CC=C2 MCULE-1931457545 [0,0,0,0,0,0|2,0,1]=3 40 B14R2.2 NC(=O)C[N+]1=CSC2=C1C=CC=C2 MCULE-2346106431 [0,0,0,0,0,0|2,0,0]=2 41 B14R2.2 NC(=O)C[N+]1=CSC2=C1C=CC=C2 MCULE-3433199793 [0,0,0,0,0,0|2,0,0]=2 42 B14R2.2 NC(=S)CC1=CNC2=C1C=CC=C2 MCULE-8809650069 [0,0,0,0,0,0|0,1,0]=1 43 B14R2.2 NC(=S)CN1C=NC2=CC=CC=C12 MCULE-1997281019 [0,0,0,0,0,0|1,1,1]=3 44 B14R2.2 NC(=S)NC1=NNC2=C1C=CC=C2 MCULE-1305165864 [0,0,0,0,0,0|2,1,0]=3 45 B14R2.2 O=C(Cl)CC1=CNC2=CC=CC=C12 MCULE-6562481749 [0,0,0,0,0,0|1,0,0]=1 46 B14R2.2 O=C(Cl)CC1=NOC2=CC=CC=C12 MCULE-3041762539 [0,0,0,0,0,0|3,0,0]=3 47 B14R2.2 O=C(Cl)CN1CCC2=CC=CC=C12 MCULE-6402563233 [0,0,0,0,0,0|3,0,1]=4 48 B14R2.2 O=C(Cl)CN1N=NC2=C1C=CC=C2 MCULE-1652996022 [0,0,0,0,0,0|3,0,1]=4 49 B14R2.2 O=C(O)CC1=C2C=CC=CC2=CO1 MCULE-4741629356 [0,0,0,0,0,0|3,0,0]=3 50 B14R2.2 O=C(O)CC1=C2C=CC=CN2C=N1 MCULE-1957366338 [0,0,0,0,0,0|4,0,0]=4 51 B14R2.2 O=C(O)CC1=C2C=CC=CN2N=C1 MCULE-4064520120 [0,0,0,0,0,0|2,0,1]=3 52 B14R2.2 O=C(O)CC1=C2C=CNC=C2N=C1 MCULE-8161143287 [0,0,0,0,0,0|2,0,1]=3 53 B14R2.2 O=C(O)CC1=CN=C2N1C=CC=C2 MCULE-5015122117 [0,0,0,0,0,0|2,0,1]=3 54 B14R2.2 O=C(O)CC1=CN=C2N1C=CC=C2 MCULE-7817520804 [0,0,0,0,0,0|2,0,1]=3 55 B14R2.2 O=C(O)CC1=CN=C2N1N=CC=C2 MCULE-2267609654 [0,0,0,0,0,0|3,0,1]=4 56 B14R2.2 O=C(O)CC1=CN=C2N1N=CC=C2 MCULE-5364809214 [0,0,0,0,0,0|3,0,1]=4 57 B14R2.2 O=C(O)CC1=CNC2=C1C=CC=C2 MCULE-9266736782 [0,0,0,0,0,0|1,0,0]=1 58 B14R2.2 O=C(O)CC1=CNC2=C1C=CC=N2 MCULE-3393546300 [0,0,0,0,0,0|2,0,0]=2 59 B14R2.2 O=C(O)CC1=CNC2=C1C=CN=C2 MCULE-1011345996 [0,0,0,0,0,0|2,0,0]=2 60 B14R2.2 O=C(O)CC1=CNC2=C1C=CN=C2 MCULE-1460737867 [0,0,0,0,0,0|2,0,0]=2 61 B14R2.2 O=C(O)CC1=CNC2=CC=CN=C12 MCULE-7199890870 [0,0,0,0,0,0|2,0,0]=2 62 B14R2.2 O=C(O)CC1=CNC2=NC=CC=C12 MCULE-3834471692 [0,0,0,0,0,0|2,0,0]=2 63 B14R2.2 O=C(O)CC1=CNC2=NC=CN=C12 MCULE-3940180881 [0,0,0,0,0,0|3,0,0]=3 64 B14R2.2 O=C(O)CC1=COC2=C1C=CC=C2 MCULE-6197784001 [0,0,0,0,0,0|2,0,0]=2 65 B14R2.2 O=C(O)CC1=CSC2=CC=CC=C12 MCULE-5976245234 [0,0,0,0,0,0|2,0,0]=2 66 B14R2.2 O=C(O)CC1=NNC2=CC=CC=C12 MCULE-8082948728 [0,0,0,0,0,0|2,0,0]=2 67 B14R2.2 O=C(O)CC1=NNC2=NC=CC=C12 MCULE-6803403652 [0,0,0,0,0,0|3,0,0]=3 68 B14R2.2 O=C(O)CC1=NOC2=C1C=CC=C2 MCULE-4494939468 [0,0,0,0,0,0|3,0,0]=3 69 B14R2.2 O=C(O)CC1=NOC2=CC=CN=C12 MCULE-9620784043 [0,0,0,0,0,0|4,0,0]=4 70 B14R2.2 O=C(O)CC1=NSC2=C1C=CC=C2 MCULE-4666776096 [0,0,0,0,0,0|3,0,0]=3 71 B14R2.2 O=C(O)CC1CCC2=C1C=CC=C2 MCULE-1961521456 [0,0,0,0,0,0|2,0,2]=4 72 B14R2.2 O=C(O)CC1CNC2=C1C=CC=C2 MCULE-4485519781 [0,0,0,0,0,0|1,0,2]=3 73 B14R2.2 O=C(O)CC1CNC2=C1C=CC=C2 MCULE-9569578698 [0,0,0,0,0,0|1,0,2]=3 74 B14R2.2 O=C(O)CC1COC2=C1C=CC=C2 MCULE-2236868857 [0,0,0,0,0,0|2,0,2]=4 75 B14R2.2 O=C(O)CN1C=CC2=C1N=CC=C2 MCULE-8241373108 [0,0,0,0,0,0|4,0,0]=4 76 B14R2.2 O=C(O)CN1C=CC2=CC=CC=C12 MCULE-3243128001 [0,0,0,0,0,0|3,0,0]=3 77 B14R2.2 O=C(O)CN1C=NC2=CC=CC=C12 MCULE-5269416736 [0,0,0,0,0,0|2,0,1]=3 78 B14R2.2 O=C(O)CN1C=NC2=CC=CC=C12 MCULE-6499795191 [0,0,0,0,0,0|2,0,1]=3 79 B14R2.2 O=C(O)CN1CCC2=C1C=CC=C2 MCULE-2787979324 [0,0,0,0,0,0|3,0,1]=4 80 B14R2.2 O=C(O)CN1CCC2=C1C=CC=C2 MCULE-5770674919 [0,0,0,0,0,0|3,0,1]=4 81 B14R2.2 O=C(O)CN1N=CC2=CC=CC=C12 MCULE-7817622881 [0,0,0,0,0,0|4,0,0]=4 82 B14R2.2 O=C(O)CN1N=NC2=C1C=CC=C2 MCULE-6198639583 [0,0,0,0,0,0|3,0,1]=4 83 B14R2.2 O=C(O)C[N+]1=CSC2=C1C=CC=C2 MCULE-4561417538 [0,0,0,0,0,0|3,0,0]=3 84 B14R2.2 O=C([O-])CC1=CNC2=C1C=CC=C2 MCULE-3608225852 [0,0,0,0,0,0|1,0,0]=1 85 B14R2.2 O=C([O-])CC1=CNC2=C1C=CC=C2 MCULE-7228643156 [0,0,0,0,0,0|1,0,0]=1 86 B14R2.2 O=C([O-])CN1C=NC2=C1C=CC=C2 MCULE-6338092837 [0,0,0,0,0,0|2,0,1]=3 87 B14R2.2 O=C([O-])CN1CCC2=C1C=CC=C2 MCULE-5460101865 [0,0,0,0,0,0|3,0,1]=4 88 B14R2.2 O=C([O-])CN1N=NC2=C1C=CC=C2 MCULE-1842670806 [0,0,0,0,0,0|3,0,1]=4 89 B14R2.2 O=C([O-])C[N+]1=CSC2=C1C=CC=C2 MCULE-1340674051 [0,0,0,0,0,0|3,0,0]=3 90 B13R2.1 BrCCC1=CNC2=CC=CC=C12 MCULE-7970040548 [1,0,0,0,0,0|1,0,1]=3 91 B13R2.1 C=CCC1=CNC2=C1C=CC=C2 MCULE-3755785484 [1,0,0,0,0,0|1,0,0]=2 92 B13R2.1 C=CCN1C=NC2=CC=CC=C12 MCULE-1016417058 [1,0,0,0,0,0|2,0,1]=4 93 B13R2.1 C=CCN1C=NC2=CC=CC=C12 MCULE-4730128626 [1,0,0,0,0,0|2,0,1]=4 94 B13R2.1 C=CC[N+]1=CSC2=C1C=CC=C2 MCULE-7592644002 [1,0,0,0,0,0|3,0,0]=4 95 B13R2.1 C=CC[N+]1=CSC2=C1C=CC=C2 MCULE-8769416262 [1,0,0,0,0,0|3,0,0]=4 96 B13R2.1 CNCC1=CNC2=C1C=CC=C2 MCULE-9047737801 [1,0,0,0,0,0|2,0,0]=3 97 B13R2.1 CNCC1=CNC2=NC=CC=C12 MCULE-5684641489 [1,0,0,0,0,0|3,0,0]=4 98 B13R2.1 CNCC1=CNC2=NC=CC=C12 MCULE-6551207812 [1,0,0,0,0,0|3,0,0]=4 99 B13R2.1 CNCC1=COC2=CC=CC=C12 MCULE-6950410380 [1,0,0,0,0,0|3,0,0]=4 100 B13R2.1 CNCC1=COC2=CC=CC=C12 MCULE-9111623154 [1,0,0,0,0,0|3,0,0]=4 101 B13R2.1 CNCC1=CSC2=C1C=CC=C2 MCULE-4376202521 [1,0,0,0,0,0|3,0,0]=4 102 B13R2.1 CNCC1=CSC2=C1C=CC=C2 MCULE-5470793084 [1,0,0,0,0,0|3,0,0]=4 103 B13R2.1 COCC1=CNC2=CC=CC=C12 MCULE-1453715736 [1,0,0,0,0,0|2,0,0]=3 104 B13R2.1 ClCCC1=CNC2=C1C=CC=C2 MCULE-9877505951 [1,0,0,0,0,0|1,0,1]=3 105 B13R2.1 ClCCC1=CNC2=NC=CC=C12 MCULE-3079129470 [1,0,0,0,0,0|2,0,1]=4 106 B13R2.1 N#CCC1=CNC2=C1C=CC=C2 MCULE-6428652739 [1,0,0,0,0,0|0,0,2]=3 107 B13R2.1 N#CCC1=CNC2=C1C=CC=N2 MCULE-4158591942 [1,0,0,0,0,0|1,0,2]=4 108 B13R2.1 N#CCC1=CNC2=C1C=NC=C2 MCULE-7837319835 [1,0,0,0,0,0|1,0,2]=4 109 B13R2.1 N#CCC1=CNC2=C1N=CC=C2 MCULE-3641390243 [1,0,0,0,0,0|1,0,2]=4 110 B13R2.1 N#CCC1=COC2=CC=CC=C12 MCULE-7242052261 [1,0,0,0,0,0|1,0,2]=4 111 B13R2.1 N#CCC1=CSC2=C1C=CC=C2 MCULE-9427542606 [1,0,0,0,0,0|1,0,2]=4 112 B13R2.1 N#CCC1=NNC2=C1C=CC=C2 MCULE-8048782676 [1,0,0,0,0,0|1,0,2]=4 113 B13R2.1 NCCC1=CCC2=C1C=CC=C2 MCULE-2661013112 [1,0,0,0,0,0|1,0,1]=3 114 B13R2.1 NCCC1=CCC2=C1C=CC=C2 MCULE-5998677222 [1,0,0,0,0,0|1,0,1]=3 115 B13R2.1 NCCC1=CN=C2N1C=CC=C2 MCULE-3232960845 [1,0,0,0,0,0|1,0,2]=4 116 B13R2.1 NCCC1=CN=C2N1C=CC=C2 MCULE-6491492151 [1,0,0,0,0,0|1,0,2]=4 117 B13R2.1 NCCC1=CNC2=C1C=CC=C2 MCULE-6402431765 [1,0,0,0,0,0|0,0,1]=2 118 B13R2.1 NCCC1=CNC2=C1C=CC=N2 MCULE-6871527636 [1,0,0,0,0,0|1,0,1]=3 119 B13R2.1 NCCC1=CNC2=C1C=CN=C2 MCULE-1726648661 [1,0,0,0,0,0|1,0,1]=3 120 B13R2.1 NCCC1=CNC2=C1C=CN=C2 MCULE-7587127908 [1,0,0,0,0,0|1,0,1]=3 121 B13R2.1 NCCC1=CNC2=C1C=NC=C2 MCULE-3986262249 [1,0,0,0,0,0|1,0,1]=3 122 B13R2.1 NCCC1=CNC2=C1C=NC=C2 MCULE-7073983222 [1,0,0,0,0,0|1,0,1]=3 123 B13R2.1 NCCC1=CNC2=C1N=CC=C2 MCULE-5172198608 [1,0,0,0,0,0|1,0,1]=3 124 B13R2.1 NCCC1=CNC2=CC=CN=C12 MCULE-5751228184 [1,0,0,0,0,0|1,0,1]=3 125 B13R2.1 NCCC1=CNC2=NC=CC=C12 MCULE-5729961356 [1,0,0,0,0,0|1,0,1]=3 126 B13R2.1 NCCC1=CNC2=NC=CC=C12 MCULE-9632213722 [1,0,0,0,0,0|1,0,1]=3 127 B13R2.1 NCCC1=COC2=CC=CC=C12 MCULE-7528617628 [1,0,0,0,0,0|1,0,1]=3 128 B13R2.1 NCCC1=COC2=CC=CC=C12 MCULE-7867750419 [1,0,0,0,0,0|1,0,1]=3 129 B13R2.1 NCCC1=CSC2=C1C=CC=C2 MCULE-4237424815 [1,0,0,0,0,0|1,0,1]=3 130 B13R2.1 NCCC1=CSC2=C1C=CC=C2 MCULE-4439041927 [1,0,0,0,0,0|1,0,1]=3 131 B13R2.1 NCCC1=NNC2=C1C=CC=C2 MCULE-1354507733 [1,0,0,0,0,0|1,0,1]=3 132 B13R2.1 NCCC1=NNC2=C1C=CC=C2 MCULE-8325758175 [1,0,0,0,0,0|1,0,1]=3 133 B13R2.1 NCCC1=NOC2=C1C=CC=C2 MCULE-3151664736 [1,0,0,0,0,0|2,0,1]=4 134 B13R2.1 NCCC1=NOC2=C1C=CC=C2 MCULE-5047657632 [1,0,0,0,0,0|2,0,1]=4 135 B13R2.1 NCCC1=NSC2=C1C=CC=C2 MCULE-2503660518 [1,0,0,0,0,0|2,0,1]=4 136 B13R2.1 NCCC1=NSC2=C1C=CC=C2 MCULE-3141745623 [1,0,0,0,0,0|2,0,1]=4 137 B13R2.1 NCCC1CNC2=C1C=CC=C2 MCULE-4011745440 [1,0,0,0,0,0|0,0,3]=4 138 B13R2.1 NCCN1C=CC2=C1C=CC=C2 MCULE-9137752201 [1,0,0,0,0,0|2,0,1]=4 139 B13R2.1 NCCN1C=CC2=CC=CC=C12 MCULE-3588787751 [1,0,0,0,0,0|2,0,1]=4 140 B13R2.1 NCCN1C=CC2=CC=CC=C12 MCULE-7768705028 [1,0,0,0,0,0|2,0,1]=4 141 B13R2.1 NCCN1C=NC2=C1C=CC=C2 MCULE-4986998211 [1,0,0,0,0,0|1,0,2]=4 142 B13R2.1 NCCN1C=NC2=C1C=CC=C2 MCULE-6950259320 [1,0,0,0,0,0|1,0,2]=4 143 B13R2.1 NCCN1C=NC2=CC=CC=C12 MCULE-1272920132 [1,0,0,0,0,0|1,0,2]=4 144 B13R2.1 NN=CC1=CNC2=C1C=CC=C2 MCULE-5380513489 [1,0,0,0,0,0|1,0,1]=3 145 B13R2.1 O/N=C/C1=CNC2=C1C=CC=C2 MCULE-4454530861 [1,0,0,0,0,0|1,0,2]=4 146 B13R2.1 O=C=NC1=CNC2=C1C=CC=C2 MCULE-5249849405 [1,0,0,0,0,0|1,0,1]=3 147 B13R2.1 O=CCC1=CNC2=C1C=CC=C2 MCULE-2893533280 [1,0,0,0,0,0|0,0,0]=1 148 B13R2.1 OCCC1=CNC2=C1C=CC=C2 MCULE-8363712085 [1,0,0,0,0,0|0,0,2]=3 149 B13R2.1 OCCC1=COC2=C1C=CC=C2 MCULE-7695308896 [1,0,0,0,0,0|1,0,2]=4 150 B13R2.1 OCCC1=CSC2=C1C=CC=C2 MCULE-5213360412 [1,0,0,0,0,0|1,0,2]=4 151 B13R2.1 ON=CC1=CNC2=C1C=CC=C2 MCULE-5495833021 [1,0,0,0,0,0|1,0,2]=4 152 B13R2.1 SCCC1=CNC2=C1C=CC=C2 MCULE-4961164716 [1,0,0,0,0,0|0,1,1]=3 153 B13R2.1 [NH3+]CCC1=CNC2=C1C=CC=C2 MCULE-2705006421 [1,0,0,0,0,0|0,0,2]=3 154 B15R2.4 CCC(N)CC1=CNC2=C1C=CC=C2 MCULE-5651076502 [0,1,0,0,0,0|1,0,1]=3 155 B15R2.4 CCC(N)CC1=CNC2=C1C=CC=C2 MCULE-8710039661 [0,1,0,0,0,0|1,0,1]=3 156 B15R2.4 CCC(N)CC1=CNC2=CC=CC=C12 MCULE-7617108096 [0,1,0,0,0,0|1,0,1]=3 157 B15R2.4 CC[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-2042856337 [0,1,0,0,0,0|1,0,1]=3 158 B15R2.4 CC[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-9961177523 [0,1,0,0,0,0|1,0,1]=3 159 B15R2.4 CNC(=O)CC1=CNC2=C1C=CC=C2 MCULE-3992305884 [0,1,0,0,0,0|0,0,0]=1 160 B15R2.4 CNC(=O)CC1=NSC2=C1C=CC=C2 MCULE-3438982730 [0,1,0,0,0,0|2,0,0]=3 161 B15R2.4 CNC(=O)CN1C=NC2=C1C=CC=C2 MCULE-8620912003 [0,1,0,0,0,0|1,0,1]=3 162 B15R2.4 CNC(=O)C[N+]1=CSC2=C1C=CC=C2 MCULE-5913590258 [0,1,0,0,0,0|2,0,0]=3 163 B15R2.4 CNC(=O)C[N+]1=CSC2=C1C=CC=C2 MCULE-9608245149 [0,1,0,0,0,0|2,0,0]=3 164 B15R2.4 CNC(C)CC1=CNC2=C1C=CC=C2 MCULE-7812720422 [0,1,0,0,0,0|1,0,1]=3 165 B15R2.4 COC(=O)CC1=CN=C2N1C=CC=C2 MCULE-7310621570 [0,1,0,0,0,0|2,0,1]=4 166 B15R2.4 COC(=O)CC1=CNC2=C1C=CC=C2 MCULE-4496787216 [0,1,0,0,0,0|1,0,0]=2 167 B15R2.4 COC(=O)CC1=CNC2=NC=CC=C12 MCULE-8471137420 [0,1,0,0,0,0|2,0,0]=3 168 B15R2.4 COC(=O)CC1=COC2=CC=CC=C12 MCULE-8063421888 [0,1,0,0,0,0|2,0,0]=3 169 B15R2.4 COC(=O)CC1=NNC2=C1C=CC=C2 MCULE-9594802419 [0,1,0,0,0,0|2,0,0]=3 170 B15R2.4 COC(=O)CC1=NOC2=CC=CC=C12 MCULE-7987710845 [0,1,0,0,0,0|3,0,0]=4 171 B15R2.4 COC(=O)CC1CNC2=C1C=CC=C2 MCULE-6401142560 [0,1,0,0,0,0|1,0,2]=4 172 B15R2.4 COC(=O)CN1C=CC2=C1C=CC=C2 MCULE-3540261836 [0,1,0,0,0,0|3,0,0]=4 173 B15R2.4 N/C(=N/O)/CC1=CNC2=C1C=CC=C2 MCULE-3765624297 [0,1,0,0,0,0|0,0,1]=2 174 B15R2.4 N/C(=N\O)/CC1=CSC2=CC=CC=C12 MCULE-6364420236 [0,1,0,0,0,0|1,0,1]=3 175 B15R2.4 N/C(=N\O)/CN1C=NC2=CC=CC=C12 MCULE-9459895267 [0,1,0,0,0,0|1,0,2]=4 176 B15R2.4 NC(CO)CC1=CNC2=C1C=CC=C2 MCULE-4101569242 [0,1,0,0,0,0|0,0,2]=3 177 B15R2.4 NC(CO)CC1=CNC2=C1C=CC=C2 MCULE-4419819481 [0,1,0,0,0,0|0,0,2]=3 178 B15R2.4 NC(CO)CC1=CNC2=C1C=CC=C2 MCULE-8757853264 [0,1,0,0,0,0|0,0,2]=3 179 B15R2.4 NNC(=O)CC1=CNC2=C1C=CC=C2 MCULE-8651125112 [0,1,0,0,0,0|0,0,0]=1 180 B15R2.4 NNC(=O)CC1=NOC2=CC=CC=C12 MCULE-2030408291 [0,1,0,0,0,0|2,0,0]=3 181 B15R2.4 NNC(=O)CN1C=CC2=CC=CC=C12 MCULE-8638717608 [0,1,0,0,0,0|2,0,0]=3 182 B15R2.4 NNC(=O)CN1C=NC2=C1C=CC=C2 MCULE-9668854349 [0,1,0,0,0,0|1,0,1]=3 183 B15R2.4 NNC(=O)CN1N=NC2=C1C=CC=C2 MCULE-4375031485 [0,1,0,0,0,0|2,0,1]=4 184 B15R2.4 N[C@@H](CO)CC1=CNC2=C1C=CC=C2 MCULE-5057169498 [0,1,0,0,0,0|0,0,2]=3 185 B15R2.4 N[C@@H](CO)CC1=CNC2=C1C=CC=C2 MCULE-6263792283 [0,1,0,0,0,0|0,0,2]=3 186 B15R2.4 N[C@@H](CO)CC1=CNC2=C1C=CC=C2 MCULE-7147570312 [0,1,0,0,0,0|0,0,2]=3 187 B15R2.4 N[C@@H](CO)CC1=CNC2=CC=CC=C12 MCULE-9591598328 [0,1,0,0,0,0|0,0,2]=3 188 B15R2.4 N[C@H](CO)CC1=CNC2=C1C=CC=C2 MCULE-1258780591 [0,1,0,0,0,0|0,0,2]=3 189 B15R2.4 [C@@H](N)(CO)CC1=CNC2=C1C=CC=C2 MCULE-7424777740 [0,1,0,0,0,0|0,0,2]=3 190 B15R2.11 CC(C)(N)CC1=CNC2=CC=CC=C12 MCULE-3158163903 [0,1,0,0,0,0|1,0,1]=3 191 B15R2.11 C[N+](C)(C)CC1=CNC2=C1C=CC=C2 MCULE-3399862006 [0,1,0,0,0,0|3,0,0]=4 192 B15R2.11 C[N+](C)(C)CC1=CNC2=C1C=CC=C2 MCULE-5988746515 [0,1,0,0,0,0|3,0,0]=4 193 B15R2.11 FC(F)(F)CC1=CNC2=CC=CC=C12 MCULE-3212662249 [0,1,0,0,0,0|2,0,1]=4 194 B15R2.11 NS(=O)(=O)CC1=NOC2=C1C=CC=C2 MCULE-1873297847 [0,1,0,0,0,0|3,0,0]=4 195 B15R2.11 O=P(O)(O)OC1=CNC2=C1C=CC=C2 MCULE-4329951499 [0,1,0,0,0,0|3,0,0]=4 196 B15R2.11 O=P([O-])([O-])OC1=CNC2=C1C=CC=C2 MCULE-7377326251 [0,1,0,0,0,0|3,0,0]=4 197 B15R2.11 O=S(=O)(O)OC1=CNC2=C1C=CC=C2 MCULE-2913964954 [0,1,0,0,0,0|3,0,0]=4 198 B15R2.11 O=S(=O)([O-])OC1=CNC2=C1C=CC=C2 MCULE-3130688077 [0,1,0,0,0,0|3,0,0]=4 199 B15R2.377 CC(=O)CC1=CNC2=CC(=CC=C12)Cl MCULE-4367006692 [0,1,0,0,0,0|1,0,0]=2 200 B15R2.377 CC(=O)OC1=CNC2=C1C=CC(=C2)Br MCULE-8652630468 [0,1,0,0,0,0|2,0,0]=3 201 B15R2.377 CC(=O)OC1=CNC2=C1C=CC(=C2)Cl MCULE-1102968777 [0,1,0,0,0,0|2,0,0]=3 202 B15R2.377 CC(C)CC1=CNC2=C1C=CC(=C2)F MCULE-1460562565 [0,1,0,0,0,0|2,0,1]=4 203 B15R2.377 CC1=CC2=C(C=C1)C(=CN2)CC(=O)O MCULE-1851230852 [0,1,0,0,0,0|1,0,0]=2 204 B15R2.377 CC1=CC2=C(C=C1)C(=CN2)CN(C)C MCULE-7449562890 [0,1,0,0,0,0|3,0,0]=4 205 B15R2.377 CC1=CC2=C(C=C1)N(C=N2)CC(=O)O MCULE-1084596521 [0,1,0,0,0,0|2,0,1]=4 206 B15R2.377 CC1=CC2=C(C=C1)N(C=N2)CC(=O)O MCULE-3561070137 [0,1,0,0,0,0|2,0,1]=4 207 B15R2.377 CC1=CC=C2C(=C1)C=CN2CC(=O)O MCULE-5011690867 [0,1,0,0,0,0|3,0,0]=4 208 B15R2.377 CC1=CC=C2C(=C1)ON=C2CC(=O)O MCULE-1233355511 [0,1,0,0,0,0|3,0,0]=4 209 B15R2.377 CC1=CC=C2C(=CNC2=C1)CC(C)N MCULE-8619656770 [0,1,0,0,0,0|1,0,1]=3 210 B15R2.377 CC1=CC=C2C(=COC2=C1)CC(=O)O MCULE-6577994358 [0,1,0,0,0,0|2,0,0]=3 211 B15R2.377 CC1=CC=C2C(=COC2=C1)CC(=O)[O-] MCULE-9619363901 [0,1,0,0,0,0|2,0,0]=3 212 B15R2.377 CN(C)CC1=CNC2=C1C=CC(=C2)Br MCULE-9631552390 [0,1,0,0,0,0|3,0,0]=4 213 B15R2.377 CN(C)CC1=CNC2=C1C=CC(=C2)Cl MCULE-4662916771 [0,1,0,0,0,0|3,0,0]=4 214 B15R2.377 CN(C)CC1=CNC2=C1C=CC(=C2)F MCULE-8902688711 [0,1,0,0,0,0|3,0,0]=4 215 B15R2.377 NC(=O)CN1C=CC2=C1C=CC(=C2)Br MCULE-3665909071 [0,1,0,0,0,0|2,0,0]=3 216 B15R2.377 NC1=CC2=C(C=C1)N(C=N2)CC(=O)O MCULE-9001138899 [0,1,0,0,0,0|2,0,1]=4 217 B15R2.377 O=C(O)CC1=CNC2=C1C=CC(=C2)Br MCULE-5576207368 [0,1,0,0,0,0|1,0,0]=2 218 B15R2.377 O=C(O)CC1=CNC2=C1C=CC(=C2)Cl MCULE-8330371483 [0,1,0,0,0,0|1,0,0]=2 219 B15R2.377 O=C(O)CC1=CNC2=C1C=CC(=C2)F MCULE-5534512232 [0,1,0,0,0,0|1,0,0]=2 220 B15R2.377 O=C(O)CC1=CNC2=C1C=CC(=N2)Cl MCULE-2435711863 [0,1,0,0,0,0|2,0,0]=3 221 B15R2.377 O=C(O)CC1=CNC2=CC(=CC=C12)O MCULE-2932262739 [0,1,0,0,0,0|1,0,0]=2 222 B15R2.377 O=C(O)CC1=COC2=C1C=CC(=C2)F MCULE-4596349219 [0,1,0,0,0,0|2,0,0]=3 223 B15R2.377 O=C(O)CC1=COC2=C1C=CC(=C2)O MCULE-2650354142 [0,1,0,0,0,0|2,0,0]=3 224 B15R2.377 O=C(O)CC1=COC2=CC(=CC=C12)Br MCULE-8775600267 [0,1,0,0,0,0|2,0,0]=3 225 B15R2.377 O=C(O)CC1=COC2=CC(=CC=C12)Cl MCULE-2532015131 [0,1,0,0,0,0|2,0,0]=3 226 B15R2.377 O=C(O)CC1=NNC2=C1C=CC(=C2)Cl MCULE-2079572180 [0,1,0,0,0,0|2,0,0]=3 227 B15R2.377 O=C(O)CC1=NNC2=CC(=CC=C12)Br MCULE-8394406789 [0,1,0,0,0,0|2,0,0]=3 228 B15R2.377 O=C(O)CC1=NOC2=C1C=CC(=C2)Br MCULE-2598613242 [0,1,0,0,0,0|3,0,0]=4 229 B15R2.377 O=C(O)CC1=NOC2=C1C=CC(=C2)O MCULE-4593168478 [0,1,0,0,0,0|3,0,0]=4 230 B15R2.377 O=C(O)CC1=NOC2=CC(=CC=C12)Cl MCULE-2505954066 [0,1,0,0,0,0|3,0,0]=4 231 B15R2.377 O=C(O)CC1=NOC2=CC(=CC=C12)F MCULE-3609548251 [0,1,0,0,0,0|3,0,0]=4 232 B15R2.377 O=C(O)CN1C=CC2=C1C=CC(=C2)Br MCULE-1184388743 [0,1,0,0,0,0|3,0,0]=4 233 B15R2.377 O=C(O)CN1C=CC2=C1C=CC(=C2)F MCULE-2899872126 [0,1,0,0,0,0|3,0,0]=4 234 B15R2.377 O=C(O)CN1C=CC2=CC(=CC=C12)Cl MCULE-2944182089 [0,1,0,0,0,0|3,0,0]=4 235 B15R2.377 O=C(O)CN1C=NC2=C1C=CC(=C2)F MCULE-2789021379 [0,1,0,0,0,0|2,0,1]=4 236 B15R2.993 C=C(Br)CN1C(=O)NC2=CC=CC=C12 MCULE-6852316482 [0,1,0,0,0,0|3,0,0]=4 237 B15R2.993 C=C(C)CN1C(=O)NC2=CC=CC=C12 MCULE-2830167959 [0,1,0,0,0,0|3,0,0]=4 238 B15R2.993 CC(=O)CN1C(=O)OC2=CC=CC=C12 MCULE-8357191550 [0,1,0,0,0,0|3,0,0]=4 239 B15R2.993 CC(=O)NC1=C(OC2=C1C=CC=C2)Cl MCULE-9381181602 [0,1,0,0,0,0|3,0,0]=4 240 B15R2.993 CC1=C(C2=C(N1)C=CC=C2)CC(=O)O MCULE-2477434025 [0,1,0,0,0,0|1,0,0]=2 241 B15R2.993 CC1=C(C2=C(N1)C=CC=C2)CN(C)C MCULE-4516162416 [0,1,0,0,0,0|3,0,0]=4 242 B15R2.993 CC1=C(C2=C(N1)C=CC=C2)SC(=N)N MCULE-2071466438 [0,1,0,0,0,0|2,0,0]=3 243 B15R2.993 CC1=C(C2=C(N1)C=CC=C2)SC(=N)N MCULE-6630246124 [0,1,0,0,0,0|2,0,0]=3 244 B15R2.993 CC1=C(C2=C(N1)N=CC=C2)CC(=O)O MCULE-9803322745 [0,1,0,0,0,0|2,0,0]=3 245 B15R2.993 CC1=C(C2=C(O1)C=CC=C2)CC(=O)O MCULE-8034313758 [0,1,0,0,0,0|2,0,0]=3 246 B15R2.993 CC1=C(N2C=CC=CC2=N1)CC(=O)O MCULE-3779218621 [0,1,0,0,0,0|2,0,1]=4 247 B15R2.993 CC1=C(N2C=CC=CC2=N1)CC(=O)O MCULE-6008688494 [0,1,0,0,0,0|2,0,1]=4 248 B15R2.993 CC1=CC2=CC=CC=C2N1CC(=O)O MCULE-2919500641 [0,1,0,0,0,0|3,0,0]=4 249 B15R2.993 CC1=NC2=C(N1CC(=O)N)C=CC=C2 MCULE-7280579581 [0,1,0,0,0,0|1,0,1]=3 250 B15R2.993 CC1=NC2=CC=CC=C2N1CC(=O)O MCULE-3143721209 [0,1,0,0,0,0|2,0,1]=4 251 B15R2.993 CC1=NC2=CC=CC=C2N1CC(=O)O MCULE-7323968439 [0,1,0,0,0,0|2,0,1]=4 252 B15R2.993 CC1=NC2=CC=CC=C2N1CC(=O)[O-] MCULE-2523967335 [0,1,0,0,0,0|2,0,1]=4 253 B15R2.993 CC1=[N+](C2=C(S1)C=CC=C2)CC(=O)O MCULE-2814092707 [0,1,0,0,0,0|3,0,0]=4 254 B15R2.993 CC1=[N+](C2=C(S1)C=CC=C2)CC(=O)O MCULE-6917568314 [0,1,0,0,0,0|3,0,0]=4 255 B15R2.993 CC1CC2=C(N1CC(=O)N)C=CC=C2 MCULE-4780956084 [0,1,0,0,0,0|2,0,1]=4 256 B15R2.993 NC(=O)CN1C(=O)CC2=C1C=CC=C2 MCULE-7587314961 [0,1,0,0,0,0|2,0,0]=3 257 B15R2.993 NC(=O)CN1C(=O)OC2=C1C=CC=C2 MCULE-9179622725 [0,1,0,0,0,0|2,0,0]=3 258 B15R2.993 NC(=O)CN1C(=O)SC2=C1C=CC=C2 MCULE-4045308105 [0,1,0,0,0,0|2,0,0]=3 259 B15R2.993 NC(=O)CN1C2=CC=CC=C2N=C1Cl MCULE-6250725926 [0,1,0,0,0,0|1,0,1]=3 260 B15R2.993 NC(=O)CN1C2=CC=CC=C2N=C1S MCULE-4275554789 [0,1,0,0,0,0|1,0,1]=3 261 B15R2.993 O=C(O)C=C1C(=O)NC2=CC=CC=C12 MCULE-2066261067 [0,1,0,0,0,0|1,0,1]=3 262 B15R2.993 O=C(O)CC1=C(SC2=C1C=CC=C2)Cl MCULE-5318260515 [0,1,0,0,0,0|2,0,0]=3 263 B15R2.993 O=C(O)CC1C(=O)NC2=C1C=CC=C2 MCULE-2736811906 [0,1,0,0,0,0|1,0,1]=3 264 B15R2.993 O=C(O)CN1C(=CC2=C1C=CC=C2)I MCULE-8095832208 [0,1,0,0,0,0|3,0,0]=4 265 B15R2.993 O=C(O)CN1C(=O)CC2=C1C=CC=C2 MCULE-5577141396 [0,1,0,0,0,0|3,0,0]=4 266 B15R2.993 O=C(O)CN1C(=O)NC2=C1C=CC=C2 MCULE-1046043674 [0,1,0,0,0,0|2,0,0]=3 267 B15R2.993 O=C(O)CN1C(=O)OC2=C1C=CC=C2 MCULE-4408323669 [0,1,0,0,0,0|3,0,0]=4 268 B15R2.993 O=C(O)CN1C(=O)SC2=C1C=CC=C2 MCULE-7125482113 [0,1,0,0,0,0|3,0,0]=4 269 B15R2.993 O=C(O)CN1C(=S)SC2=C1C=CC=C2 MCULE-4123228544 [0,1,0,0,0,0|3,0,0]=4 270 B15R2.1255 CC(C(=O)N)N1N=NC2=C1C=CC=C2 MCULE-5845042726 [0,1,0,0,0,0|2,0,1]=4 271 B15R2.1255 CC(C(=O)O)N1C=CC2=CC=CC=C12 MCULE-7771418365 [0,1,0,0,0,0|3,0,0]=4 272 B15R2.1255 CC(C(=O)O)N1C=NC2=C1C=CC=C2 MCULE-6976772317 [0,1,0,0,0,0|2,0,1]=4 273 B15R2.1255 CC(C(=O)O)N1C=[NH+]C2=CC=CC=C12 MCULE-5454710476 [0,1,0,0,0,0|2,0,1]=4 274 B15R2.1255 C[C@@H](C(=O)O)N1C=CC2=C1C=CC=C2 MCULE-3855599730 [0,1,0,0,0,0|3,0,0]=4 275 B15R2.1255 NC(=O)C(=O)C1=CNC2=C1C=CC=C2 MCULE-8079887802 [0,1,0,0,0,0|0,0,1]=2 276 B15R2.1255 NC(=O)C(N)C1=NNC2=CC=CC=C12 MCULE-5090588064 [0,1,0,0,0,0|1,0,0]=2 277 B15R2.1255 NC(=O)C(N)C1=NNC2=CC=CC=C12 MCULE-8006798471 [0,1,0,0,0,0|1,0,0]=2 278 B15R2.1255 NC(C(=O)O)C1=CNC2=C1C=CC=C2 MCULE-3418323043 [0,1,0,0,0,0|1,0,0]=2 279 B15R2.1255 NC(C(=O)O)C1=CNC2=C1C=CC=N2 MCULE-6611768328 [0,1,0,0,0,0|2,0,0]=3 280 B15R2.1255 N[C@@H](C1=CNC2=CC=CC=C12)C(F)F MCULE-2395300273 [0,1,0,0,0,0|2,0,1]=4 281 B15R2.1255 N[C@@H](C1=CNC2=CC=CC=C12)C(F)F MCULE-6931434908 [0,1,0,0,0,0|2,0,1]=4 282 B15R2.1255 N[C@H](C(=O)O)C1=CNC2=C1C=CC=C2 MCULE-2652998695 [0,1,0,0,0,0|1,0,0]=2 283 B15R2.1255 N[C@H](C(=O)O)C1=CNC2=CC=CC=C12 MCULE-9368537487 [0,1,0,0,0,0|1,0,0]=2 284 B15R2.1255 N[C@H](C1=CNC2=CC=CC=C12)C(F)F MCULE-3704525825 [0,1,0,0,0,0|2,0,1]=4 285 B15R2.1255 N[C@H](C1=CNC2=CC=CC=C12)C(F)F MCULE-9778409025 [0,1,0,0,0,0|2,0,1]=4 286 B15R2.1255 O=C(Cl)C(=O)C1=CNC2=C1C=CC=C2 MCULE-9933419210 [0,1,0,0,0,0|1,0,1]=3 287 B15R2.1255 O=C(O)C(=O)C1=CNC2=C1C=CC=C2 MCULE-3151156759 [0,1,0,0,0,0|1,0,1]=3 288 B15R2.1255 O=C(O)C(=O)C1=CNC2=NC=CC=C12 MCULE-4578394025 [0,1,0,0,0,0|2,0,1]=4 289 B15R2.1255 O=C(O)C(Br)C1=NOC2=CC=CC=C12 MCULE-4791446111 [0,1,0,0,0,0|3,0,0]=4 290 B15R2.1255 O=C([O-])C(=O)C1=CNC2=NC=CC=C12 MCULE-2658684225 [0,1,0,0,0,0|2,0,1]=4 291 B15R2.1255 [NH3+][C@@H](C(=O)[O-])C1=CNC2=C1C=CC=C2 MCULE-2623705486 [0,1,0,0,0,0|1,0,0]=2 292 B15R2.9410 CC(=O)CC1=CNC2=CC=C(C=C12)Cl MCULE-9615898504 [0,1,0,0,0,0|1,0,0]=2 293 B15R2.9410 CC(=O)OC1=CNC2=C1C=C(C=C2)C MCULE-7721591080 [0,1,0,0,0,0|2,0,0]=3 294 B15R2.9410 CC(=O)OC1=CNC2=C1C=C(C=C2)F MCULE-1401178134 [0,1,0,0,0,0|2,0,0]=3 295 B15R2.9410 CC(=O)OC1=CNC2=CC=C(C=C12)Br MCULE-4252530481 [0,1,0,0,0,0|2,0,0]=3 296 B15R2.9410 CC(C)CC1=CNC2=C1C=C(C=C2)F MCULE-1453913066 [0,1,0,0,0,0|2,0,1]=4 297 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)Cl MCULE-5875373928 [0,1,0,0,0,0|1,0,1]=3 298 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)Cl MCULE-9955720207 [0,1,0,0,0,0|1,0,1]=3 299 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)F MCULE-2837435802 [0,1,0,0,0,0|1,0,1]=3 300 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)F MCULE-8954408176 [0,1,0,0,0,0|1,0,1]=3 301 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)O MCULE-7600122348 [0,1,0,0,0,0|1,0,1]=3 302 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)O MCULE-7768148728 [0,1,0,0,0,0|1,0,1]=3 303 B15R2.9410 CC(N)CC1=CNC2=CC=C(C=C12)O MCULE-2734017010 [0,1,0,0,0,0|1,0,1]=3 304 B15R2.9410 CC1=CC2=C(C=C1)N=CN2CC(=O)O MCULE-5038335178 [0,1,0,0,0,0|2,0,1]=4 305 B15R2.9410 CC1=CC2=C(C=C1)N=CN2CC(=O)O MCULE-6937293644 [0,1,0,0,0,0|2,0,1]=4 306 B15R2.9410 CC1=CC2=C(C=C1)NC=C2CC(=O)N MCULE-9176085989 [0,1,0,0,0,0|0,0,0]=1 307 B15R2.9410 CC1=CC2=C(C=C1)NC=C2CC(=O)O MCULE-1757765395 [0,1,0,0,0,0|1,0,0]=2 308 B15R2.9410 CC1=CC2=C(C=C1)NC=C2CC(C)N MCULE-4929700306 [0,1,0,0,0,0|1,0,1]=3 309 B15R2.9410 CC1=CC2=C(C=C1)SC=C2CC(=O)O MCULE-3895461249 [0,1,0,0,0,0|2,0,0]=3 310 B15R2.9410 CC1=CC=C2NC=C(C2=C1)CN(C)C MCULE-1239304316 [0,1,0,0,0,0|3,0,0]=4 311 B15R2.9410 CC1=CC=C2OC=C(C2=C1)CC(=O)O MCULE-1336420816 [0,1,0,0,0,0|2,0,0]=3 312 B15R2.9410 CC1=CC=C2ON=C(C2=C1)CC(=O)O MCULE-5267416177 [0,1,0,0,0,0|3,0,0]=4 313 B15R2.9410 CC1=CN2C(=CN=C2C=C1)CC(=O)O MCULE-9081062761 [0,1,0,0,0,0|2,0,1]=4 314 B15R2.9410 CN(C)CC1=CNC2=C1C=C(C=C2)Br MCULE-7969751778 [0,1,0,0,0,0|3,0,0]=4 315 B15R2.9410 CN(C)CC1=CNC2=C1C=C(C=C2)Cl MCULE-6526064946 [0,1,0,0,0,0|3,0,0]=4 316 B15R2.9410 CN(C)CC1=CNC2=C1C=C(C=C2)N MCULE-8554220221 [0,1,0,0,0,0|3,0,0]=4 317 B15R2.9410 CN(C)CC1=CNC2=CC=C(C=C12)F MCULE-1783162847 [0,1,0,0,0,0|3,0,0]=4 318 B15R2.9410 C[C@@H](N)CC1=CNC2=CC=C(C=C12)F MCULE-7398131426 [0,1,0,0,0,0|1,0,1]=3 319 B15R2.9410 C[C@@H](N)CC1=CNC2=CC=C(C=C12)O MCULE-2319511262 [0,1,0,0,0,0|1,0,1]=3 320 B15R2.9410 C[C@@H](N)CC1=CNC2=CC=C(C=C12)O MCULE-5638747243 [0,1,0,0,0,0|1,0,1]=3 321 B15R2.9410 NC(=O)CC1=CNC2=C1C=C(C=C2)Br MCULE-9805573352 [0,1,0,0,0,0|0,0,0]=1 322 B15R2.9410 NC(=O)CC1=COC2=CC=C(C=C12)F MCULE-4162480230 [0,1,0,0,0,0|1,0,0]=2 323 B15R2.9410 NC(=O)CC1=NNC2=C1C=C(C=C2)Cl MCULE-7212048121 [0,1,0,0,0,0|1,0,0]=2 324 B15R2.9410 NC(=O)CN1CCC2=C1C=C(C=C2)N MCULE-6031378784 [0,1,0,0,0,0|2,0,1]=4 325 B15R2.9410 O=C(O)CC1=CNC2=C1C=C(C=C2)Br MCULE-7197362248 [0,1,0,0,0,0|1,0,0]=2 326 B15R2.9410 O=C(O)CC1=CNC2=C1C=C(C=C2)Cl MCULE-6310723285 [0,1,0,0,0,0|1,0,0]=2 327 B15R2.9410 O=C(O)CC1=CNC2=C1C=C(C=C2)F MCULE-2430731854 [0,1,0,0,0,0|1,0,0]=2 328 B15R2.9410 O=C(O)CC1=CNC2=C1C=C(N=C2)Cl MCULE-2050967010 [0,1,0,0,0,0|2,0,0]=3 329 B15R2.9410 O=C(O)CC1=CNC2=C1C=C(N=C2)Cl MCULE-4430392183 [0,1,0,0,0,0|2,0,0]=3 330 B15R2.9410 O=C(O)CC1=CNC2=CC=C(C=C12)O MCULE-5193831459 [0,1,0,0,0,0|1,0,0]=2 331 B15R2.9410 O=C(O)CC1=CNC2=NC=C(C=C12)Br MCULE-3986082996 [0,1,0,0,0,0|2,0,0]=3 332 B15R2.9410 O=C(O)CC1=COC2=C1C=C(C=C2)F MCULE-7256135626 [0,1,0,0,0,0|2,0,0]=3 333 B15R2.9410 O=C(O)CC1=CSC2=C1C=C(C=C2)Br MCULE-2948177095 [0,1,0,0,0,0|2,0,0]=3 334 B15R2.9410 O=C(O)CC1=CSC2=C1C=C(C=C2)Cl MCULE-9754763413 [0,1,0,0,0,0|2,0,0]=3 335 B15R2.9410 O=C(O)CC1=NNC2=C1C=C(C=C2)Br MCULE-5745706231 [0,1,0,0,0,0|2,0,0]=3 336 B15R2.9410 O=C(O)CC1=NNC2=C1C=C(C=C2)Cl MCULE-9136773619 [0,1,0,0,0,0|2,0,0]=3 337 B15R2.9410 O=C(O)CC1=NNC2=C1C=C(C=C2)F MCULE-3457719895 [0,1,0,0,0,0|2,0,0]=3 338 B15R2.9410 O=C(O)CC1=NNC2=C1C=C(C=C2)O MCULE-5879500600 [0,1,0,0,0,0|2,0,0]=3 339 B15R2.9410 O=C(O)CC1=NOC2=C1C=C(C=C2)Br MCULE-3370590759 [0,1,0,0,0,0|3,0,0]=4 340 B15R2.9410 O=C(O)CC1=NOC2=C1C=C(C=C2)F MCULE-5386401720 [0,1,0,0,0,0|3,0,0]=4 341 B15R2.9410 O=C(O)CC1=NOC2=CC=C(C=C12)Cl MCULE-9881026598 [0,1,0,0,0,0|3,0,0]=4 342 B15R2.9410 O=C(O)CC1=NOC2=CC=C(C=C12)O MCULE-4620797319 [0,1,0,0,0,0|3,0,0]=4 343 B15R2.9410 O=C(O)CC1CNC2=C1C=C(C=C2)Br MCULE-1192678071 [0,1,0,0,0,0|1,0,2]=4 344 B15R2.9410 O=C(O)CN1C=CC2=C1C=C(C=C2)Br MCULE-4557408626 [0,1,0,0,0,0|3,0,0]=4 345 B15R2.9410 O=C(O)CN1C=CC2=C1C=C(C=C2)F MCULE-2249071902 [0,1,0,0,0,0|3,0,0]=4 346 B15R2.9410 O=C(O)CN1C=CC2=CC=C(C=C12)Cl MCULE-4291963565 [0,1,0,0,0,0|3,0,0]=4 347 B15R2.9410 O=C(O)CN1C=NC2=CC=C(C=C12)F MCULE-3845226655 [0,1,0,0,0,0|2,0,1]=4 348 B15R2.9410 O=C([O-])CC1=CNC2=C1C=C(C=C2)O MCULE-2088824557 [0,1,0,0,0,0|1,0,0]=2 349 B15R2.13587 CC(=O)OC1=CNC2=C(C=CC=C12)Cl MCULE-7319483621 [0,1,0,0,0,0|2,0,0]=3 350 B15R2.13587 CC(C)CC1=CNC2=C1C=CC=C2F MCULE-4719562494 [0,1,0,0,0,0|2,0,1]=4 351 B15R2.13587 CC1=C2C=CN(C2=CC=C1)CC(=O)O MCULE-2143107322 [0,1,0,0,0,0|3,0,0]=4 352 B15R2.13587 CC1=C2NC=C(C2=CC=C1)CC(=O)O MCULE-6230590211 [0,1,0,0,0,0|1,0,0]=2 353 B15R2.13587 CC1=C2ON=C(C2=CC=C1)CC(=O)O MCULE-5303401837 [0,1,0,0,0,0|3,0,0]=4 354 B15R2.13587 CC1=CC=CC2=C1NC=C2CC(C)N MCULE-2012819762 [0,1,0,0,0,0|1,0,1]=3 355 B15R2.13587 CC1=CC=CC2=C1NC=C2CC(C)N MCULE-8183855027 [0,1,0,0,0,0|1,0,1]=3 356 B15R2.13587 CC1=CC=CC2=C1NC=C2CN(C)C MCULE-5198958845 [0,1,0,0,0,0|3,0,0]=4 357 B15R2.13587 CC1=CC=CN2C1=NC=C2CC(=O)O MCULE-2937979030 [0,1,0,0,0,0|2,0,1]=4 358 B15R2.13587 CC1=CC=CN2C1=NC=C2CC(=O)O MCULE-9874430004 [0,1,0,0,0,0|2,0,1]=4 359 B15R2.13587 CN(C)CC1=CNC2=C1C=CC=C2Br MCULE-7047700294 [0,1,0,0,0,0|3,0,0]=4 360 B15R2.13587 CN(C)CC1=CNC2=C1C=CC=C2Cl MCULE-2834986242 [0,1,0,0,0,0|3,0,0]=4 361 B15R2.13587 NC1=C2C=CN(C2=CC=C1)CC(=O)O MCULE-5487667572 [0,1,0,0,0,0|3,0,0]=4 362 B15R2.13587 O=C(O)CC1=CNC2=C(C=CC=C12)Br MCULE-9007116109 [0,1,0,0,0,0|1,0,0]=2 363 B15R2.13587 O=C(O)CC1=CNC2=C(C=CC=C12)Cl MCULE-6743940624 [0,1,0,0,0,0|1,0,0]=2 364 B15R2.13587 O=C(O)CC1=CNC2=C1C=CC=C2F MCULE-8030160256 [0,1,0,0,0,0|1,0,0]=2 365 B15R2.13587 O=C(O)CC1=NNC2=C(C=CC=C12)Br MCULE-4135223363 [0,1,0,0,0,0|2,0,0]=3 366 B15R2.13587 O=C(O)CC1=NNC2=C(C=CC=C12)Cl MCULE-4803967281 [0,1,0,0,0,0|2,0,0]=3 367 B15R2.13587 O=C(O)CC1=NOC2=C(C=CC=C12)Br MCULE-1558897256 [0,1,0,0,0,0|3,0,0]=4 368 B15R2.13587 O=C(O)CC1=NOC2=C(C=CC=C12)F MCULE-9313455847 [0,1,0,0,0,0|3,0,0]=4 369 B15R2.13587 O=C(O)CC1=NOC2=C1C=CC=C2Cl MCULE-2780489474 [0,1,0,0,0,0|3,0,0]=4 370 B15R2.13587 O=C(O)CN1C=CC2=C(C=CC=C12)Br MCULE-6813556277 [0,1,0,0,0,0|3,0,0]=4 371 B15R2.13587 O=C(O)CN1C=CC2=C(C=CC=C12)Cl MCULE-1283285696 [0,1,0,0,0,0|3,0,0]=4 372 B15R2.13587 O=C(O)CN1C=CC2=C1C=CC=C2F MCULE-5217420101 [0,1,0,0,0,0|3,0,0]=4 373 B15R2.13587 O=C(O)CN1C=NC2=C(C=CC=C12)F MCULE-6321834838 [0,1,0,0,0,0|2,0,1]=4 374 B15R2.13624 CC(=O)CC1=CNC2=CC=CC(=C12)Cl MCULE-6944176404 [0,1,0,0,0,0|1,0,0]=2 375 B15R2.13624 CC(=O)CC1=CNC2=CC=CC(=C12)F MCULE-6372707059 [0,1,0,0,0,0|1,0,0]=2 376 B15R2.13624 CC(=O)OC1=CNC2=CC=CC(=C12)F MCULE-9760813120 [0,1,0,0,0,0|2,0,0]=3 377 B15R2.13624 CC(=O)OC1=CNC2=CC=CC(=C12)I MCULE-6208379327 [0,1,0,0,0,0|2,0,0]=3 378 B15R2.13624 CC(=O)OC1=CNC2=CC=CC(=C12)N MCULE-7945464622 [0,1,0,0,0,0|2,0,0]=3 379 B15R2.13624 CC(C)CC1=CNC2=C1C(=CC=C2)F MCULE-3544868367 [0,1,0,0,0,0|2,0,1]=4 380 B15R2.13624 CC1=C2C(=CC=C1)C=CN2CC(=O)O MCULE-2760013779 [0,1,0,0,0,0|3,0,0]=4 381 B15R2.13624 CC1=C2C(=CNC2=CC=C1)CC(=O)O MCULE-7906795026 [0,1,0,0,0,0|1,0,0]=2 382 B15R2.13624 CN(C)CC1=CNC2=C1C(=CC=C2)Br MCULE-5007676335 [0,1,0,0,0,0|3,0,0]=4 383 B15R2.13624 CN(C)CC1=CNC2=C1C(=CC=C2)F MCULE-5797929285 [0,1,0,0,0,0|3,0,0]=4 384 B15R2.13624 NC(=O)CC1=CNC2=C1C(=CC=C2)O MCULE-9143898485 [0,1,0,0,0,0|0,0,0]=1 385 B15R2.13624 O=C(O)CC1=CNC2=C1C(=CC=C2)Br MCULE-3750478780 [0,1,0,0,0,0|1,0,0]=2 386 B15R2.13624 O=C(O)CC1=CNC2=C1C(=CC=C2)Cl MCULE-1860664726 [0,1,0,0,0,0|1,0,0]=2 387 B15R2.13624 O=C(O)CC1=CNC2=C1C(=CC=C2)F MCULE-3412252005 [0,1,0,0,0,0|1,0,0]=2 388 B15R2.13624 O=C(O)CC1=CNC2=C1C(=CC=C2)O MCULE-9125368599 [0,1,0,0,0,0|1,0,0]=2 389 B15R2.13624 O=C(O)CC1=CNC2=C1C(=CC=N2)Cl MCULE-2006817564 [0,1,0,0,0,0|2,0,0]=3 390 B15R2.13624 O=C(O)CC1=CNC2=C1C(=CC=N2)Cl MCULE-7038932779 [0,1,0,0,0,0|2,0,0]=3 391 B15R2.13624 O=C(O)CC1=CNC2=NC=CC(=C12)Br MCULE-7893526030 [0,1,0,0,0,0|2,0,0]=3 392 B15R2.13624 O=C(O)CC1=NOC2=CC=CC(=C12)Br MCULE-4027992161 [0,1,0,0,0,0|3,0,0]=4 393 B15R2.13624 O=C(O)CC1=NOC2=CC=CC(=C12)Cl MCULE-6579940253 [0,1,0,0,0,0|3,0,0]=4 394 B15R2.13624 O=C(O)CN1C=CC2=C1C(=CC=C2)F MCULE-2457253773 [0,1,0,0,0,0|3,0,0]=4 395 B15R2.13624 O=C(O)CN1C=NC2=C1C(=CC=C2)F MCULE-1775248770 [0,1,0,0,0,0|2,0,1]=4 396 B15R2.53147 CC(=O)OC1=CN(C2=C1C=CC=C2)C MCULE-1881490859 [0,1,0,0,0,0|2,0,0]=3 397 B15R2.53147 CC(N)CC1=CN(C2=C1C=CC=C2)C MCULE-8078196971 [0,1,0,0,0,0|1,0,1]=3 398 B15R2.53147 CC(N)CC1=CN(C2=CC=CC=C12)C MCULE-5211414288 [0,1,0,0,0,0|1,0,1]=3 399 B15R2.53147 CC1=CN(C2=CC=CC=C12)CC(=O)O MCULE-3728551943 [0,1,0,0,0,0|3,0,0]=4 400 B15R2.53147 CN(C)CC1=CN(C2=C1C=CC=C2)C MCULE-1488429538 [0,1,0,0,0,0|3,0,0]=4 401 B15R2.53147 CN1C=C(C2=CC=CC=C12)CC(=O)N MCULE-1090608814 [0,1,0,0,0,0|0,0,0]=1 402 B15R2.53147 CN1C=C(C2=CC=CC=C12)CC(=O)O MCULE-4439939699 [0,1,0,0,0,0|1,0,0]=2 403 B15R2.53147 CN1N=C(C2=C1C=CC=C2)CC(=O)O MCULE-2496177776 [0,1,0,0,0,0|2,0,0]=3 404 B15R2.53147 NC(=O)C=C1OC(=O)C2=CC=CC=C12 MCULE-7141230271 [0,1,0,0,0,0|2,0,1]=4 405 B15R2.53147 NC(=O)CC1NC(=O)C2=C1C=CC=C2 MCULE-4592384524 [0,1,0,0,0,0|2,0,1]=4 406 B15R2.53147 NC(=O)CC1OC(=O)C2=C1C=CC=C2 MCULE-4997430834 [0,1,0,0,0,0|2,0,1]=4 407 B13R1.90 C=CC1=CC=CC=C1OCC(=O)O MCULE-2322182634 [0,0,1,0,0,0|3,0,0]=4 408 B13R1.90 COC1=C(C=CC=C1)OCC(=O)N MCULE-9042627931 [0,0,1,0,0,0|2,0,1]=4 409 B13R1.90 N#CC1=CC=CC=C1CCC(=O)N MCULE-3077700462 [0,0,1,0,0,0|2,0,1]=4 410 B13R1.90 N#CC1=CC=CC=C1OCC(=O)N MCULE-8175551418 [0,0,1,0,0,0|3,0,0]=4 411 B13R1.90 NC(=O)COC1=C(C=CC=C1)C=O MCULE-6096725708 [0,0,1,0,0,0|3,0,0]=4 412 B13R1.201 CC(=O)CC(=O)C1=C(C=CC=C1)Br MCULE-2737241459 [0,0,1,0,0,0|3,0,0]=4 413 B13R1.201 CC(=O)CC(=O)C1=C(C=CC=C1)Cl MCULE-2583207227 [0,0,1,0,0,0|3,0,0]=4 414 B13R1.201 CC(=O)CC(=O)C1=C(C=CC=C1)F MCULE-4656353581 [0,0,1,0,0,0|3,0,0]=4 415 B13R1.201 CC(=O)CC(=O)C1=C(C=CC=C1)O MCULE-1995801466 [0,0,1,0,0,0|3,0,0]=4 416 B13R1.201 CC(=O)CC(=O)C1=CC=CC=C1C MCULE-8100231015 [0,0,1,0,0,0|3,0,0]=4 417 B13R1.201 O=C(O)CC(=O)C1=CC=CC=C1Cl MCULE-2599664916 [0,0,1,0,0,0|3,0,0]=4 418 B13R1.337 CC(=O)C=CC=CC1=CC=CC=C1 MCULE-8738280016 [0,0,1,0,0,0|2,0,1]=4 419 B13R1.337 NC(=O)CCCOC1=CC=CC=C1 MCULE-4454926991 [0,0,1,0,0,0|1,0,2]=4 420 B13R1.337 NC(=O)CCNCC1=CC=CC=C1 MCULE-8073483780 [0,0,1,0,0,0|2,0,1]=4 421 B13R1.337 NC(=O)CCNCC1=CC=CC=C1 MCULE-9028611191 [0,0,1,0,0,0|2,0,1]=4 422 B13R1.337 NC(=O)CCOCC1=CC=CC=C1 MCULE-7333319459 [0,0,1,0,0,0|2,0,1]=4 423 B13R1.337 NC(=O)CCSCC1=CC=CC=C1 MCULE-8317987041 [0,0,1,0,0,0|2,0,1]=4 424 B13R1.337 O=C(Cl)C=CC=CC1=CC=CC=C1 MCULE-2537593255 [0,0,1,0,0,0|2,0,1]=4 425 B13R1.337 O=C(O)/C=C/C=C/C1=CC=CC=C1 MCULE-7226363257 [0,0,1,0,0,0|2,0,1]=4 426 B13R1.337 O=C(O)C=CC=CC1=CC=CC=C1 MCULE-5804453111 [0,0,1,0,0,0|2,0,1]=4 427 B13R1.337 O=C(O)CCC=CC1=CC=CC=C1 MCULE-6627837769 [0,0,1,0,0,0|2,0,1]=4 428 B13R1.337 O=C(O)CSC=CC1=CC=CC=C1 MCULE-5673313207 [0,0,1,0,0,0|3,0,0]=4 429 B13R1.713 C=CC(CC(=O)O)C1=CC=CC=C1 MCULE-2960833071 [0,0,1,0,0,0|2,0,1]=4 430 B13R1.713 CNC(CC(=O)N)C1=CC=CC=C1 MCULE-1554236816 [0,0,1,0,0,0|2,0,1]=4 431 B13R1.713 CNC(CC(=O)N)C1=CC=CC=C1 MCULE-6107650661 [0,0,1,0,0,0|2,0,1]=4 432 B13R1.713 NCC(CC(=O)O)C1=CC=CC=C1 MCULE-5816217249 [0,0,1,0,0,0|1,0,2]=4 433 B13R1.713 NCC(CC(=O)O)C1=CC=CC=C1 MCULE-9862731096 [0,0,1,0,0,0|1,0,2]=4 434 B13R1.713 NC[C@@H](CC(=O)O)C1=CC=CC=C1 MCULE-1505990193 [0,0,1,0,0,0|1,0,2]=4 435 B13R1.713 NC[C@@H](CC(=O)O)C1=CC=CC=C1 MCULE-6190546623 [0,0,1,0,0,0|1,0,2]=4 436 B13R1.713 NC[C@@H](CC(=O)O)C1=CC=CC=C1 MCULE-8069604431 [0,0,1,0,0,0|1,0,2]=4 437 B13R1.713 NC[C@@H](CC(=O)O)C1=CC=CC=C1 MCULE-9461364099 [0,0,1,0,0,0|1,0,2]=4 438 B13R1.713 NC[C@H](CC(=O)O)C1=CC=CC=C1 MCULE-3726907829 [0,0,1,0,0,0|1,0,2]=4 439 B13R1.713 NC[C@H](CC(=O)O)C1=CC=CC=C1 MCULE-4517880361 [0,0,1,0,0,0|1,0,2]=4 440 B13R1.713 NC[C@H](CC(=O)O)C1=CC=CC=C1 MCULE-7915129742 [0,0,1,0,0,0|1,0,2]=4 441 B13R1.713 NC[C@H](CC(=O)O)C1=CC=CC=C1 MCULE-9847907661 [0,0,1,0,0,0|1,0,2]=4 442 B13R1.713 O=CN(CC(=O)O)C1=CC=CC=C1 MCULE-1669781512 [0,0,1,0,0,0|3,0,0]=4 443 B15R3.2009 CC1=NC2=C(S1)NC3=CC=CC=C23 MCULE-5330226496 [0,0,0,1,0,0|2,1,0]=4 444 B15R3.2009 NC1=NC2=C(S1)CC3=C2C=CC=C3 MCULE-2465523398 [0,0,0,1,0,0|2,1,0]=4 445 B15R3.2009 NC1=NC2=C(S1)CC3=C2C=CC=C3 MCULE-3375723914 [0,0,0,1,0,0|2,1,0]=4 446 B15R3.2009 NC1CC2=C(C1)C3=C(N2)C=CC=C3 MCULE-3220302711 [0,0,0,1,0,0|1,0,1]=3 447 B15R3.2009 O=C1CC2=C(C1)C3=C(N2)C=CC=C3 MCULE-4808786300 [0,0,0,1,0,0|1,0,0]=2 448 B15R3.14764 NC1CC2=CNC3=CC=CC(=C23)C1 MCULE-2932698296 [0,0,0,1,0,0|1,0,1]=3 449 B13R2.72 CC(=O)C1=C2C=CC=CN2N=C1 MCULE-6568440480 [0,0,0,0,1,0|2,0,1]=4 450 B13R2.72 CC(=O)C1=C2C=CNC=C2N=C1 MCULE-7152847312 [0,0,0,0,1,0|2,0,1]=4 451 B13R2.72 CC(=O)C1=CN=C2C1=CNC=C2 MCULE-9211546221 [0,0,0,0,1,0|2,0,1]=4 452 B13R2.72 CC(=O)C1=CN=C2N1C=CC=C2 MCULE-5759800681 [0,0,0,0,1,0|2,0,1]=4 453 B13R2.72 CC(=O)C1=CNC2=C1C=CC=N2 MCULE-1978852744 [0,0,0,0,1,0|2,0,0]=3 454 B13R2.72 CC(=O)C1=CNC2=C1C=CN=C2 MCULE-8889468572 [0,0,0,0,1,0|2,0,0]=3 455 B13R2.72 CC(=O)C1=CNC2=C1C=NC=C2 MCULE-6744695889 [0,0,0,0,1,0|2,0,0]=3 456 B13R2.72 CC(=O)C1=CNC2=CC=CC=C12 MCULE-5994992193 [0,0,0,0,1,0|1,0,0]=2 457 B13R2.72 CC(=O)C1=CNC2=CC=CN=C12 MCULE-2966030255 [0,0,0,0,1,0|2,0,0]=3 458 B13R2.72 CC(=O)C1=CNC2=NC=CN=C12 MCULE-4953469155 [0,0,0,0,1,0|3,0,0]=4 459 B13R2.72 CC(=O)C1=COC2=C1C=CC=C2 MCULE-1611465572 [0,0,0,0,1,0|2,0,0]=3 460 B13R2.72 CC(=O)C1=CSC2=C1C=CC=C2 MCULE-5544904867 [0,0,0,0,1,0|2,0,0]=3 461 B13R2.72 CC(=O)C1=NNC2=C1C=CC=N2 MCULE-9568405297 [0,0,0,0,1,0|3,0,0]=4 462 B13R2.72 CC(=O)C1=NNC2=CC=CC=C12 MCULE-1293948569 [0,0,0,0,1,0|2,0,0]=3 463 B13R2.72 CC(=O)C1=NNC2=CC=CN=C12 MCULE-4206086196 [0,0,0,0,1,0|3,0,0]=4 464 B13R2.72 CC(=O)C1=NNC2=CC=NC=C12 MCULE-1616290563 [0,0,0,0,1,0|3,0,0]=4 465 B13R2.72 CC(=O)N1C=CC2=C1C=CC=C2 MCULE-9105742571 [0,0,0,0,1,0|3,0,0]=4 466 B13R2.72 CC(Br)C1=CNC2=CC=CC=C12 MCULE-1227110359 [0,0,0,0,1,0|2,0,1]=4 467 B13R2.72 CC(C)C1=CNC2=C1C=CC=C2 MCULE-9596446013 [0,0,0,0,1,0|2,0,1]=4 468 B13R2.72 CC(N)C1=CNC2=CC=CC=C12 MCULE-1459797926 [0,0,0,0,1,0|1,0,1]=3 469 B13R2.72 CC(N)C1=CNC2=CC=CC=C12 MCULE-5345457509 [0,0,0,0,1,0|1,0,1]=3 470 B13R2.72 CC(N)C1=CSC2=C1C=CC=C2 MCULE-4346513384 [0,0,0,0,1,0|2,0,1]=4 471 B13R2.72 CC(N)C1=CSC2=C1C=CC=C2 MCULE-6220780672 [0,0,0,0,1,0|2,0,1]=4 472 B13R2.72 CS(=O)C1=CNC2=C1C=CC=C2 MCULE-5973421190 [0,0,0,0,1,0|2,0,0]=3 473 B13R2.72 C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-3508718350 [0,0,0,0,1,0|1,0,1]=3 474 B13R2.72 C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-3630046097 [0,0,0,0,1,0|1,0,1]=3 475 B13R2.72 C[C@@H](N)C1=CSC2=CC=CC=C12 MCULE-4397901133 [0,0,0,0,1,0|2,0,1]=4 476 B13R2.72 C[C@@H](N)C1=CSC2=CC=CC=C12 MCULE-7233337215 [0,0,0,0,1,0|2,0,1]=4 477 B13R2.72 C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-3023778123 [0,0,0,0,1,0|1,0,1]=3 478 B13R2.72 C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-5029928307 [0,0,0,0,1,0|1,0,1]=3 479 B13R2.72 C[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-8203509549 [0,0,0,0,1,0|2,0,1]=4 480 B13R2.72 C[C@H](N)C1=CSC2=CC=CC=C12 MCULE-4085185440 [0,0,0,0,1,0|2,0,1]=4 481 B13R2.72 N=C(N)C1=CNC2=C1C=CC=C2 MCULE-2721616347 [0,0,0,0,1,0|1,0,0]=2 482 B13R2.72 N=C(N)C1=CNC2=C1C=CC=C2 MCULE-9122292521 [0,0,0,0,1,0|1,0,0]=2 483 B13R2.72 N=C(N)C1=CSC2=C1C=CC=C2 MCULE-2685239624 [0,0,0,0,1,0|2,0,0]=3 484 B13R2.72 N=C(N)C1=CSC2=C1C=CC=C2 MCULE-3132008230 [0,0,0,0,1,0|2,0,0]=3 485 B13R2.72 NC(=O)C1=C2C=CC=CN2N=C1 MCULE-1279040359 [0,0,0,0,1,0|1,0,1]=3 486 B13R2.72 NC(=O)C1=C2N=CC=CN2N=C1 MCULE-7685840960 [0,0,0,0,1,0|2,0,1]=4 487 B13R2.72 NC(=O)C1=C2NC=CC=C2N=C1 MCULE-8011570756 [0,0,0,0,1,0|1,0,1]=3 488 B13R2.72 NC(=O)C1=CCC2=C1C=CC=C2 MCULE-2864979942 [0,0,0,0,1,0|1,0,0]=2 489 B13R2.72 NC(=O)C1=CNC2=C1C=CC=C2 MCULE-6602357386 [0,0,0,0,1,0|0,0,0]=1 490 B13R2.72 NC(=O)C1=CNC2=C1C=CC=N2 MCULE-9842049454 [0,0,0,0,1,0|1,0,0]=2 491 B13R2.72 NC(=O)C1=CNC2=CC=CN=C12 MCULE-4752876596 [0,0,0,0,1,0|1,0,0]=2 492 B13R2.72 NC(=O)C1=COC2=CC=CC=C12 MCULE-6858305922 [0,0,0,0,1,0|1,0,0]=2 493 B13R2.72 NC(=O)C1=COC2=CC=CN=C12 MCULE-5626906378 [0,0,0,0,1,0|2,0,0]=3 494 B13R2.72 NC(=O)C1=CSC2=C1C=CC=C2 MCULE-5559138515 [0,0,0,0,1,0|1,0,0]=2 495 B13R2.72 NC(=O)C1=NNC2=C1C=CC=C2 MCULE-2541350999 [0,0,0,0,1,0|1,0,0]=2 496 B13R2.72 NC(=O)C1=NNC2=CN=CC=C12 MCULE-7336285201 [0,0,0,0,1,0|2,0,0]=3 497 B13R2.72 NC(=O)C1=NOC2=CC=CC=C12 MCULE-5336541125 [0,0,0,0,1,0|2,0,0]=3 498 B13R2.72 NC(=O)C1CCC2=C1C=CC=C2 MCULE-1034012078 [0,0,0,0,1,0|1,0,2]=4 499 B13R2.72 NC(=O)C1COC2=CC=CC=C12 MCULE-7848919760 [0,0,0,0,1,0|1,0,2]=4 500 B13R2.72 NC(=O)C1NCC2=CC=CC=C12 MCULE-3091607204 [0,0,0,0,1,0|2,0,1]=4 501 B13R2.72 NC(=O)N1CCC2=C1C=CC=C2 MCULE-7661560290 [0,0,0,0,1,0|2,0,1]=4 502 B13R2.72 NC(=O)N1N=NC2=C1C=CC=C2 MCULE-1020519915 [0,0,0,0,1,0|2,0,1]=4 503 B13R2.72 NC(=S)C1=C2C=CC=CN2N=C1 MCULE-3771745455 [0,0,0,0,1,0|1,1,1]=4 504 B13R2.72 NC(=S)C1=CN=C2N1C=CC=C2 MCULE-3723285492 [0,0,0,0,1,0|1,1,1]=4 505 B13R2.72 NC(=S)C1=CNC2=C1C=CC=C2 MCULE-4605135158 [0,0,0,0,1,0|0,1,0]=2 506 B13R2.72 NC(=S)C1=CNC2=NC=CC=C12 MCULE-2333640784 [0,0,0,0,1,0|1,1,0]=3 507 B13R2.72 NC(=S)C1=COC2=C1C=CC=C2 MCULE-8588818207 [0,0,0,0,1,0|1,1,0]=3 508 B13R2.72 NC(=S)C1=CSC2=C1C=CC=C2 MCULE-4003719039 [0,0,0,0,1,0|1,1,0]=3 509 B13R2.72 NC(=S)C1=NNC2=CC=CC=C12 MCULE-5889692199 [0,0,0,0,1,0|1,1,0]=3 510 B13R2.72 NC(=S)C1=NOC2=CC=CC=C12 MCULE-2982222667 [0,0,0,0,1,0|2,1,0]=4 511 B13R2.72 O=C(Cl)C1=CN=C2N1C=CC=C2 MCULE-5263561704 [0,0,0,0,1,0|2,0,1]=4 512 B13R2.72 O=C(Cl)C1=CNC2=CC=CC=C12 MCULE-7811906781 [0,0,0,0,1,0|1,0,0]=2 513 B13R2.72 O=C(Cl)C1=CNC2=NC=CC=C12 MCULE-4694195070 [0,0,0,0,1,0|2,0,0]=3 514 B13R2.72 O=C(Cl)C1=COC2=C1C=CC=C2 MCULE-5372606604 [0,0,0,0,1,0|2,0,0]=3 515 B13R2.72 O=C(Cl)C1=CSC2=C1C=CC=C2 MCULE-4332616181 [0,0,0,0,1,0|2,0,0]=3 516 B13R2.72 O=C(Cl)C1=NNC2=C1C=CC=C2 MCULE-8998776382 [0,0,0,0,1,0|2,0,0]=3 517 B13R2.72 O=C(O)C1=C2C=CC=CC2=CN1 MCULE-8997316936 [0,0,0,0,1,0|3,0,0]=4 518 B13R2.72 O=C(O)C1=C2C=CC=CC2=CO1 MCULE-1577537596 [0,0,0,0,1,0|3,0,0]=4 519 B13R2.72 O=C(O)C1=C2C=CC=CC2=NO1 MCULE-8566101056 [0,0,0,0,1,0|2,0,1]=4 520 B13R2.72 O=C(O)C1=C2C=CC=CC2=NS1 MCULE-1694921526 [0,0,0,0,1,0|2,0,1]=4 521 B13R2.72 O=C(O)C1=C2C=CC=CN2C=C1 MCULE-7906881254 [0,0,0,0,1,0|3,0,0]=4 522 B13R2.72 O=C(O)C1=C2C=CC=CN2N=C1 MCULE-4993718209 [0,0,0,0,1,0|2,0,1]=4 523 B13R2.72 O=C(O)C1=C2C=CNC=C2N=C1 MCULE-9903506728 [0,0,0,0,1,0|2,0,1]=4 524 B13R2.72 O=C(O)C1=C2NC=CC=C2N=C1 MCULE-1861724289 [0,0,0,0,1,0|2,0,1]=4 525 B13R2.72 O=C(O)C1=CCC2=CC=CC=C12 MCULE-6113093142 [0,0,0,0,1,0|2,0,0]=3 526 B13R2.72 O=C(O)C1=CN=C2C1=CNC=C2 MCULE-1676152489 [0,0,0,0,1,0|2,0,1]=4 527 B13R2.72 O=C(O)C1=CN=C2N1C=CC=C2 MCULE-7597921465 [0,0,0,0,1,0|2,0,1]=4 528 B13R2.72 O=C(O)C1=CNC2=C1C=CC=N2 MCULE-4452059641 [0,0,0,0,1,0|2,0,0]=3 529 B13R2.72 O=C(O)C1=CNC2=C1C=CN=C2 MCULE-7439182142 [0,0,0,0,1,0|2,0,0]=3 530 B13R2.72 O=C(O)C1=CNC2=C1C=NC=N2 MCULE-7309686969 [0,0,0,0,1,0|3,0,0]=4 531 B13R2.72 O=C(O)C1=CNC2=C1N=CC=C2 MCULE-6652782915 [0,0,0,0,1,0|2,0,0]=3 532 B13R2.72 O=C(O)C1=CNC2=C1N=CC=C2 MCULE-8061566019 [0,0,0,0,1,0|2,0,0]=3 533 B13R2.72 O=C(O)C1=CNC2=CC=CC=C12 MCULE-9692083886 [0,0,0,0,1,0|1,0,0]=2 534 B13R2.72 O=C(O)C1=CNC2=CC=NC=C12 MCULE-9214281458 [0,0,0,0,1,0|2,0,0]=3 535 B13R2.72 O=C(O)C1=CNC2=NC=CN=C12 MCULE-3183987728 [0,0,0,0,1,0|3,0,0]=4 536 B13R2.72 O=C(O)C1=COC2=C1C=CC=C2 MCULE-2542401716 [0,0,0,0,1,0|2,0,0]=3 537 B13R2.72 O=C(O)C1=CSC2=C1C=CC=C2 MCULE-7496972581 [0,0,0,0,1,0|2,0,0]=3 538 B13R2.72 O=C(O)C1=CSC2=C1C=CN=C2 MCULE-4684517356 [0,0,0,0,1,0|3,0,0]=4 539 B13R2.72 O=C(O)C1=CSC2=CC=CN=C12 MCULE-9981354999 [0,0,0,0,1,0|3,0,0]=4 540 B13R2.72 O=C(O)C1=NNC2=C1C=CC=C2 MCULE-6118849993 [0,0,0,0,1,0|2,0,0]=3 541 B13R2.72 O=C(O)C1=NNC2=C1C=CN=C2 MCULE-7663141596 [0,0,0,0,1,0|3,0,0]=4 542 B13R2.72 O=C(O)C1=NNC2=CC=CN=C12 MCULE-1218949842 [0,0,0,0,1,0|3,0,0]=4 543 B13R2.72 O=C(O)C1=NNC2=CC=NC=C12 MCULE-8291949237 [0,0,0,0,1,0|3,0,0]=4 544 B13R2.72 O=C(O)C1=NNC2=NC=CC=C12 MCULE-6317531869 [0,0,0,0,1,0|3,0,0]=4 545 B13R2.72 O=C(O)C1=NOC2=C1C=CC=C2 MCULE-8907899256 [0,0,0,0,1,0|3,0,0]=4 546 B13R2.72 O=C(O)C1=NSC2=C1C=CC=C2 MCULE-5175918770 [0,0,0,0,1,0|3,0,0]=4 547 B13R2.72 O=C(O)C1C=CC2=C1C=CC=C2 MCULE-2683790390 [0,0,0,0,1,0|2,0,1]=4 548 B13R2.72 O=C(O)C1CNC2=C1C=CC=C2 MCULE-9569963908 [0,0,0,0,1,0|1,0,2]=4 549 B13R2.72 O=C(O)C1CNC2=C1C=CC=C2 MCULE-9785577019 [0,0,0,0,1,0|1,0,2]=4 550 B13R2.72 O=C(O)N1C=CC2=CC=CC=C12 MCULE-3235334301 [0,0,0,0,1,0|3,0,0]=4 551 B13R2.72 O=C(O)N1C=NC2=CC=CC=C12 MCULE-2424411223 [0,0,0,0,1,0|2,0,1]=4 552 B13R2.72 O=N(=O)C1=CNC2=C1C=CC=C2 MCULE-9401944807 [0,0,0,0,1,0|2,0,0]=3 553 B13R2.72 O=N(=O)C1=CNC2=C1C=CC=N2 MCULE-5932688604 [0,0,0,0,1,0|3,0,0]=4 554 B13R2.72 O=N(=O)C1=CNC2=C1C=CN=C2 MCULE-3746481977 [0,0,0,0,1,0|3,0,0]=4 555 B13R2.72 O=N(=O)C1=CNC2=C1C=NC=C2 MCULE-1159726575 [0,0,0,0,1,0|3,0,0]=4 556 B13R2.72 O=N(=O)C1=CNC2=CC=CN=C12 MCULE-6110903539 [0,0,0,0,1,0|3,0,0]=4 557 B13R2.72 O=N(=O)C1=NNC2=C1C=CC=C2 MCULE-6549948831 [0,0,0,0,1,0|3,0,0]=4 558 B13R2.72 OB(O)C1=CNC2=C1C=CC=C2 MCULE-1174263630 [0,0,0,0,1,0|2,0,1]=4 559 B15R2.6 CC(=O)C=CC1=CNC2=CC=CC=C12 MCULE-1503677397 [0,0,0,0,0,1|1,0,1]=3 560 B15R2.6 CC(=O)CCC1=CNC2=C1C=CC=C2 MCULE-7392845361 [0,0,0,0,0,1|1,0,0]=2 561 B15R2.6 CC(=O)CCN1C=NC2=C1C=CC=C2 MCULE-3225504435 [0,0,0,0,0,1|2,0,1]=4 562 B15R2.6 CC(=O)CSC1=CNC2=C1C=CC=C2 MCULE-3315787994 [0,0,0,0,0,1|1,0,0]=2 563 B15R2.6 CN(C)CCC1=CNC2=C1C=CC=C2 MCULE-1451594833 [0,0,0,0,0,1|3,0,0]=4 564 B15R2.6 NC(=O)CCC1=CNC2=C1C=CC=C2 MCULE-3897886792 [0,0,0,0,0,1|0,0,0]=1 565 B15R2.6 NC(=O)CCN1C=CC2=CC=CC=C12 MCULE-8078725777 [0,0,0,0,0,1|2,0,0]=3 566 B15R2.6 NC(=O)CCN1C=NC2=C1C=CC=C2 MCULE-6609412974 [0,0,0,0,0,1|1,0,1]=3 567 B15R2.6 NC(=O)CCN1N=NC2=CC=CC=C12 MCULE-7612674047 [0,0,0,0,0,1|2,0,1]=4 568 B15R2.6 NC(=O)CSC1=CNC2=C1C=CC=C2 MCULE-9969213922 [0,0,0,0,0,1|0,0,0]=1 569 B15R2.6 NC(=O)NN=C1CCC2=CC=CC=C12 MCULE-2262287408 [0,0,0,0,0,1|2,0,1]=4 570 B15R2.6 O=C(O)/C=C/C1=CNC2=C1C=CC=C2 MCULE-6532813939 [0,0,0,0,0,1|1,0,1]=3 571 B15R2.6 O=C(O)/C=C\C1=CNC2=CC=CC=C12 MCULE-5749603036 [0,0,0,0,0,1|1,0,1]=3 572 B15R2.6 O=C(O)C=CC1=CNC2=CC=CC=C12 MCULE-2676235699 [0,0,0,0,0,1|1,0,1]=3 573 B15R2.6 O=C(O)CCC1=CNC2=C1C=CC=C2 MCULE-4395981703 [0,0,0,0,0,1|1,0,0]=2 574 B15R2.6 O=C(O)CCC1=CNC2=C1C=CC=N2 MCULE-3968966198 [0,0,0,0,0,1|2,0,0]=3 575 B15R2.6 O=C(O)CCC1=CSC2=C1C=CC=C2 MCULE-9447024037 [0,0,0,0,0,1|2,0,0]=3 576 B15R2.6 O=C(O)CCC1=NNC2=NC=CC=C12 MCULE-2665228438 [0,0,0,0,0,1|3,0,0]=4 577 B15R2.6 O=C(O)CCC1CNC2=CC=CC=C12 MCULE-8363659489 [0,0,0,0,0,1|1,0,2]=4 578 B15R2.6 O=C(O)CCN1C=CC2=CC=CC=C12 MCULE-1354088018 [0,0,0,0,0,1|3,0,0]=4 579 B15R2.6 O=C(O)CCN1C=NC2=C1C=CC=C2 MCULE-3872829331 [0,0,0,0,0,1|2,0,1]=4 580 B15R2.6 O=C(O)CCN1C=NC2=C1C=CC=C2 MCULE-8755783788 [0,0,0,0,0,1|2,0,1]=4 581 B15R2.6 O=C(O)CCN1C=[NH+]C2=CC=CC=C12 MCULE-9033437062 [0,0,0,0,0,1|2,0,1]=4 582 B15R2.6 O=C(O)CNC1=NCC2=C1C=CC=C2 MCULE-9135692160 [0,0,0,0,0,1|3,0,0]=4 583 B15R2.6 O=C(O)COC1=NNC2=C1C=CC=C2 MCULE-5988475690 [0,0,0,0,0,1|2,0,0]=3 584 B15R2.6 O=C(O)CSC1=CNC2=C1C=CC=C2 MCULE-3383554611 [0,0,0,0,0,1|1,0,0]=2 585 B15R2.6 O=C([O-])C=CC1=CNC2=CC=CC=C12 MCULE-2887903829 [0,0,0,0,0,1|1,0,1]=3 586 B15R2.6 O=N(=O)/C=C/C1=CNC2=C1C=CC=C2 MCULE-4890946052 [0,0,0,0,0,1|2,0,1]=4 587 B15R2.6 O=[N+]([O-])C=CC1=CNC2=CC=CC=C12 MCULE-4352099957 [0,0,0,0,0,1|2,0,1]=4 588 B15R2.1668 C=C(Br)CC1=CC2=C(C=CC=C2)C=C1 MCULE-5497094052 [0,0,0,0,0,1|3,0,0]=4 589 B15R2.1668 C=C(C)CC1=CC2=C(C=CC=C2)C=C1 MCULE-6351303075 [0,0,0,0,0,1|3,0,0]=4 590 B15R2.1668 C=C(Cl)CC1=CC2=C(C=CC=C2)C=C1 MCULE-8510528343 [0,0,0,0,0,1|3,0,0]=4 591 B15R2.1668 CC(=O)CC1=CC2=CC=CC=C2C=C1 MCULE-9025023615 [0,0,0,0,0,1|2,0,0]=3 592 B15R2.1668 CC(=O)CC1=NC2=C(C=CC=C2)C=C1 MCULE-6945595303 [0,0,0,0,0,1|2,0,0]=3 593 B15R2.1668 CC(=O)C[N+]1=CC2=C(C=CC=C2)C=C1 MCULE-1245067535 [0,0,0,0,0,1|3,0,0]=4 594 B15R2.1668 CC(=O)C[N+]1=CC2=C(C=CC=C2)C=C1 MCULE-5646684084 [0,0,0,0,0,1|3,0,0]=4 595 B15R2.1668 CC(=O)NC1=CC=C2C=CC=CC2=C1 MCULE-5777673761 [0,0,0,0,0,1|3,0,0]=4 596 B15R2.1668 CC(=O)NC1=NC2=C(C=CC=C2)N=C1 MCULE-5469290742 [0,0,0,0,0,1|2,0,1]=4 597 B15R2.1668 CC(=O)OC1=CC2=C(C=CC=C2)C=C1 MCULE-4875836262 [0,0,0,0,0,1|3,0,0]=4 598 B15R2.1668 CC(N)CC1=NC2=C(C=CC=C2)C=C1 MCULE-5136888727 [0,0,0,0,0,1|2,0,1]=4 599 B15R2.1668 N=C(N)CC1=CC2=CC=CC=C2C=C1 MCULE-1576114001 [0,0,0,0,0,1|2,0,0]=3 600 B15R2.1668 N=C(N)CC1=CC2=CC=CC=C2C=C1 MCULE-8613018586 [0,0,0,0,0,1|2,0,0]=3 601 B15R2.1668 NC(=O)CC1=CC2=C(C=CC=C2)C=C1 MCULE-7802986673 [0,0,0,0,0,1|1,0,0]=2 602 B15R2.1668 NC(=O)CC1=CC2=CC=CC=C2N=C1 MCULE-1180644918 [0,0,0,0,0,1|0,0,1]=2 603 B15R2.1668 NC(=O)CC1=CC=C2C=CC=CC2=N1 MCULE-4150955221 [0,0,0,0,0,1|1,0,0]=2 604 B15R2.1668 NC(=O)CC1=NC2=NC=CC=C2C=C1 MCULE-5393527055 [0,0,0,0,0,1|2,0,0]=3 605 B15R2.1668 NC(=O)CC1=NN=C2C=CC=CC2=N1 MCULE-3231948798 [0,0,0,0,0,1|1,0,1]=3 606 B15R2.1668 NC(=O)CN1CCC2=CC=CC=C2C1 MCULE-1392545928 [0,0,0,0,0,1|2,0,1]=4 607 B15R2.1668 NC(=O)C[N+]1=CC2=C(C=CC=C2)C=C1 MCULE-3541277932 [0,0,0,0,0,1|2,0,0]=3 608 B15R2.1668 NC(=O)C[N+]1=CC2=C(C=CC=C2)C=C1 MCULE-6131124353 [0,0,0,0,0,1|2,0,0]=3 609 B15R2.1668 NC(=O)C[N+]1=CC2=C(C=CC=C2)C=C1 MCULE-6877033578 [0,0,0,0,0,1|2,0,0]=3 610 B15R2.1668 NC(=S)NC1=CC=C2C=CC=CC2=C1 MCULE-5632197556 [0,0,0,0,0,1|2,1,0]=4 611 B15R2.1668 NC(=S)NC1=CN=C2C=CC=CC2=C1 MCULE-1246899584 [0,0,0,0,0,1|1,1,1]=4 612 B15R2.1668 O=C(Cl)CC1=CC2=CC=CC=C2C=C1 MCULE-7239632493 [0,0,0,0,0,1|2,0,0]=3 613 B15R2.1668 O=C(Cl)OC1=CC=C2C=CC=CC2=C1 MCULE-7889361980 [0,0,0,0,0,1|3,0,0]=4 614 B15R2.1668 O=C(O)CC1=CC2=C(C=C1)C=NC=C2 MCULE-6774928862 [0,0,0,0,0,1|3,0,0]=4 615 B15R2.1668 O=C(O)CC1=CC2=C(C=C1)C=NC=C2 MCULE-9702085272 [0,0,0,0,0,1|3,0,0]=4 616 B15R2.1668 O=C(O)CC1=CC2=C(C=CC=C2)N=C1 MCULE-1372203161 [0,0,0,0,0,1|1,0,1]=3 617 B15R2.1668 O=C(O)CC1=CC2=C(C=CN=C2)C=C1 MCULE-1042665880 [0,0,0,0,0,1|3,0,0]=4 618 B15R2.1668 O=C(O)CC1=CC2=CC=CC=C2C=C1 MCULE-7141202973 [0,0,0,0,0,1|2,0,0]=3 619 B15R2.1668 O=C(O)CC1=CC2=CC=CC=C2C=N1 MCULE-3901415736 [0,0,0,0,0,1|3,0,0]=4 620 B15R2.1668 O=C(O)CC1=CC2=CC=CC=C2N=C1 MCULE-4044511177 [0,0,0,0,0,1|1,0,1]=3 621 B15R2.1668 O=C(O)CC1=CC2=CC=CN=C2C=C1 MCULE-7292944327 [0,0,0,0,0,1|3,0,0]=4 622 B15R2.1668 O=C(O)CC1=CC=C2C=CC=NC2=C1 MCULE-3204454312 [0,0,0,0,0,1|3,0,0]=4 623 B15R2.1668 O=C(O)CC1=NC2=C(C=CC=C2)C=C1 MCULE-6574067896 [0,0,0,0,0,1|2,0,0]=3 624 B15R2.1668 O=C(O)CC1=NC2=C(C=CC=C2)C=C1 MCULE-7711584672 [0,0,0,0,0,1|2,0,0]=3 625 B15R2.1668 O=C(O)CC1=NC2=CC=CN=C2C=C1 MCULE-9186928554 [0,0,0,0,0,1|3,0,0]=4 626 B15R2.1668 O=C(O)CC1=NN=C2C=CC=CC2=N1 MCULE-8738162550 [0,0,0,0,0,1|2,0,1]=4 627 B15R2.1668 O=C(O)CC1CNC2=C(S1)C=CC=C2 MCULE-1285348384 [0,0,0,0,0,1|1,0,2]=4 628 B15R2.1668 O=C([O-])CC1=CC2=CC=CC=C2C=N1 MCULE-8359100655 [0,0,0,0,0,1|3,0,0]=4 629 B15R2.1668 O=C([O-])CC1=CC=C2N=CC=CC2=N1 MCULE-5846181156 [0,0,0,0,0,1|3,0,0]=4 630 B15R2.1668 O=C([O-])CC1=NC2=C(C=CC=C2)C=C1 MCULE-2259267153 [0,0,0,0,0,1|2,0,0]=3 631 B15R2.1668 O=C([O-])CC1=NC2=C(C=CC=C2)C=C1 MCULE-3262719250 [0,0,0,0,0,1|2,0,0]=3 632 B15R2.68122 C=C(Br)CC1=CC=CC2=C1C=CC=C2 MCULE-3688172649 [0,0,0,0,0,1|3,0,0]=4 633 B15R2.68122 C=C(C)CC1=CC=CC2=C1C=CC=C2 MCULE-2879401230 [0,0,0,0,0,1|3,0,0]=4 634 B15R2.68122 C=C(Cl)CC1=CC=CC2=C1C=CC=C2 MCULE-3200349164 [0,0,0,0,0,1|3,0,0]=4 635 B15R2.68122 CC(=O)CC1=C2C=CC=CC2=CC=C1 MCULE-5258877483 [0,0,0,0,0,1|2,0,0]=3 636 B15R2.68122 CC(=O)NC1=C2C=CC=CC2=CC=C1 MCULE-8959631022 [0,0,0,0,0,1|3,0,0]=4 637 B15R2.68122 CC(=O)NC1=C2C=CC=CC2=NC=C1 MCULE-7951003580 [0,0,0,0,0,1|2,0,1]=4 638 B15R2.68122 CC(=O)NC1=CCCC2=CC=CC=C12 MCULE-2390108139 [0,0,0,0,0,1|3,0,0]=4 639 B15R2.68122 CC(=O)OC1=C2C=CC=CC2=CC=C1 MCULE-8543973076 [0,0,0,0,0,1|3,0,0]=4 640 B15R2.68122 CC(=O)SC1=C2C=CC=CC2=CC=N1 MCULE-4296775677 [0,0,0,0,0,1|3,0,0]=4 641 B15R2.68122 N=C(N)CC1=C2C=CC=CC2=CC=C1 MCULE-1806664518 [0,0,0,0,0,1|2,0,0]=3 642 B15R2.68122 N=C(N)CC1=C2C=CC=CC2=CC=C1 MCULE-8634347388 [0,0,0,0,0,1|2,0,0]=3 643 B15R2.68122 N=C(N)NC1=C2C=CC=CC2=CC=C1 MCULE-4865020144 [0,0,0,0,0,1|3,0,0]=4 644 B15R2.68122 N=C(N)NC1=C2C=CC=CC2=CC=C1 MCULE-5061130459 [0,0,0,0,0,1|3,0,0]=4 645 B15R2.68122 NC(=O)CC1=C2C=CC=CC2=CC=C1 MCULE-1799098717 [0,0,0,0,0,1|1,0,0]=2 646 B15R2.68122 NC(=O)C[N+]1=C2C=CC=CC2=CC=C1 MCULE-6643478783 [0,0,0,0,0,1|2,0,0]=3 647 B15R2.68122 NC(=O)C[N+]1=C2C=CC=CC2=CC=C1 MCULE-7069204350 [0,0,0,0,0,1|2,0,0]=3 648 B15R2.68122 NC(=O)NC1=CC=CC2=C1N=CC=C2 MCULE-4414314116 [0,0,0,0,0,1|3,0,0]=4 649 B15R2.68122 NC(=O)NC1=CC=CC2=CC=CC=C12 MCULE-9293414269 [0,0,0,0,0,1|2,0,0]=3 650 B15R2.68122 NC(=O)NC1=NC=CC2=CC=CC=C12 MCULE-3615821627 [0,0,0,0,0,1|2,0,0]=3 651 B15R2.68122 NC(=O)OC1=C2C=CC=CC2=CC=C1 MCULE-1320543024 [0,0,0,0,0,1|2,0,0]=3 652 B15R2.68122 NC(=S)CC1=C2C=CC=CC2=CC=C1 MCULE-8406217511 [0,0,0,0,0,1|1,1,0]=3 653 B15R2.68122 NC(=S)NC1=CC=CC2=C1C=CC=C2 MCULE-3312237822 [0,0,0,0,0,1|2,1,0]=4 654 B15R2.68122 O=C(Cl)CC1=CC=CC2=CC=CC=C12 MCULE-7893586354 [0,0,0,0,0,1|2,0,0]=3 655 B15R2.68122 O=C(O)CC1=C2C=CC=CC2=CN=C1 MCULE-1322464469 [0,0,0,0,0,1|1,0,1]=3 656 B15R2.68122 O=C(O)CC1=C2C=CC=CC2=CN=C1 MCULE-9217372115 [0,0,0,0,0,1|1,0,1]=3 657 B15R2.68122 O=C(O)CC1=C2C=CC=CC2=NC=N1 MCULE-3394383006 [0,0,0,0,0,1|1,0,1]=3 658 B15R2.68122 O=C(O)CC1=C2C=CC=NC2=CC=C1 MCULE-6518936634 [0,0,0,0,0,1|3,0,0]=4 659 B15R2.68122 O=C(O)CC1=C2C=CN=CC2=CC=C1 MCULE-7300221289 [0,0,0,0,0,1|3,0,0]=4 660 B15R2.68122 O=C(O)CC1=C2C=CN=CC2=CC=C1 MCULE-8573987475 [0,0,0,0,0,1|3,0,0]=4 661 B15R2.68122 O=C(O)CC1=C2N=CC=CC2=CC=C1 MCULE-2042227794 [0,0,0,0,0,1|3,0,0]=4 662 B15R2.68122 O=C(O)CC1=CC=CC2=CC=CC=C12 MCULE-1244884723 [0,0,0,0,0,1|2,0,0]=3 663 B15R2.68122 O=C(O)CC1=CC=NC2=C1C=CC=C2 MCULE-3326591019 [0,0,0,0,0,1|1,0,1]=3 664 B15R2.68122 O=C(O)CC1=NC=CC2=C1C=CC=C2 MCULE-2437544672 [0,0,0,0,0,1|2,0,0]=3 665 B15R2.68122 O=C([O-])CC1=C2C=CC=CC2=CC=C1 MCULE-1636771408 [0,0,0,0,0,1|2,0,0]=3 666 B15R2.68122 O=C([O-])CC1=C2C=CC=CC2=CC=N1 MCULE-6019258067 [0,0,0,0,0,1|2,0,0]=3 667 B15R2.68122 O=C([O-])CC1=CC=CC2=C1C=CC=C2 MCULE-4942585639 [0,0,0,0,0,1|2,0,0]=3 668 B15R2.68122 O=C([O-])CC1=CC=NC2=CC=CC=C12 MCULE-1021403041 [0,0,0,0,0,1|1,0,1]=3 669 B15R2.68122 O=C([O-])CC1=NC=CC2=NC=CC=C12 MCULE-2847000735 [0,0,0,0,0,1|3,0,0]=4 670 B15R2.68122 O=C([O-])CC1=NC=CC2=NC=CC=C12 MCULE-7454239143 [0,0,0,0,0,1|3,0,0]=4 671 B15R2.83023 CC(=O)NC1=C2C=CC=CC=C2C=C1 MCULE-2525013211 [0,0,0,0,0,1|3,0,0]=4 672 B12R1.125 CC1=C(C=CC=C1)C=CC(=O)N MCULE-6358361236 [1,0,1,0,0,0|0,0,2]=4 673 B12R1.125 CC1=CC=CC=C1OCC(=O)N MCULE-7049614745 [1,0,1,0,0,0|1,0,1]=4 674 B12R1.125 NC(=O)C=CC1=CC=CC=C1F MCULE-2172697582 [1,0,1,0,0,0|1,0,1]=4 675 B12R1.125 NC(=O)CCC1=C(C=CC=C1)F MCULE-3464151618 [1,0,1,0,0,0|1,0,1]=4 676 B12R1.125 NC(=O)CCC1=C(C=CC=C1)N MCULE-7163988486 [1,0,1,0,0,0|0,0,1]=3 677 B12R1.125 NC(=O)CCC1=CC=CC=C1Cl MCULE-7359271020 [1,0,1,0,0,0|1,0,1]=4 678 B12R1.125 NC(=O)CCC1=CC=CC=C1O MCULE-6563350140 [1,0,1,0,0,0|1,0,1]=4 679 B12R1.125 NC(=O)COC1=C(C=CC=C1)Br MCULE-6843547928 [1,0,1,0,0,0|2,0,0]=4 680 B12R1.125 NC(=O)COC1=C(C=CC=C1)I MCULE-2786204561 [1,0,1,0,0,0|2,0,0]=4 681 B12R1.125 NC(=O)COC1=C(C=CC=C1)O MCULE-2154592280 [1,0,1,0,0,0|2,0,0]=4 682 B12R1.125 NC(=O)COC1=CC=CC=C1Cl MCULE-6372008313 [1,0,1,0,0,0|2,0,0]=4 683 B12R1.125 NC(=O)COC1=CC=CC=C1F MCULE-8187026469 [1,0,1,0,0,0|2,0,0]=4 684 B12R1.125 NC(=O)CSC1=CC=CC=C1N MCULE-8446030479 [1,0,1,0,0,0|1,0,0]=3 685 B12R1.125 NC1=C(C=CC=C1)C=CC(=O)O MCULE-1813623710 [1,0,1,0,0,0|1,0,1]=4 686 B12R1.125 NC1=C(C=CC=C1)SCC(=O)O MCULE-2684589425 [1,0,1,0,0,0|2,0,0]=4 687 B12R1.107 C=C(NC(=O)C)C1=CC=CC=C1 MCULE-1985628354 [1,0,1,0,0,0|2,0,0]=4 688 B12R1.107 C=C(OC(=O)C)C1=CC=CC=C1 MCULE-4064749340 [1,0,1,0,0,0|2,0,0]=4 689 B12R1.107 CC(=O)C=C(N)C1=CC=CC=C1 MCULE-8012328953 [1,0,1,0,0,0|1,0,1]=4 690 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 MCULE-5543155182 [1,0,1,0,0,0|2,0,0]=4 691 B12R1.107 CC(CC(=O)N)C1=CC=CC=C1 MCULE-3754045547 [1,0,1,0,0,0|0,0,2]=4 692 B12R1.107 NC(=O)CC(=O)C1=CC=CC=C1 MCULE-9691688431 [1,0,1,0,0,0|1,0,0]=3 693 B12R1.107 NC(=O)C[C@H](N)C1=NC=CC=C1 MCULE-2055508769 [1,0,1,0,0,0|1,0,1]=4 694 B12R1.107 NC(=O)NC(=O)C1=CC=CC=C1 MCULE-1037521403 [1,0,1,0,0,0|2,0,0]=4 695 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 MCULE-2945759933 [1,0,1,0,0,0|1,0,1]=4 696 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 MCULE-3660219565 [1,0,1,0,0,0|1,0,1]=4 697 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 MCULE-5669000935 [1,0,1,0,0,0|1,0,1]=4 698 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 MCULE-6127429811 [1,0,1,0,0,0|1,0,1]=4 699 B12R1.107 NN(CC(=O)O)C1=CC=CC=C1 MCULE-6961208756 [1,0,1,0,0,0|2,0,0]=4 700 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 MCULE-2881987414 [1,0,1,0,0,0|1,0,1]=4 701 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 MCULE-4499633586 [1,0,1,0,0,0|1,0,1]=4 702 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 MCULE-8154475618 [1,0,1,0,0,0|1,0,1]=4 703 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 MCULE-9668897685 [1,0,1,0,0,0|1,0,1]=4 704 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 MCULE-1696975646 [1,0,1,0,0,0|1,0,1]=4 705 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 MCULE-4246457220 [1,0,1,0,0,0|1,0,1]=4 706 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 MCULE-6312772741 [1,0,1,0,0,0|1,0,1]=4 707 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 MCULE-9809220026 [1,0,1,0,0,0|1,0,1]=4 708 B12R1.107 O=C(O)CC(=O)C1=CC=CC=C1 MCULE-6221631058 [1,0,1,0,0,0|2,0,0]=4 709 B12R1.107 O=C([O-])CC(=O)C1=CC=CC=C1 MCULE-2660128967 [1,0,1,0,0,0|2,0,0]=4 710 B12R1.308 NCCC(=O)C1=C(C=CC=C1)N MCULE-1856278005 [1,0,1,0,0,0|1,0,1]=4 711 B12R1.308 NCCC(=O)C1=C(C=CC=C1)N MCULE-3193536846 [1,0,1,0,0,0|1,0,1]=4 712 B12R1.308 NCCC(=O)C1=C(C=CC=C1)N MCULE-4036784099 [1,0,1,0,0,0|1,0,1]=4 713 B12R2.1 BrCC1=CNC2=C1C=CC=C2 MCULE-1377909031 [2,0,0,0,0,0|1,0,0]=3 714 B12R2.1 BrCC1=CNC2=C1C=CC=N2 MCULE-8584278715 [2,0,0,0,0,0|2,0,0]=4 715 B12R2.1 BrCC1=COC2=CC=CC=C12 MCULE-3522363001 [2,0,0,0,0,0|2,0,0]=4 716 B12R2.1 BrCC1=CSC2=C1C=CC=C2 MCULE-9793829732 [2,0,0,0,0,0|2,0,0]=4 717 B12R2.1 BrCC1=NNC2=C1C=CC=C2 MCULE-3908845668 [2,0,0,0,0,0|2,0,0]=4 718 B12R2.1 C#CC1=CNC2=C1C=CC=C2 MCULE-5263503284 [2,0,0,0,0,0|0,0,2]=4 719 B12R2.1 CCC1=CNC2=C1C=CC=C2 MCULE-3241860725 [2,0,0,0,0,0|0,0,1]=3 720 B12R2.1 CCC1=NNC2=C1C=CC=C2 MCULE-3985662148 [2,0,0,0,0,0|1,0,1]=4 721 B12R2.1 COC1=CNC2=C1C=CC=C2 MCULE-1213990459 [2,0,0,0,0,0|1,0,1]=4 722 B12R2.1 ClCC1=CNC2=NC=CC=C12 MCULE-5345451045 [2,0,0,0,0,0|2,0,0]=4 723 B12R2.1 ClCC1=COC2=CC=CC=C12 MCULE-1295511115 [2,0,0,0,0,0|2,0,0]=4 724 B12R2.1 N#CC1=CNC2=C1C=CC=C2 MCULE-7698645213 [2,0,0,0,0,0|0,0,2]=4 725 B12R2.1 NCC1=C2C=CC=CN2N=C1 MCULE-1172350284 [2,0,0,0,0,0|1,0,1]=4 726 B12R2.1 NCC1=C2C=CC=CN2N=C1 MCULE-3396947144 [2,0,0,0,0,0|1,0,1]=4 727 B12R2.1 NCC1=C2C=CC=CN2N=C1 MCULE-5633315258 [2,0,0,0,0,0|1,0,1]=4 728 B12R2.1 NCC1=CN=C2N1C=CC=C2 MCULE-3943816471 [2,0,0,0,0,0|1,0,1]=4 729 B12R2.1 NCC1=CN=C2N1C=CC=C2 MCULE-6366036872 [2,0,0,0,0,0|1,0,1]=4 730 B12R2.1 NCC1=CN=C2N1C=CC=C2 MCULE-9999616493 [2,0,0,0,0,0|1,0,1]=4 731 B12R2.1 NCC1=CNC2=C1C=CC=C2 MCULE-2819825629 [2,0,0,0,0,0|0,0,0]=2 732 B12R2.1 NCC1=CNC2=C1C=CC=C2 MCULE-5055326468 [2,0,0,0,0,0|0,0,0]=2 733 B12R2.1 NCC1=CNC2=C1C=CC=C2 MCULE-6053621035 [2,0,0,0,0,0|0,0,0]=2 734 B12R2.1 NCC1=CNC2=C1C=CN=C2 MCULE-9171113565 [2,0,0,0,0,0|1,0,0]=3 735 B12R2.1 NCC1=CNC2=C1C=NC=C2 MCULE-5741147455 [2,0,0,0,0,0|1,0,0]=3 736 B12R2.1 NCC1=CNC2=C1C=NC=N2 MCULE-4336458844 [2,0,0,0,0,0|2,0,0]=4 737 B12R2.1 NCC1=CNC2=CC=CN=C12 MCULE-9601781185 [2,0,0,0,0,0|1,0,0]=3 738 B12R2.1 NCC1=CNC2=NC=CC=C12 MCULE-2782562812 [2,0,0,0,0,0|1,0,0]=3 739 B12R2.1 NCC1=CNC2=NC=CC=C12 MCULE-5053567068 [2,0,0,0,0,0|1,0,0]=3 740 B12R2.1 NCC1=CNC2=NC=CC=C12 MCULE-8210374854 [2,0,0,0,0,0|1,0,0]=3 741 B12R2.1 NCC1=COC2=CC=CC=C12 MCULE-7222873597 [2,0,0,0,0,0|1,0,0]=3 742 B12R2.1 NCC1=CSC2=C1C=CC=C2 MCULE-2116073937 [2,0,0,0,0,0|1,0,0]=3 743 B12R2.1 NCC1=CSC2=C1C=CC=C2 MCULE-2816554904 [2,0,0,0,0,0|1,0,0]=3 744 B12R2.1 NCC1=CSC2=NC=CC=C12 MCULE-6778449072 [2,0,0,0,0,0|2,0,0]=4 745 B12R2.1 NCC1=NNC2=C1C=CC=C2 MCULE-4479782378 [2,0,0,0,0,0|1,0,0]=3 746 B12R2.1 NCC1=NNC2=CC=CC=C12 MCULE-1747658348 [2,0,0,0,0,0|1,0,0]=3 747 B12R2.1 NCC1=NNC2=CC=CC=C12 MCULE-7361342855 [2,0,0,0,0,0|1,0,0]=3 748 B12R2.1 NCC1=NNC2=NC=CC=C12 MCULE-2071695584 [2,0,0,0,0,0|2,0,0]=4 749 B12R2.1 NCC1=NNC2=NC=CC=C12 MCULE-8009206795 [2,0,0,0,0,0|2,0,0]=4 750 B12R2.1 NCC1=NOC2=C1C=CC=C2 MCULE-1516680874 [2,0,0,0,0,0|2,0,0]=4 751 B12R2.1 NCC1=NOC2=C1C=CC=C2 MCULE-6144448150 [2,0,0,0,0,0|2,0,0]=4 752 B12R2.1 NCC1=NSC2=C1C=CC=C2 MCULE-2468048020 [2,0,0,0,0,0|2,0,0]=4 753 B12R2.1 NCC1=NSC2=C1C=CC=C2 MCULE-2825512825 [2,0,0,0,0,0|2,0,0]=4 754 B12R2.1 NCC1CNC2=C1C=CC=C2 MCULE-7121055363 [2,0,0,0,0,0|0,0,2]=4 755 B12R2.1 NCC1CNC2=C1C=CC=C2 MCULE-7582859068 [2,0,0,0,0,0|0,0,2]=4 756 B12R2.1 O=CC1=C2C=CC=CC2=NO1 MCULE-6565012023 [2,0,0,0,0,0|1,0,1]=4 757 B12R2.1 O=CC1=C2C=CC=CC2=NS1 MCULE-9169142297 [2,0,0,0,0,0|1,0,1]=4 758 B12R2.1 O=CC1=C2C=CC=CN2C=C1 MCULE-3445944828 [2,0,0,0,0,0|2,0,0]=4 759 B12R2.1 O=CC1=C2C=CC=CN2N=C1 MCULE-5943682971 [2,0,0,0,0,0|1,0,1]=4 760 B12R2.1 O=CC1=C2C=CNC=C2N=C1 MCULE-4254665317 [2,0,0,0,0,0|1,0,1]=4 761 B12R2.1 O=CC1=C2NC=CC=C2N=C1 MCULE-8147422270 [2,0,0,0,0,0|1,0,1]=4 762 B12R2.1 O=CC1=CC=C2C1=COC=C2 MCULE-7052178299 [2,0,0,0,0,0|2,0,0]=4 763 B12R2.1 O=CC1=CN=C2C1=CNC=C2 MCULE-2391462408 [2,0,0,0,0,0|1,0,1]=4 764 B12R2.1 O=CC1=CN=C2N1C=CC=C2 MCULE-7299475984 [2,0,0,0,0,0|1,0,1]=4 765 B12R2.1 O=CC1=CNC2=C1C=CC=C2 MCULE-6521465109 [2,0,0,0,0,0|0,0,0]=2 766 B12R2.1 O=CC1=CNC2=C1C=CN=C2 MCULE-4842043328 [2,0,0,0,0,0|1,0,0]=3 767 B12R2.1 O=CC1=CNC2=C1C=NC=C2 MCULE-3910950048 [2,0,0,0,0,0|1,0,0]=3 768 B12R2.1 O=CC1=CNC2=C1C=NC=N2 MCULE-4181147192 [2,0,0,0,0,0|2,0,0]=4 769 B12R2.1 O=CC1=CNC2=C1N=CC=N2 MCULE-4113053394 [2,0,0,0,0,0|2,0,0]=4 770 B12R2.1 O=CC1=CNC2=CC=CN=C12 MCULE-9019395338 [2,0,0,0,0,0|1,0,0]=3 771 B12R2.1 O=CC1=CNC2=NC=CC=C12 MCULE-5889033314 [2,0,0,0,0,0|1,0,0]=3 772 B12R2.1 O=CC1=COC2=C1C=CC=N2 MCULE-9674173706 [2,0,0,0,0,0|2,0,0]=4 773 B12R2.1 O=CC1=COC2=CC=CC=C12 MCULE-4410146513 [2,0,0,0,0,0|1,0,0]=3 774 B12R2.1 O=CC1=CSC2=C1C=CC=C2 MCULE-7350904499 [2,0,0,0,0,0|1,0,0]=3 775 B12R2.1 O=CC1=CSC2=C1C=CN=C2 MCULE-1282451949 [2,0,0,0,0,0|2,0,0]=4 776 B12R2.1 O=CC1=CSC2=CC=CN=C12 MCULE-1392800424 [2,0,0,0,0,0|2,0,0]=4 777 B12R2.1 O=CC1=NNC2=C1C=CC=C2 MCULE-4588152234 [2,0,0,0,0,0|1,0,0]=3 778 B12R2.1 O=CC1=NNC2=C1C=CC=C2 MCULE-8295494530 [2,0,0,0,0,0|1,0,0]=3 779 B12R2.1 O=CC1=NNC2=C1C=CC=N2 MCULE-5767604863 [2,0,0,0,0,0|2,0,0]=4 780 B12R2.1 O=CC1=NOC2=CC=CC=C12 MCULE-1064510305 [2,0,0,0,0,0|2,0,0]=4 781 B12R2.1 OCC1=CNC2=C1C=CC=C2 MCULE-6344603304 [2,0,0,0,0,0|0,0,1]=3 782 B12R2.1 OCC1=CNC2=NC=CC=C12 MCULE-8394439767 [2,0,0,0,0,0|1,0,1]=4 783 B12R2.1 OCC1=COC2=C1C=CC=C2 MCULE-8804617903 [2,0,0,0,0,0|1,0,1]=4 784 B12R2.1 OCC1=CSC2=C1C=CC=C2 MCULE-3372932078 [2,0,0,0,0,0|1,0,1]=4 785 B12R2.1 OCC1=NNC2=C1C=CC=C2 MCULE-6267820363 [2,0,0,0,0,0|1,0,1]=4 786 B12R2.1 SCC1=CSC2=C1C=CC=C2 MCULE-2183190344 [2,0,0,0,0,0|1,1,0]=4 787 B14R1.482 C=CCC1=CC=CC=C1OCC(=O)N MCULE-1094687785 [0,1,1,0,0,0|2,0,0]=4 788 B14R1.420 CC(C=CCC(=O)O)C1=CC=CC=C1 MCULE-3538407133 [0,1,1,0,0,0|2,0,0]=4 789 B14R1.423 CC(=O)CCC(=O)NC1=CC=CC=C1 MCULE-7535277339 [0,1,1,0,0,0|1,0,1]=4 790 B14R1.423 NC(=O)C=CC(=O)NC1=CC=CC=C1 MCULE-1225235166 [0,1,1,0,0,0|0,0,1]=3 791 B14R1.423 NC(=O)NNC(=O)NC1=CC=CC=C1 MCULE-8357570466 [0,1,1,0,0,0|2,0,0]=4 792 B14R1.423 NC(=O)NNC(=S)NC1=CC=CC=C1 MCULE-3262626130 [0,1,1,0,0,0|2,0,0]=4 793 B14R1.423 NC(=O)SCC(=O)NC1=CC=CC=C1 MCULE-9240800584 [0,1,1,0,0,0|1,0,1]=4 794 B14R1.423 O=C(O)/C=C/C(=O)NC1=CC=CC=C1 MCULE-7600875856 [0,1,1,0,0,0|1,0,1]=4 795 B14R1.423 O=C(O)/C=C\C(=O)NC1=CC=CC=C1 MCULE-3769068478 [0,1,1,0,0,0|1,0,1]=4 796 B14R1.423 O=C(O)C=CC(=O)NC1=CC=CC=C1 MCULE-2659321975 [0,1,1,0,0,0|1,0,1]=4 797 B14R1.423 O=C(O)CCC(=O)NC1=CC=CC=C1 MCULE-2207328919 [0,1,1,0,0,0|1,0,1]=4 798 B14R1.423 O=C(O)CNC(=O)NC1=CC=CC=C1 MCULE-5518652665 [0,1,1,0,0,0|2,0,0]=4 799 B14R1.423 O=C(O)CNC(=S)NC1=CC=CC=C1 MCULE-8204338738 [0,1,1,0,0,0|2,0,0]=4 800 B14R1.716 NNC(=O)CCCNC1=CC=CC=C1 MCULE-4936689211 [0,1,1,0,0,0|0,0,2]=4 801 B14R1.818 CC(=O)CC(=O)C=CC1=CC=CC=C1 MCULE-3696385223 [0,1,1,0,0,0|2,0,0]=4 802 B14R1.818 CC(=O)CC(=O)NNC1=CC=CC=C1 MCULE-8599617557 [0,1,1,0,0,0|2,0,0]=4 803 B14R2.3 CCNCC1=CNC2=C1C=CC=C2 MCULE-4097971327 [1,1,0,0,0,0|1,0,1]=4 804 B14R2.3 CCNCC1=CNC2=C1C=CC=C2 MCULE-9425269407 [1,1,0,0,0,0|1,0,1]=4 805 B14R2.3 CNCCC1=CNC2=CC=CN=C12 MCULE-6308406696 [1,1,0,0,0,0|1,0,1]=4 806 B14R2.3 N#C/C=C/C1=CNC2=C1C=CC=C2 MCULE-4699680032 [1,1,0,0,0,0|0,0,2]=4 807 B14R2.3 N#C/C=C\C1=CNC2=C1C=CC=C2 MCULE-6819783108 [1,1,0,0,0,0|0,0,2]=4 808 B14R2.3 N#CC=CC1=CNC2=C1C=CC=C2 MCULE-3316470064 [1,1,0,0,0,0|0,0,2]=4 809 B14R2.3 N#CCCC1=CNC2=CC=CC=C12 MCULE-9844349638 [1,1,0,0,0,0|0,0,2]=4 810 B14R2.3 NCCCC1=CNC2=C1C=CC=N2 MCULE-6962821583 [1,1,0,0,0,0|1,0,1]=4 811 B14R2.3 NCCCC1=CNC2=CC=CC=C12 MCULE-4742640218 [1,1,0,0,0,0|0,0,1]=3 812 B14R2.3 NCCSC1=CNC2=C1C=CC=C2 MCULE-5852531217 [1,1,0,0,0,0|0,0,1]=3 813 B14R2.3 NCCSC1=CNC2=C1C=CC=C2 MCULE-6122840857 [1,1,0,0,0,0|0,0,1]=3 814 B14R2.3 NNCCC1=CNC2=CC=CC=C12 MCULE-3881420803 [1,1,0,0,0,0|0,0,1]=3 815 B14R2.3 O=CCCC1=CNC2=CC=CC=C12 MCULE-6631491514 [1,1,0,0,0,0|0,0,0]=2 816 B14R2.3 OCCCC1=CNC2=C1C=CC=C2 MCULE-2483523215 [1,1,0,0,0,0|0,0,2]=4 817 B14R2.3 ON=CCC1=CNC2=C1C=CC=C2 MCULE-2984317759 [1,1,0,0,0,0|0,0,1]=3 818 B14R2.3 OOCCC1=CNC2=CC=CC=C12 MCULE-6615259809 [1,1,0,0,0,0|0,0,2]=4 819 B14R2.7 CC1=C2NC=C(C2=CC=C1)CC#N MCULE-5375119433 [1,1,0,0,0,0|0,0,2]=4 820 B14R2.7 CC1=C2NC=C(C2=CC=C1)CCN MCULE-5125649614 [1,1,0,0,0,0|0,0,1]=3 821 B14R2.7 CC1=CC=CC2=C1NC=C2CCN MCULE-2234524617 [1,1,0,0,0,0|0,0,1]=3 822 B14R2.7 CC1=CC=CC2=C1NC=C2CCO MCULE-9110086515 [1,1,0,0,0,0|0,0,2]=4 823 B14R2.7 N#CCC1=CNC2=C(C=CC=C12)Cl MCULE-6273824580 [1,1,0,0,0,0|0,0,2]=4 824 B14R2.7 N#CCC1=CNC2=C1C=CC=C2Br MCULE-1624118553 [1,1,0,0,0,0|0,0,2]=4 825 B14R2.7 N#CCC1=CNC2=C1C=CC=C2F MCULE-7083811655 [1,1,0,0,0,0|0,0,2]=4 826 B14R2.7 NCCC1=CNC2=C1C=CC=C2Br MCULE-2895426890 [1,1,0,0,0,0|0,0,1]=3 827 B14R2.7 NCCC1=CNC2=C1C=CC=C2Br MCULE-4513863151 [1,1,0,0,0,0|0,0,1]=3 828 B14R2.7 NCCC1=CNC2=C1C=CC=C2Cl MCULE-5332136932 [1,1,0,0,0,0|0,0,1]=3 829 B14R2.7 NCCC1=CNC2=C1C=CC=C2Cl MCULE-6749560540 [1,1,0,0,0,0|0,0,1]=3 830 B14R2.7 NCCC1=CNC2=C1C=CC=C2F MCULE-4387630231 [1,1,0,0,0,0|0,0,1]=3 831 B14R2.7 NCCC1=CNC2=C1C=CC=C2F MCULE-8095757837 [1,1,0,0,0,0|0,0,1]=3 832 B14R2.7 OCCC1=CNC2=C1C=CC=C2Br MCULE-4169326468 [1,1,0,0,0,0|0,0,2]=4 833 B14R2.7 OCCC1=CNC2=C1C=CC=C2F MCULE-5799713175 [1,1,0,0,0,0|0,0,2]=4 834 B14R2.95 C=CC(=O)C1=CNC2=C1C=CC=C2 MCULE-3504974348 [1,1,0,0,0,0|1,0,1]=4 835 B14R2.95 C=C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-1507417467 [1,1,0,0,0,0|1,0,0]=3 836 B14R2.95 C=C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-7776521460 [1,1,0,0,0,0|1,0,0]=3 837 B14R2.95 C=C[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-2278442738 [1,1,0,0,0,0|2,0,0]=4 838 B14R2.95 C=C[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-6428206593 [1,1,0,0,0,0|2,0,0]=4 839 B14R2.95 C=C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-5319397218 [1,1,0,0,0,0|1,0,0]=3 840 B14R2.95 C=C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-7048021326 [1,1,0,0,0,0|1,0,0]=3 841 B14R2.95 C=C[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-1338956695 [1,1,0,0,0,0|2,0,0]=4 842 B14R2.95 C=C[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-7917693904 [1,1,0,0,0,0|2,0,0]=4 843 B14R2.95 CC(CN)C1=CNC2=C1C=CC=C2 MCULE-2524027121 [1,1,0,0,0,0|0,0,1]=3 844 B14R2.95 CC(CN)C1=CNC2=C1C=CC=C2 MCULE-8518594417 [1,1,0,0,0,0|0,0,1]=3 845 B14R2.95 CCC(N)C1=CNC2=CC=CC=C12 MCULE-9601467684 [1,1,0,0,0,0|1,0,1]=4 846 B14R2.95 CC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-2548857475 [1,1,0,0,0,0|1,0,1]=4 847 B14R2.95 CC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-9595198478 [1,1,0,0,0,0|1,0,1]=4 848 B14R2.95 CC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-3952399591 [1,1,0,0,0,0|1,0,1]=4 849 B14R2.95 CC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-7708332324 [1,1,0,0,0,0|1,0,1]=4 850 B14R2.95 C[C@@H](CN)C1=CNC2=C1C=CC=C2 MCULE-6876043306 [1,1,0,0,0,0|0,0,1]=3 851 B14R2.95 C[C@@H](CN)C1=CNC2=C1C=CC=C2 MCULE-8356316160 [1,1,0,0,0,0|0,0,1]=3 852 B14R2.95 NCC(=O)C1=CNC2=CC=CC=C12 MCULE-2911174687 [1,1,0,0,0,0|0,0,2]=4 853 B14R2.95 NCC(=O)C1=CNC2=CC=CC=C12 MCULE-6522696111 [1,1,0,0,0,0|0,0,2]=4 854 B14R2.95 NCC(O)C1=CSC2=C1C=CC=C2 MCULE-7884006310 [1,1,0,0,0,0|1,0,1]=4 855 B14R2.95 NC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-6862059399 [1,1,0,0,0,0|0,0,1]=3 856 B14R2.95 NC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-9802671952 [1,1,0,0,0,0|0,0,1]=3 857 B14R2.95 NC[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-2158812331 [1,1,0,0,0,0|1,0,1]=4 858 B14R2.95 NC[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-9587262604 [1,1,0,0,0,0|1,0,1]=4 859 B14R2.95 NC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-7518677701 [1,1,0,0,0,0|0,0,1]=3 860 B14R2.95 NC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-8036912777 [1,1,0,0,0,0|0,0,1]=3 861 B14R2.95 NC[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-1509513367 [1,1,0,0,0,0|1,0,1]=4 862 B14R2.95 NC[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-3970432402 [1,1,0,0,0,0|1,0,1]=4 863 B14R2.95 NNC(=O)C1=CNC2=C1C=CC=C2 MCULE-5308709857 [1,1,0,0,0,0|1,0,1]=4 864 B14R2.95 N[C@@H](CF)C1=CNC2=CC=CC=C12 MCULE-4520685200 [1,1,0,0,0,0|1,0,1]=4 865 B14R2.95 N[C@@H](CF)C1=CNC2=CC=CC=C12 MCULE-6762295141 [1,1,0,0,0,0|1,0,1]=4 866 B14R2.95 N[C@@H](CO)C1=CNC2=CC=CC=C12 MCULE-7740304645 [1,1,0,0,0,0|0,0,2]=4 867 B14R2.95 N[C@@H](CO)C1=CNC2=CC=CC=C12 MCULE-8814916599 [1,1,0,0,0,0|0,0,2]=4 868 B14R2.95 N[C@H](CF)C1=CNC2=CC=CC=C12 MCULE-2440955777 [1,1,0,0,0,0|1,0,1]=4 869 B14R2.95 N[C@H](CF)C1=CNC2=CC=CC=C12 MCULE-4015036462 [1,1,0,0,0,0|1,0,1]=4 870 B14R2.95 N[C@H](CO)C1=CNC2=CC=CC=C12 MCULE-1415139011 [1,1,0,0,0,0|0,0,2]=4 871 B14R2.95 N[C@H](CO)C1=CNC2=CC=CC=C12 MCULE-7893842300 [1,1,0,0,0,0|0,0,2]=4 872 B14R2.467 CC1=CC2=C(C=C1)C(=CN2)CC#N MCULE-6589408631 [1,1,0,0,0,0|0,0,2]=4 873 B14R2.467 CC1=CC2=C(C=C1)C(=CN2)CCN MCULE-2718317217 [1,1,0,0,0,0|0,0,1]=3 874 B14R2.467 CC1=CC2=C(C=C1)C(=CN2)CCN MCULE-5808959842 [1,1,0,0,0,0|0,0,1]=3 875 B14R2.467 N#CCC1=CNC2=C1C=CC(=C2)Br MCULE-5316863505 [1,1,0,0,0,0|0,0,2]=4 876 B14R2.467 N#CCC1=CNC2=C1C=CC(=C2)Cl MCULE-5269271243 [1,1,0,0,0,0|0,0,2]=4 877 B14R2.467 N#CCC1=CNC2=C1C=CC(=C2)F MCULE-3900773794 [1,1,0,0,0,0|0,0,2]=4 878 B14R2.467 N#CCC1=CNC2=CC(=CC=C12)N MCULE-4403363747 [1,1,0,0,0,0|0,0,2]=4 879 B14R2.467 NCCC1=CNC2=C1C=CC(=C2)Br MCULE-3654770635 [1,1,0,0,0,0|0,0,1]=3 880 B14R2.467 NCCC1=CNC2=C1C=CC(=C2)Br MCULE-5128964812 [1,1,0,0,0,0|0,0,1]=3 881 B14R2.467 NCCC1=CNC2=C1C=CC(=C2)Cl MCULE-2849563068 [1,1,0,0,0,0|0,0,1]=3 882 B14R2.467 NCCC1=CNC2=C1C=CC(=C2)Cl MCULE-6824955664 [1,1,0,0,0,0|0,0,1]=3 883 B14R2.467 NCCC1=CNC2=C1C=CC(=C2)F MCULE-1468431494 [1,1,0,0,0,0|0,0,1]=3 884 B14R2.467 NCCC1=CNC2=C1C=CC(=C2)F MCULE-4237395448 [1,1,0,0,0,0|0,0,1]=3 885 B14R2.467 NCCC1=CNC2=CC(=CC=C12)O MCULE-3353397765 [1,1,0,0,0,0|0,0,1]=3 886 B14R2.467 NCCC1=CNC2=CC(=CC=C12)O MCULE-5439697244 [1,1,0,0,0,0|0,0,1]=3 887 B14R2.467 NCCC1=NNC2=C1C=CC(=C2)F MCULE-2754263907 [1,1,0,0,0,0|1,0,1]=4 888 B14R2.467 NCCC1=NNC2=C1C=CC(=C2)F MCULE-5260352914 [1,1,0,0,0,0|1,0,1]=4 889 B14R2.467 OCCC1=CNC2=C1C=CC(=C2)Br MCULE-5106895692 [1,1,0,0,0,0|0,0,2]=4 890 B14R2.467 OCCC1=CNC2=C1C=CC(=C2)Cl MCULE-8752452234 [1,1,0,0,0,0|0,0,2]=4 891 B14R2.467 OCCC1=CNC2=CC(=CC=C12)F MCULE-5549574878 [1,1,0,0,0,0|0,0,2]=4 892 B14R2.510 C=CC[N+]1=CN(C2=C1C=CC=C2)C MCULE-6791919324 [1,1,0,0,0,0|2,0,0]=4 893 B14R2.510 C=CC[N+]1=CN(C2=C1C=CC=C2)C MCULE-8976895425 [1,1,0,0,0,0|2,0,0]=4 894 B14R2.510 CN1C=C(C2=C1C=CC=C2)CCBr MCULE-7557397477 [1,1,0,0,0,0|1,0,1]=4 895 B14R2.510 CN1C=C(C2=C1C=CC=C2)CCN MCULE-1110655685 [1,1,0,0,0,0|0,0,1]=3 896 B14R2.510 CN1C=C(C2=C1C=CC=C2)CCN MCULE-8175676285 [1,1,0,0,0,0|0,0,1]=3 897 B14R2.510 CN1C=C(C2=C1C=CC=C2)N=C=O MCULE-3433388505 [1,1,0,0,0,0|1,0,1]=4 898 B14R2.510 CN1C=C(C2=C1N=CC=C2)CCN MCULE-4061059287 [1,1,0,0,0,0|1,0,1]=4 899 B14R2.510 CN1C=C(C2=C1N=CC=C2)CCN MCULE-8801765830 [1,1,0,0,0,0|1,0,1]=4 900 B14R2.510 CN1C=C(C2=CC=CC=C12)CC#N MCULE-2862148601 [1,1,0,0,0,0|0,0,2]=4 901 B14R2.510 CN1C=C(C2=CC=CC=C12)CCN MCULE-4787274011 [1,1,0,0,0,0|0,0,1]=3 902 B14R2.510 CN1C=C(C2=CC=CC=C12)CCO MCULE-6145924171 [1,1,0,0,0,0|0,0,2]=4 903 B14R2.510 CN1N=C(C2=C1C=CC=C2)CCN MCULE-4567510139 [1,1,0,0,0,0|1,0,1]=4 904 B14R2.510 CN1N=C(C2=C1C=CC=C2)CON MCULE-2595593856 [1,1,0,0,0,0|2,0,0]=4 905 B14R2.510 CNCC1=CN(C2=C1C=CC=C2)C MCULE-3351387076 [1,1,0,0,0,0|2,0,0]=4 906 B14R2.510 CNCC1=CN(C2=C1C=CC=C2)C MCULE-6484917922 [1,1,0,0,0,0|2,0,0]=4 907 B14R2.517 C=CCN1C(=O)NC2=CC=CC=C12 MCULE-4624257377 [1,1,0,0,0,0|2,0,0]=4 908 B14R2.517 CC1=C(C2=C(N1)C=CC=C2)CC#N MCULE-5380835406 [1,1,0,0,0,0|0,0,2]=4 909 B14R2.517 CC1=C(C2=C(N1)C=CC=C2)CCN MCULE-3061128016 [1,1,0,0,0,0|0,0,1]=3 910 B14R2.517 CC1=C(C2=C(N1)C=CC=C2)CCN MCULE-5001253895 [1,1,0,0,0,0|0,0,1]=3 911 B14R2.517 CC1=C(C2=C(N1)C=CC=C2)CCN MCULE-8552900859 [1,1,0,0,0,0|0,0,1]=3 912 B14R2.517 CC1=C(C2=C(N1)C=CC=C2)CCO MCULE-3951073177 [1,1,0,0,0,0|0,0,2]=4 913 B14R2.517 CC1=C(C2=C(O1)C=CC=C2)CCN MCULE-3395133305 [1,1,0,0,0,0|1,0,1]=4 914 B14R2.517 CC1=C(C2=C(O1)C=CC=C2)CCN MCULE-8844943169 [1,1,0,0,0,0|1,0,1]=4 915 B14R2.517 CC1=C(C2=CC=CC=C2N1)CCN MCULE-7938887796 [1,1,0,0,0,0|0,0,1]=3 916 B14R2.517 CNCC1=C(NC2=C1C=CC=C2)C MCULE-3991508517 [1,1,0,0,0,0|2,0,0]=4 917 B14R2.517 CNCC1=C(NC2=CC=CC=C12)Cl MCULE-4048992116 [1,1,0,0,0,0|2,0,0]=4 918 B14R2.517 NCCC1C(=O)NC2=CC=CC=C12 MCULE-4345291438 [1,1,0,0,0,0|0,0,2]=4 919 B14R2.517 NCCN1C(=O)NC2=C1C=CC=C2 MCULE-5935193390 [1,1,0,0,0,0|1,0,1]=4 920 B14R2.517 NCCN1C(=O)NC2=C1C=CC=C2 MCULE-9516593815 [1,1,0,0,0,0|1,0,1]=4 921 B14R2.517 O=CCN1C(=O)OC2=CC=CC=C12 MCULE-9875664217 [1,1,0,0,0,0|2,0,0]=4 922 B14R2.6368 CC1=C2C(=CNC2=CC=C1)CC#N MCULE-1711509063 [1,1,0,0,0,0|0,0,2]=4 923 B14R2.6368 CC1=C2C(=CNC2=CC=C1)CCN MCULE-7839154392 [1,1,0,0,0,0|0,0,1]=3 924 B14R2.6368 N#CCC1=CNC2=C1C(=CC=C2)Cl MCULE-1502377467 [1,1,0,0,0,0|0,0,2]=4 925 B14R2.6368 N#CCC1=CNC2=C1C(=CC=C2)F MCULE-8896117378 [1,1,0,0,0,0|0,0,2]=4 926 B14R2.6368 N#CCC1=CNC2=CC=CC(=C12)Br MCULE-5837086452 [1,1,0,0,0,0|0,0,2]=4 927 B14R2.6368 NCCC1=CNC2=C1C(=CC=C2)Br MCULE-7768974323 [1,1,0,0,0,0|0,0,1]=3 928 B14R2.6368 NCCC1=CNC2=C1C(=CC=C2)Br MCULE-7810002879 [1,1,0,0,0,0|0,0,1]=3 929 B14R2.6368 NCCC1=CNC2=C1C(=CC=C2)Cl MCULE-5634772813 [1,1,0,0,0,0|0,0,1]=3 930 B14R2.6368 NCCC1=CNC2=C1C(=CC=C2)Cl MCULE-6342133461 [1,1,0,0,0,0|0,0,1]=3 931 B14R2.6368 NCCC1=CNC2=C1C(=CC=C2)F MCULE-5535319829 [1,1,0,0,0,0|0,0,1]=3 932 B14R2.6368 NCCC1=CNC2=C1C(=CC=C2)F MCULE-6080224239 [1,1,0,0,0,0|0,0,1]=3 933 B14R2.6368 O=CCC1=CNC2=CC=CC(=C12)F MCULE-7513173080 [1,1,0,0,0,0|0,0,0]=2 934 B14R2.6368 OCCC1=CNC2=C1C(=CC=C2)Cl MCULE-7853286982 [1,1,0,0,0,0|0,0,2]=4 935 B14R2.6368 OCCC1=CNC2=C1C(=CC=C2)F MCULE-8901608481 [1,1,0,0,0,0|0,0,2]=4 936 B14R2.6368 OCCC1=CNC2=CC=CC(=C12)Br MCULE-8021002797 [1,1,0,0,0,0|0,0,2]=4 937 B14R2.6419 C=CCC1=CNC2=NC=C(C=C12)C MCULE-8588420987 [1,1,0,0,0,0|2,0,0]=4 938 B14R2.6419 CC1=CC2=C(C=C1)NC=C2CC#N MCULE-4478452296 [1,1,0,0,0,0|0,0,2]=4 939 B14R2.6419 CC1=CC2=C(N=C1)NC=C2CCN MCULE-9470114772 [1,1,0,0,0,0|1,0,1]=4 940 B14R2.6419 CC1=CC=C2NC=C(C2=C1)CCN MCULE-5312670019 [1,1,0,0,0,0|0,0,1]=3 941 B14R2.6419 CC1=CC=C2NC=C(C2=C1)CC[NH3+] MCULE-3350102887 [1,1,0,0,0,0|0,0,2]=4 942 B14R2.6419 CC1=NC2=C(C=C1)NC=C2CCN MCULE-3253120470 [1,1,0,0,0,0|1,0,1]=4 943 B14R2.6419 CC1=NC2=C(C=C1)NC=C2CCN MCULE-7059867507 [1,1,0,0,0,0|1,0,1]=4 944 B14R2.6419 CNCC1=CNC2=C1C=C(C=C2)C MCULE-2513983186 [1,1,0,0,0,0|2,0,0]=4 945 B14R2.6419 CNCC1=CNC2=C1C=C(C=C2)C MCULE-5405537704 [1,1,0,0,0,0|2,0,0]=4 946 B14R2.6419 CNCC1=CNC2=C1C=C(C=C2)C MCULE-7310283504 [1,1,0,0,0,0|2,0,0]=4 947 B14R2.6419 CNCC1=CNC2=C1C=C(C=C2)F MCULE-9962013314 [1,1,0,0,0,0|2,0,0]=4 948 B14R2.6419 N#CCC1=CNC2=C1C=C(C=C2)Br MCULE-3069474503 [1,1,0,0,0,0|0,0,2]=4 949 B14R2.6419 N#CCC1=CNC2=C1C=C(C=C2)Cl MCULE-3045047131 [1,1,0,0,0,0|0,0,2]=4 950 B14R2.6419 N#CCC1=CNC2=C1C=C(C=C2)F MCULE-9934193424 [1,1,0,0,0,0|0,0,2]=4 951 B14R2.6419 N#CCC1=CNC2=C1C=C(C=C2)N MCULE-3825782364 [1,1,0,0,0,0|0,0,2]=4 952 B14R2.6419 N#CCC1=CNC2=CC=C(C=C12)O MCULE-8562461389 [1,1,0,0,0,0|0,0,2]=4 953 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)Cl MCULE-1995815377 [1,1,0,0,0,0|0,0,1]=3 954 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)Cl MCULE-2646426902 [1,1,0,0,0,0|0,0,1]=3 955 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)Cl MCULE-9765462252 [1,1,0,0,0,0|0,0,1]=3 956 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)F MCULE-9668986440 [1,1,0,0,0,0|0,0,1]=3 957 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)F MCULE-9747714953 [1,1,0,0,0,0|0,0,1]=3 958 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)I MCULE-4069103100 [1,1,0,0,0,0|0,0,1]=3 959 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)I MCULE-5927044877 [1,1,0,0,0,0|0,0,1]=3 960 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)O MCULE-1409159252 [1,1,0,0,0,0|0,0,1]=3 961 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)O MCULE-8194058321 [1,1,0,0,0,0|0,0,1]=3 962 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)O MCULE-8284106623 [1,1,0,0,0,0|0,0,1]=3 963 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)O MCULE-8788459983 [1,1,0,0,0,0|0,0,1]=3 964 B14R2.6419 NCCC1=CNC2=C1C=C(N=C2)Cl MCULE-8813113983 [1,1,0,0,0,0|1,0,1]=4 965 B14R2.6419 NCCC1=CNC2=C1C=C(N=C2)Cl MCULE-9840596557 [1,1,0,0,0,0|1,0,1]=4 966 B14R2.6419 NCCC1=CNC2=CC=C(C=C12)Br MCULE-7659546072 [1,1,0,0,0,0|0,0,1]=3 967 B14R2.6419 NCCC1=COC2=CC=C(C=C12)Cl MCULE-2020120831 [1,1,0,0,0,0|1,0,1]=4 968 B14R2.6419 NCCC1=COC2=CC=C(C=C12)Cl MCULE-8483094621 [1,1,0,0,0,0|1,0,1]=4 969 B14R2.6419 NCCC1=CSC2=C1C=C(C=C2)Cl MCULE-3643575329 [1,1,0,0,0,0|1,0,1]=4 970 B14R2.6419 NCCC1=CSC2=CC=C(C=C12)Br MCULE-6256397326 [1,1,0,0,0,0|1,0,1]=4 971 B14R2.6419 NCCC1=CSC2=CC=C(C=C12)Br MCULE-9542574448 [1,1,0,0,0,0|1,0,1]=4 972 B14R2.6419 O=CCC1=CNC2=NC=C(N=C12)Br MCULE-3247836960 [1,1,0,0,0,0|2,0,0]=4 973 B14R2.6419 OCCC1=CNC2=C1C=C(C=C2)Br MCULE-1537838913 [1,1,0,0,0,0|0,0,2]=4 974 B14R2.6419 OCCC1=CNC2=C1C=C(C=C2)F MCULE-7329374487 [1,1,0,0,0,0|0,0,2]=4 975 B14R2.6419 OCCC1=CNC2=CC=C(C=C12)Cl MCULE-2526798911 [1,1,0,0,0,0|0,0,2]=4 976 B14R2.6419 OCCC1=CNC2=CC=C(C=C12)O MCULE-7666892935 [1,1,0,0,0,0|0,0,2]=4 977 B14R2.6419 [NH3+]CCC1=CNC2=C1C=C(C=C2)O MCULE-9704202042 [1,1,0,0,0,0|0,0,2]=4 978 B14R2.6419 [NH3+]CCC1=CNC2=CC=C(C=C12)Br MCULE-5495035566 [1,1,0,0,0,0|0,0,2]=4 979 B14R2.286 CC(C)(N)C1=CNC2=C1C=CC=C2 MCULE-8624101078 [0,1,0,0,1,0|1,0,1]=4 980 B14R2.286 CS(=O)(=O)C1=CNC2=C1C=CC=C2 MCULE-3601389980 [0,1,0,0,1,0|2,0,0]=4 981 B14R2.286 NS(=O)(=O)C1=CNC2=C1C=CC=C2 MCULE-6563311122 [0,1,0,0,1,0|1,0,0]=3 982 B14R2.286 NS(=O)(=O)C1=COC2=C1C=CC=C2 MCULE-9695744615 [0,1,0,0,1,0|2,0,0]=4 983 B14R2.286 NS(=O)(=O)C1=CSC2=C1C=CC=C2 MCULE-7150466309 [0,1,0,0,1,0|2,0,0]=4 984 B14R2.286 O=S(=O)(Cl)C1=CNC2=C1C=CC=C2 MCULE-7516192857 [0,1,0,0,1,0|2,0,0]=4 985 B14R2.286 O=S(=O)(O)C1=CNC2=C1C=CC=C2 MCULE-1739170231 [0,1,0,0,1,0|2,0,0]=4 986 B14R2.286 O=S(=O)([O-])C1=CNC2=C1C=CC=C2 MCULE-7286070390 [0,1,0,0,1,0|2,0,0]=4 987 B14R2.300 CC(=O)C1=CNC2=C1C=CC(=C2)Br MCULE-9728264166 [0,1,0,0,1,0|1,0,0]=3 988 B14R2.300 CC(=O)C1=CNC2=C1C=CC(=C2)Cl MCULE-3879923449 [0,1,0,0,1,0|1,0,0]=3 989 B14R2.300 CC(=O)C1=CNC2=C1C=CC(=C2)F MCULE-6449142776 [0,1,0,0,1,0|1,0,0]=3 990 B14R2.300 CC(=O)C1=CNC2=C1C=CC(=N2)Br MCULE-5631894917 [0,1,0,0,1,0|2,0,0]=4 991 B14R2.300 CC(=O)C1=CNC2=C1C=CC(=N2)C MCULE-1136007419 [0,1,0,0,1,0|2,0,0]=4 992 B14R2.300 CC(=O)C1=CNC2=C1C=CC(=N2)F MCULE-4836115441 [0,1,0,0,1,0|2,0,0]=4 993 B14R2.300 CC(=O)C1=CNC2=C1C=CC(=N2)I MCULE-7111693659 [0,1,0,0,1,0|2,0,0]=4 994 B14R2.300 CC(=O)C1=CNC2=C1C=CC(=N2)O MCULE-5364066807 [0,1,0,0,1,0|2,0,0]=4 995 B14R2.300 CC(=O)C1=CNC2=C1C=NC(=C2)Br MCULE-7401169171 [0,1,0,0,1,0|2,0,0]=4 996 B14R2.300 CC(=O)C1=CNC2=C1C=NC(=C2)Cl MCULE-1165082346 [0,1,0,0,1,0|2,0,0]=4 997 B14R2.300 CC(=O)C1=CNC2=CC(=CC=C12)C MCULE-6956019091 [0,1,0,0,1,0|1,0,0]=3 998 B14R2.300 CC(=O)C1=CNC2=CC(=CN=C12)Br MCULE-8080040507 [0,1,0,0,1,0|2,0,0]=4 999 B14R2.300 CC(=O)C1=CNC2=CC(=CN=C12)C MCULE-3522217778 [0,1,0,0,1,0|2,0,0]=4 1000 B14R2.300 CC(=O)C1=CNC2=CC(=CN=C12)Cl MCULE-3090703460 [0,1,0,0,1,0|2,0,0]=4 1001 B14R2.300 CC(=O)C1=CNC2=CC(=CN=C12)F MCULE-1562313690 [0,1,0,0,1,0|2,0,0]=4 1002 B14R2.300 CC(=O)C1=CNC2=CC(=CN=C12)O MCULE-2944579548 [0,1,0,0,1,0|2,0,0]=4 1003 B14R2.300 CC(=O)C1=CNC2=NC(=CC=C12)Cl MCULE-2985869871 [0,1,0,0,1,0|2,0,0]=4 1004 B14R2.300 CC(=O)C1=NNC2=C1C=CC(=C2)Br MCULE-9663017154 [0,1,0,0,1,0|2,0,0]=4 1005 B14R2.300 CC1=CC2=C(C=C1)C(=CN2)C(=O)O MCULE-7746839599 [0,1,0,0,1,0|1,0,0]=3 1006 B14R2.300 CC1=CC2=C(C=C1)C(=CO2)C(=O)O MCULE-6155669570 [0,1,0,0,1,0|2,0,0]=4 1007 B14R2.300 CC1=CC2=C(C=C1)C(=CS2)C(=O)Cl MCULE-2084072268 [0,1,0,0,1,0|2,0,0]=4 1008 B14R2.300 CC1=CC2=C(C=C1)C(=CS2)C(=O)O MCULE-2876781408 [0,1,0,0,1,0|2,0,0]=4 1009 B14R2.300 CC1=CC2=C(C=C1)C(=NN2)C(=O)N MCULE-8499749049 [0,1,0,0,1,0|1,0,0]=3 1010 B14R2.300 CC1=CC2=C(C=C1)C(=NN2)C(=O)O MCULE-3759483086 [0,1,0,0,1,0|2,0,0]=4 1011 B14R2.300 CC1=CC2=C(C=N1)C(=CN2)C(=O)O MCULE-5158394436 [0,1,0,0,1,0|2,0,0]=4 1012 B14R2.300 CC1=CC=C2C(=CNC2=N1)C(=O)O MCULE-9841575907 [0,1,0,0,1,0|2,0,0]=4 1013 B14R2.300 CC1=CN=C2C(=C1)NC=C2C(=O)O MCULE-6972856919 [0,1,0,0,1,0|2,0,0]=4 1014 B14R2.300 NC(=O)C1=NSC2=C1C=CC(=C2)Br MCULE-8149187124 [0,1,0,0,1,0|2,0,0]=4 1015 B14R2.300 NC1=CC2=C(C=C1)C(=CN2)C(=O)O MCULE-9310921101 [0,1,0,0,1,0|1,0,0]=3 1016 B14R2.300 NC1=CC2=C(C=C1)C(=NN2)C(=O)O MCULE-6870352588 [0,1,0,0,1,0|2,0,0]=4 1017 B14R2.300 NC1=CN=C2C(=C1)NC=C2C(=O)O MCULE-2261341218 [0,1,0,0,1,0|2,0,0]=4 1018 B14R2.300 O=C(O)C1=CNC2=C1C=CC(=C2)Br MCULE-7402607387 [0,1,0,0,1,0|1,0,0]=3 1019 B14R2.300 O=C(O)C1=CNC2=C1C=CC(=C2)Cl MCULE-7418494612 [0,1,0,0,1,0|1,0,0]=3 1020 B14R2.300 O=C(O)C1=CNC2=C1C=CC(=C2)F MCULE-5028951448 [0,1,0,0,1,0|1,0,0]=3 1021 B14R2.300 O=C(O)C1=CNC2=C1C=CC(=C2)O MCULE-2874117627 [0,1,0,0,1,0|1,0,0]=3 1022 B14R2.300 O=C(O)C1=CNC2=C1C=CC(=N2)Br MCULE-4867121051 [0,1,0,0,1,0|2,0,0]=4 1023 B14R2.300 O=C(O)C1=CNC2=C1C=CC(=N2)Cl MCULE-6762553263 [0,1,0,0,1,0|2,0,0]=4 1024 B14R2.300 O=C(O)C1=CNC2=C1C=NC(=C2)Br MCULE-4041015005 [0,1,0,0,1,0|2,0,0]=4 1025 B14R2.300 O=C(O)C1=CNC2=C1C=NC(=C2)Cl MCULE-7146905240 [0,1,0,0,1,0|2,0,0]=4 1026 B14R2.300 O=C(O)C1=CNC2=C1C=NC(=C2)O MCULE-2693454045 [0,1,0,0,1,0|2,0,0]=4 1027 B14R2.300 O=C(O)C1=CNC2=C1N=CC(=C2)Br MCULE-6562184963 [0,1,0,0,1,0|2,0,0]=4 1028 B14R2.300 O=C(O)C1=CNC2=CC(=CN=C12)Cl MCULE-7896852063 [0,1,0,0,1,0|2,0,0]=4 1029 B14R2.300 O=C(O)C1=CNC2=CC(=CN=C12)F MCULE-8466138757 [0,1,0,0,1,0|2,0,0]=4 1030 B14R2.300 O=C(O)C1=CNC2=CC(=CN=C12)I MCULE-9317613428 [0,1,0,0,1,0|2,0,0]=4 1031 B14R2.300 O=C(O)C1=CNC2=CC(=CN=C12)O MCULE-8806567841 [0,1,0,0,1,0|2,0,0]=4 1032 B14R2.300 O=C(O)C1=CNC2=CC(=NC=C12)F MCULE-1014961685 [0,1,0,0,1,0|2,0,0]=4 1033 B14R2.300 O=C(O)C1=CNC2=NC(=CC=C12)F MCULE-7963380623 [0,1,0,0,1,0|2,0,0]=4 1034 B14R2.300 O=C(O)C1=COC2=C1C=CC(=C2)F MCULE-7452816716 [0,1,0,0,1,0|2,0,0]=4 1035 B14R2.300 O=C(O)C1=COC2=C1C=CC(=C2)O MCULE-4212620714 [0,1,0,0,1,0|2,0,0]=4 1036 B14R2.300 O=C(O)C1=COC2=CC(=CC=C12)Br MCULE-5971395677 [0,1,0,0,1,0|2,0,0]=4 1037 B14R2.300 O=C(O)C1=CSC2=CC(=CC=C12)Br MCULE-9161903714 [0,1,0,0,1,0|2,0,0]=4 1038 B14R2.300 O=C(O)C1=NNC2=C1C=CC(=C2)Cl MCULE-9704152529 [0,1,0,0,1,0|2,0,0]=4 1039 B14R2.300 O=C(O)C1=NNC2=C1C=CC(=C2)I MCULE-6221943867 [0,1,0,0,1,0|2,0,0]=4 1040 B14R2.300 O=C(O)C1=NNC2=C1C=CC(=C2)O MCULE-9188207461 [0,1,0,0,1,0|2,0,0]=4 1041 B14R2.300 O=C(O)C1=NNC2=CC(=CC=C12)Br MCULE-3992134357 [0,1,0,0,1,0|2,0,0]=4 1042 B14R2.300 O=C(O)C1=NNC2=CC(=CC=C12)F MCULE-4509610053 [0,1,0,0,1,0|2,0,0]=4 1043 B14R2.642 CC(=C1C(=O)NC2=CC=CC=C12)C MCULE-9237061165 [0,1,0,0,1,0|2,0,0]=4 1044 B14R2.642 CC(=O)C1=C(NC2=C1C=CC=C2)C MCULE-3514712432 [0,1,0,0,1,0|1,0,0]=3 1045 B14R2.642 CC(=O)C1=C(NC2=C1C=CC=C2)Cl MCULE-6302948399 [0,1,0,0,1,0|1,0,0]=3 1046 B14R2.642 CC(=O)C1=C(OC2=C1C=CC=C2)C MCULE-3965255922 [0,1,0,0,1,0|2,0,0]=4 1047 B14R2.642 CC(=O)C1=C(SC2=C1C=CC=C2)C MCULE-5286190541 [0,1,0,0,1,0|2,0,0]=4 1048 B14R2.642 CC(=O)N1C(=S)NC2=C1C=CC=C2 MCULE-7190993400 [0,1,0,0,1,0|2,0,0]=4 1049 B14R2.642 CC1=C(C2=C(N1)C=CC=C2)C(=O)O MCULE-4338224583 [0,1,0,0,1,0|1,0,0]=3 1050 B14R2.642 CC1=C(C2=C(N1)C=CC=C2)N(=O)=O MCULE-7023460338 [0,1,0,0,1,0|2,0,0]=4 1051 B14R2.642 CC1=C(C2=C(N1)C=CC=C2)[C@@H](C)N MCULE-8345547371 [0,1,0,0,1,0|1,0,1]=4 1052 B14R2.642 CC1=C(C2=C(N1)C=CC=C2)[C@@H](C)N MCULE-8774349401 [0,1,0,0,1,0|1,0,1]=4 1053 B14R2.642 CC1=C(C2=C(N1)C=CC=C2)[C@H](C)N MCULE-1660057457 [0,1,0,0,1,0|1,0,1]=4 1054 B14R2.642 CC1=C(C2=C(N1)C=CC=C2)[C@H](C)N MCULE-9897648731 [0,1,0,0,1,0|1,0,1]=4 1055 B14R2.642 CC1=C(C2=C(N1)C=CN=C2)C(=O)O MCULE-3307427004 [0,1,0,0,1,0|2,0,0]=4 1056 B14R2.642 CC1=C(C2=C(N1)C=NC=C2)C(=O)O MCULE-1894119546 [0,1,0,0,1,0|2,0,0]=4 1057 B14R2.642 CC1=C(C2=C(N1)N=CC=C2)C(=O)O MCULE-1762931772 [0,1,0,0,1,0|2,0,0]=4 1058 B14R2.642 CC1=C(C2=C(O1)C=CC=C2)C(=O)O MCULE-4427881398 [0,1,0,0,1,0|2,0,0]=4 1059 B14R2.642 CC1=C(C2=C(S1)C=CC=C2)C(=O)O MCULE-4777109246 [0,1,0,0,1,0|2,0,0]=4 1060 B14R2.642 CC1=C(C2=CC=CC=C2N1)C(=O)N MCULE-4117396994 [0,1,0,0,1,0|0,0,0]=2 1061 B14R2.642 CC1=C(C2=CC=CC=C2S1)C(=O)N MCULE-2477066608 [0,1,0,0,1,0|1,0,0]=3 1062 B14R2.642 CC1=C(C2=NC=CC=C2N1)C(=O)O MCULE-4029281200 [0,1,0,0,1,0|2,0,0]=4 1063 B14R2.642 CC1=C(N2C=CC=CC2=N1)C(=O)N MCULE-9339104076 [0,1,0,0,1,0|1,0,1]=4 1064 B14R2.642 NC1=C(C2=CC=CC=C2S1)C(=O)O MCULE-7535728128 [0,1,0,0,1,0|2,0,0]=4 1065 B14R2.642 O=C(Cl)C1=C(NC2=CC=CC=C12)Cl MCULE-9731997607 [0,1,0,0,1,0|1,0,0]=3 1066 B14R2.642 O=C(O)C1=C(NC2=C1C=CC=C2)Cl MCULE-6932777113 [0,1,0,0,1,0|1,0,0]=3 1067 B14R2.642 O=C(O)C1=C(OC2=C1C=CC=C2)Cl MCULE-2742565169 [0,1,0,0,1,0|2,0,0]=4 1068 B14R2.5816 CC(=O)C1=CNC2=C1C=C(C=C2)Br MCULE-5996030182 [0,1,0,0,1,0|1,0,0]=3 1069 B14R2.5816 CC(=O)C1=CNC2=C1C=C(C=N2)C MCULE-6312045669 [0,1,0,0,1,0|2,0,0]=4 1070 B14R2.5816 CC(=O)C1=CNC2=C1C=C(C=N2)Cl MCULE-8674191720 [0,1,0,0,1,0|2,0,0]=4 1071 B14R2.5816 CC(=O)C1=CNC2=C1C=C(C=N2)F MCULE-7599472749 [0,1,0,0,1,0|2,0,0]=4 1072 B14R2.5816 CC(=O)C1=CNC2=C1C=C(C=N2)I MCULE-2399517114 [0,1,0,0,1,0|2,0,0]=4 1073 B14R2.5816 CC(=O)C1=CNC2=C1C=C(C=N2)O MCULE-2617473476 [0,1,0,0,1,0|2,0,0]=4 1074 B14R2.5816 CC(=O)C1=CNC2=CC=C(C=C12)C MCULE-3974175009 [0,1,0,0,1,0|1,0,0]=3 1075 B14R2.5816 CC(=O)C1=CNC2=CC=C(C=C12)Cl MCULE-1210972902 [0,1,0,0,1,0|1,0,0]=3 1076 B14R2.5816 CC(=O)C1=CNC2=CC=C(C=C12)F MCULE-5326424870 [0,1,0,0,1,0|1,0,0]=3 1077 B14R2.5816 CC(=O)C1=CNC2=CC=C(N=C12)Br MCULE-7492948036 [0,1,0,0,1,0|2,0,0]=4 1078 B14R2.5816 CC(=O)C1=CNC2=CC=C(N=C12)C MCULE-6199204301 [0,1,0,0,1,0|2,0,0]=4 1079 B14R2.5816 CC(=O)C1=CNC2=CC=C(N=C12)Cl MCULE-8709441168 [0,1,0,0,1,0|2,0,0]=4 1080 B14R2.5816 CC(=O)C1=CNC2=CC=C(N=C12)F MCULE-1035592334 [0,1,0,0,1,0|2,0,0]=4 1081 B14R2.5816 CC(=O)C1=CNC2=CC=C(N=C12)O MCULE-9740960666 [0,1,0,0,1,0|2,0,0]=4 1082 B14R2.5816 CC(=O)C1=CNC2=CN=C(C=C12)Br MCULE-1393690468 [0,1,0,0,1,0|2,0,0]=4 1083 B14R2.5816 CC(=O)C1=CNC2=CN=C(C=C12)C MCULE-1000122542 [0,1,0,0,1,0|2,0,0]=4 1084 B14R2.5816 CC(=O)C1=CNC2=CN=C(C=C12)Cl MCULE-7474669554 [0,1,0,0,1,0|2,0,0]=4 1085 B14R2.5816 CC(=O)C1=CNC2=NC=C(C=C12)Br MCULE-7439275919 [0,1,0,0,1,0|2,0,0]=4 1086 B14R2.5816 CC(=O)C1=CSC2=CC=C(C=C12)Br MCULE-3891394924 [0,1,0,0,1,0|2,0,0]=4 1087 B14R2.5816 CC(=O)C1=CSC2=CC=C(C=C12)Cl MCULE-7947100698 [0,1,0,0,1,0|2,0,0]=4 1088 B14R2.5816 CC(=O)C1=CSC2=CC=C(C=C12)F MCULE-3788315474 [0,1,0,0,1,0|2,0,0]=4 1089 B14R2.5816 CC(=O)C1=NNC2=CC=C(C=C12)Br MCULE-1326924101 [0,1,0,0,1,0|2,0,0]=4 1090 B14R2.5816 CC1=CC2=C(C=C1)NC=C2C(=O)O MCULE-1094716054 [0,1,0,0,1,0|1,0,0]=3 1091 B14R2.5816 CC1=CC2=C(C=C1)NN=C2C(=O)O MCULE-9819438059 [0,1,0,0,1,0|2,0,0]=4 1092 B14R2.5816 CC1=CC2=C(C=C1)OC=C2C(=O)O MCULE-5772948855 [0,1,0,0,1,0|2,0,0]=4 1093 B14R2.5816 CC1=CC=C2NC=C(C2=N1)C(=O)O MCULE-4830751098 [0,1,0,0,1,0|2,0,0]=4 1094 B14R2.5816 CC1=CC=C2SN=C(C2=C1)C(=O)N MCULE-8565024870 [0,1,0,0,1,0|2,0,0]=4 1095 B14R2.5816 CC1=CN=C2NC=C(C2=C1)C(=O)O MCULE-3851338887 [0,1,0,0,1,0|2,0,0]=4 1096 B14R2.5816 C[C@@H](N)C1=CNC2=C1C=C(C=C2)Br MCULE-1587262613 [0,1,0,0,1,0|1,0,1]=4 1097 B14R2.5816 C[C@@H](N)C1=CNC2=C1C=C(C=C2)Br MCULE-7422487830 [0,1,0,0,1,0|1,0,1]=4 1098 B14R2.5816 C[C@H](N)C1=CNC2=C1C=C(C=C2)Br MCULE-4668008036 [0,1,0,0,1,0|1,0,1]=4 1099 B14R2.5816 C[C@H](N)C1=CNC2=C1C=C(C=C2)Br MCULE-7056790422 [0,1,0,0,1,0|1,0,1]=4 1100 B14R2.5816 NC(=O)C1=CN=C2N1C=C(C=C2)Br MCULE-5395411054 [0,1,0,0,1,0|1,0,1]=4 1101 B14R2.5816 NC(=O)C1=CNC2=C1C=C(C=C2)N MCULE-3787369735 [0,1,0,0,1,0|0,0,0]=2 1102 B14R2.5816 NC(=O)C1=CNC2=C1C=C(C=C2)N MCULE-4311390394 [0,1,0,0,1,0|0,0,0]=2 1103 B14R2.5816 NC(=O)C1=CNC2=CC=C(C=C12)Br MCULE-4765564363 [0,1,0,0,1,0|0,0,0]=2 1104 B14R2.5816 NC(=O)C1=CNC2=NC=C(C=C12)Br MCULE-1970127629 [0,1,0,0,1,0|1,0,0]=3 1105 B14R2.5816 NC(=O)C1=NNC2=C1C=C(C=C2)Br MCULE-1447218506 [0,1,0,0,1,0|1,0,0]=3 1106 B14R2.5816 NC(=O)C1=NNC2=C1C=C(C=C2)Cl MCULE-3192019879 [0,1,0,0,1,0|1,0,0]=3 1107 B14R2.5816 NC(=O)C1=NNC2=C1C=C(C=C2)N MCULE-2178470635 [0,1,0,0,1,0|1,0,0]=3 1108 B14R2.5816 NC1=CC2=C(C=C1)NC=C2C(=O)O MCULE-4652622749 [0,1,0,0,1,0|1,0,0]=3 1109 B14R2.5816 NC1=CC2=C(C=C1)NN=C2C(=O)O MCULE-5005425774 [0,1,0,0,1,0|2,0,0]=4 1110 B14R2.5816 NC1=CC2=C(C=C1)NN=C2C(=O)O MCULE-6689333592 [0,1,0,0,1,0|2,0,0]=4 1111 B14R2.5816 NC1=CN=C2NC=C(C2=C1)C(=O)O MCULE-2994012259 [0,1,0,0,1,0|2,0,0]=4 1112 B14R2.5816 O=C(Cl)C1=CSC2=C1C=C(C=C2)Br MCULE-2827446543 [0,1,0,0,1,0|2,0,0]=4 1113 B14R2.5816 O=C(O)C1=CNC2=C1C=C(C=C2)Br MCULE-1291911930 [0,1,0,0,1,0|1,0,0]=3 1114 B14R2.5816 O=C(O)C1=CNC2=C1C=C(C=C2)Cl MCULE-8137039785 [0,1,0,0,1,0|1,0,0]=3 1115 B14R2.5816 O=C(O)C1=CNC2=C1C=C(C=C2)F MCULE-4247521443 [0,1,0,0,1,0|1,0,0]=3 1116 B14R2.5816 O=C(O)C1=CNC2=C1C=C(C=C2)I MCULE-8390686169 [0,1,0,0,1,0|1,0,0]=3 1117 B14R2.5816 O=C(O)C1=CNC2=C1C=C(C=C2)O MCULE-1215747065 [0,1,0,0,1,0|1,0,0]=3 1118 B14R2.5816 O=C(O)C1=CNC2=C1C=C(C=N2)Br MCULE-5287561812 [0,1,0,0,1,0|2,0,0]=4 1119 B14R2.5816 O=C(O)C1=CNC2=C1C=C(N=C2)Cl MCULE-6680669308 [0,1,0,0,1,0|2,0,0]=4 1120 B14R2.5816 O=C(O)C1=CNC2=CC=C(N=C12)Br MCULE-3873975294 [0,1,0,0,1,0|2,0,0]=4 1121 B14R2.5816 O=C(O)C1=CNC2=CC=C(N=C12)Cl MCULE-5318029139 [0,1,0,0,1,0|2,0,0]=4 1122 B14R2.5816 O=C(O)C1=CNC2=CC=C(N=C12)F MCULE-8429868437 [0,1,0,0,1,0|2,0,0]=4 1123 B14R2.5816 O=C(O)C1=CNC2=CC=C(N=C12)O MCULE-5794536764 [0,1,0,0,1,0|2,0,0]=4 1124 B14R2.5816 O=C(O)C1=CNC2=CN=C(C=C12)Br MCULE-8196309701 [0,1,0,0,1,0|2,0,0]=4 1125 B14R2.5816 O=C(O)C1=CNC2=NC=C(C=C12)Cl MCULE-3500950430 [0,1,0,0,1,0|2,0,0]=4 1126 B14R2.5816 O=C(O)C1=CNC2=NC=C(C=C12)F MCULE-9749557675 [0,1,0,0,1,0|2,0,0]=4 1127 B14R2.5816 O=C(O)C1=CNC2=NC=C(C=C12)O MCULE-1776162120 [0,1,0,0,1,0|2,0,0]=4 1128 B14R2.5816 O=C(O)C1=COC2=C1C=C(C=C2)Cl MCULE-6608344358 [0,1,0,0,1,0|2,0,0]=4 1129 B14R2.5816 O=C(O)C1=COC2=C1C=C(C=C2)F MCULE-1460229625 [0,1,0,0,1,0|2,0,0]=4 1130 B14R2.5816 O=C(O)C1=COC2=CC=C(C=C12)Br MCULE-8637410462 [0,1,0,0,1,0|2,0,0]=4 1131 B14R2.5816 O=C(O)C1=COC2=CC=C(C=C12)O MCULE-5030534401 [0,1,0,0,1,0|2,0,0]=4 1132 B14R2.5816 O=C(O)C1=CSC2=C1C=C(C=C2)Cl MCULE-5256813065 [0,1,0,0,1,0|2,0,0]=4 1133 B14R2.5816 O=C(O)C1=CSC2=CC=C(C=C12)Br MCULE-9983271898 [0,1,0,0,1,0|2,0,0]=4 1134 B14R2.5816 O=C(O)C1=CSC2=CC=C(C=C12)F MCULE-4612436697 [0,1,0,0,1,0|2,0,0]=4 1135 B14R2.5816 O=C(O)C1=CSC2=CC=C(C=C12)O MCULE-7921544443 [0,1,0,0,1,0|2,0,0]=4 1136 B14R2.5816 O=C(O)C1=NNC2=C1C=C(C=C2)Cl MCULE-7413972507 [0,1,0,0,1,0|2,0,0]=4 1137 B14R2.5816 O=C(O)C1=NNC2=C1C=C(C=C2)F MCULE-1490373274 [0,1,0,0,1,0|2,0,0]=4 1138 B14R2.5816 O=C(O)C1=NNC2=C1C=C(C=C2)O MCULE-9941388627 [0,1,0,0,1,0|2,0,0]=4 1139 B14R2.5816 O=C(O)C1=NNC2=CC=C(C=C12)Br MCULE-1832670371 [0,1,0,0,1,0|2,0,0]=4 1140 B14R2.5816 O=C(O)C1=NNC2=CC=C(C=C12)Cl MCULE-3161364448 [0,1,0,0,1,0|2,0,0]=4 1141 B14R2.5816 O=N(=O)C1=CNC2=C1C=C(C=C2)Br MCULE-5239482397 [0,1,0,0,1,0|2,0,0]=4 1142 B14R2.5816 O=N(=O)C1=CNC2=C1C=C(C=C2)Cl MCULE-6005644616 [0,1,0,0,1,0|2,0,0]=4 1143 B14R2.5816 O=N(=O)C1=CNC2=CC=C(C=C12)F MCULE-1593789613 [0,1,0,0,1,0|2,0,0]=4 1144 B14R2.8032 CC(=O)C1=CNC2=C(C=CC=C12)Cl MCULE-8066584299 [0,1,0,0,1,0|1,0,0]=3 1145 B14R2.8032 CC(=O)C1=CNC2=C(C=CC=C12)F MCULE-5420433045 [0,1,0,0,1,0|1,0,0]=3 1146 B14R2.8032 CC(=O)C1=CNC2=C(C=CN=C12)Br MCULE-4940954673 [0,1,0,0,1,0|2,0,0]=4 1147 B14R2.8032 CC(=O)C1=CNC2=C(C=CN=C12)C MCULE-4175408193 [0,1,0,0,1,0|2,0,0]=4 1148 B14R2.8032 CC(=O)C1=CNC2=C(C=CN=C12)Cl MCULE-8261463619 [0,1,0,0,1,0|2,0,0]=4 1149 B14R2.8032 CC(=O)C1=CNC2=C(C=CN=C12)O MCULE-4551652440 [0,1,0,0,1,0|2,0,0]=4 1150 B14R2.8032 CC(=O)C1=CNC2=C(N=CC=C12)C MCULE-1664208684 [0,1,0,0,1,0|2,0,0]=4 1151 B14R2.8032 CC(=O)C1=CNC2=C(N=CC=C12)Cl MCULE-1284451067 [0,1,0,0,1,0|2,0,0]=4 1152 B14R2.8032 CC(=O)C1=CNC2=C(N=CC=C12)F MCULE-1576473696 [0,1,0,0,1,0|2,0,0]=4 1153 B14R2.8032 CC(=O)C1=CNC2=C1C=CC=C2Br MCULE-7821981642 [0,1,0,0,1,0|1,0,0]=3 1154 B14R2.8032 CC(=O)C1=CNC2=C1C=NC=C2Br MCULE-3881743845 [0,1,0,0,1,0|2,0,0]=4 1155 B14R2.8032 CC(=O)C1=CNC2=C1C=NC=C2C MCULE-9264453132 [0,1,0,0,1,0|2,0,0]=4 1156 B14R2.8032 CC(=O)C1=CNC2=C1C=NC=C2F MCULE-4106827819 [0,1,0,0,1,0|2,0,0]=4 1157 B14R2.8032 CC(=O)C1=COC2=C1C=CC=C2C MCULE-7156884515 [0,1,0,0,1,0|2,0,0]=4 1158 B14R2.8032 CC(=O)C1=CSC2=C(C=CC=C12)F MCULE-4035390215 [0,1,0,0,1,0|2,0,0]=4 1159 B14R2.8032 CC1=C2NC=C(C2=CC=N1)C(=O)O MCULE-5824196203 [0,1,0,0,1,0|2,0,0]=4 1160 B14R2.8032 CC1=C2NC=C(C2=NC=C1)C(=O)O MCULE-2369619158 [0,1,0,0,1,0|2,0,0]=4 1161 B14R2.8032 CC1=C2NN=C(C2=CC=C1)C(=O)N MCULE-1297437138 [0,1,0,0,1,0|1,0,0]=3 1162 B14R2.8032 CC1=C2NN=C(C2=CC=C1)C(=O)O MCULE-5961216486 [0,1,0,0,1,0|2,0,0]=4 1163 B14R2.8032 CC1=C2OC=C(C2=CC=C1)C(=O)O MCULE-8441930736 [0,1,0,0,1,0|2,0,0]=4 1164 B14R2.8032 CC1=CC=CC2=C1NC=C2C(=O)O MCULE-4467976608 [0,1,0,0,1,0|1,0,0]=3 1165 B14R2.8032 CC1=CN=CC2=C1NC=C2C(=O)O MCULE-6199187705 [0,1,0,0,1,0|2,0,0]=4 1166 B14R2.8032 NC1=C2NC=C(C2=CC=N1)C(=O)O MCULE-7375440481 [0,1,0,0,1,0|2,0,0]=4 1167 B14R2.8032 NC1=C2NC=C(C2=NC=C1)C(=O)O MCULE-5461754716 [0,1,0,0,1,0|2,0,0]=4 1168 B14R2.8032 O=C(O)C1=CNC2=C(C=CN=C12)Br MCULE-2723113893 [0,1,0,0,1,0|2,0,0]=4 1169 B14R2.8032 O=C(O)C1=CNC2=C(C=CN=C12)Cl MCULE-4530791622 [0,1,0,0,1,0|2,0,0]=4 1170 B14R2.8032 O=C(O)C1=CNC2=C(C=CN=C12)O MCULE-3088212763 [0,1,0,0,1,0|2,0,0]=4 1171 B14R2.8032 O=C(O)C1=CNC2=C(N=CC=C12)Br MCULE-1507115310 [0,1,0,0,1,0|2,0,0]=4 1172 B14R2.8032 O=C(O)C1=CNC2=C(N=CC=C12)F MCULE-8914850968 [0,1,0,0,1,0|2,0,0]=4 1173 B14R2.8032 O=C(O)C1=CNC2=C(N=CC=C12)O MCULE-5409290903 [0,1,0,0,1,0|2,0,0]=4 1174 B14R2.8032 O=C(O)C1=CNC2=C1C=CC=C2Br MCULE-6430212170 [0,1,0,0,1,0|1,0,0]=3 1175 B14R2.8032 O=C(O)C1=CNC2=C1C=CC=C2Cl MCULE-1873289033 [0,1,0,0,1,0|1,0,0]=3 1176 B14R2.8032 O=C(O)C1=CNC2=C1C=CC=C2F MCULE-9199697501 [0,1,0,0,1,0|1,0,0]=3 1177 B14R2.8032 O=C(O)C1=CNC2=C1C=CC=C2O MCULE-9287204172 [0,1,0,0,1,0|1,0,0]=3 1178 B14R2.8032 O=C(O)C1=CNC2=C1C=CN=C2Cl MCULE-4463406500 [0,1,0,0,1,0|2,0,0]=4 1179 B14R2.8032 O=C(O)C1=CNC2=C1C=NC=C2F MCULE-2823474538 [0,1,0,0,1,0|2,0,0]=4 1180 B14R2.8032 O=C(O)C1=COC2=C1C=CC=C2Br MCULE-3519085911 [0,1,0,0,1,0|2,0,0]=4 1181 B14R2.8032 O=C(O)C1=COC2=C1C=CC=C2F MCULE-3931132626 [0,1,0,0,1,0|2,0,0]=4 1182 B14R2.8032 O=C(O)C1=CSC2=C1C=CC=C2Br MCULE-6089959946 [0,1,0,0,1,0|2,0,0]=4 1183 B14R2.8032 O=C(O)C1=CSC2=C1C=CC=C2F MCULE-6259093087 [0,1,0,0,1,0|2,0,0]=4 1184 B14R2.8032 O=C(O)C1=NNC2=C(C=CC=C12)Br MCULE-3222795398 [0,1,0,0,1,0|2,0,0]=4 1185 B14R2.8032 O=C(O)C1=NNC2=C1C=CC=C2Cl MCULE-2419651295 [0,1,0,0,1,0|2,0,0]=4 1186 B14R2.8032 O=C(O)C1=NNC2=C1C=CC=C2F MCULE-5840950289 [0,1,0,0,1,0|2,0,0]=4 1187 B14R2.8032 O=C(O)C1=NNC2=C1C=CC=C2O MCULE-3880639889 [0,1,0,0,1,0|2,0,0]=4 1188 B14R2.8032 O=N(=O)C1=CNC2=C1C=CC=C2Cl MCULE-9743058090 [0,1,0,0,1,0|2,0,0]=4 1189 B14R2.8053 CC(=O)C1=CNC2=C1C(=CC=C2)Br MCULE-4705031717 [0,1,0,0,1,0|1,0,0]=3 1190 B14R2.8053 CC(=O)C1=CNC2=C1C(=CC=C2)Cl MCULE-4416890286 [0,1,0,0,1,0|1,0,0]=3 1191 B14R2.8053 CC(=O)C1=CNC2=C1C(=CC=C2)I MCULE-5244717297 [0,1,0,0,1,0|1,0,0]=3 1192 B14R2.8053 CC(=O)C1=CNC2=C1C(=CC=N2)Br MCULE-9904434097 [0,1,0,0,1,0|2,0,0]=4 1193 B14R2.8053 CC(=O)C1=CNC2=C1C(=CC=N2)C MCULE-1732838630 [0,1,0,0,1,0|2,0,0]=4 1194 B14R2.8053 CC(=O)C1=CNC2=C1C(=CC=N2)Cl MCULE-6412571505 [0,1,0,0,1,0|2,0,0]=4 1195 B14R2.8053 CC(=O)C1=CNC2=C1C(=CC=N2)F MCULE-6579859373 [0,1,0,0,1,0|2,0,0]=4 1196 B14R2.8053 CC(=O)C1=CNC2=C1C(=CC=N2)I MCULE-6419770175 [0,1,0,0,1,0|2,0,0]=4 1197 B14R2.8053 CC(=O)C1=CNC2=C1C(=CC=N2)N MCULE-4868549710 [0,1,0,0,1,0|2,0,0]=4 1198 B14R2.8053 CC(=O)C1=CNC2=C1C(=CC=N2)O MCULE-8481097333 [0,1,0,0,1,0|2,0,0]=4 1199 B14R2.8053 CC(=O)C1=CNC2=C1C(=NC=C2)Br MCULE-5640639053 [0,1,0,0,1,0|2,0,0]=4 1200 B14R2.8053 CC(=O)C1=CNC2=C1C(=NC=C2)C MCULE-4075782958 [0,1,0,0,1,0|2,0,0]=4 1201 B14R2.8053 CC(=O)C1=CNC2=C1C(=NC=C2)Cl MCULE-6056322137 [0,1,0,0,1,0|2,0,0]=4 1202 B14R2.8053 CC(=O)C1=CNC2=CC=CC(=C12)N MCULE-6460814133 [0,1,0,0,1,0|1,0,0]=3 1203 B14R2.8053 CC(=O)C1=CNC2=CC=CC(=C12)N MCULE-7588581034 [0,1,0,0,1,0|1,0,0]=3 1204 B14R2.8053 CC(=O)C1=CNC2=CC=NC(=C12)F MCULE-6213695037 [0,1,0,0,1,0|2,0,0]=4 1205 B14R2.8053 CC(=O)C1=CNC2=CN=CC(=C12)Br MCULE-3477645298 [0,1,0,0,1,0|2,0,0]=4 1206 B14R2.8053 CC(=O)C1=CNC2=CN=CC(=C12)C MCULE-5115969483 [0,1,0,0,1,0|2,0,0]=4 1207 B14R2.8053 CC(=O)C1=CNC2=CN=CC(=C12)Cl MCULE-3816910781 [0,1,0,0,1,0|2,0,0]=4 1208 B14R2.8053 CC1=C2C(=CC=C1)NC=C2C(=O)O MCULE-4433639968 [0,1,0,0,1,0|1,0,0]=3 1209 B14R2.8053 CC1=C2C(=CN=C1)NC=C2C(=O)O MCULE-5910033979 [0,1,0,0,1,0|2,0,0]=4 1210 B14R2.8053 CC1=C2C(=CNC2=NC=C1)C(=O)O MCULE-7293197053 [0,1,0,0,1,0|2,0,0]=4 1211 B14R2.8053 CC1=CC=CC2=C1C(=NN2)C(=O)O MCULE-9843903681 [0,1,0,0,1,0|2,0,0]=4 1212 B14R2.8053 CC1=NC=CC2=C1C(=CN2)C(=O)O MCULE-6761750728 [0,1,0,0,1,0|2,0,0]=4 1213 B14R2.8053 NC(=O)C1=CNC2=C1C(=NC=N2)Cl MCULE-4051303944 [0,1,0,0,1,0|2,0,0]=4 1214 B14R2.8053 NC(=O)C1=NNC2=C1C(=CC=C2)Cl MCULE-5739720035 [0,1,0,0,1,0|1,0,0]=3 1215 B14R2.8053 NC1=C2C(=CN=C1)NC=C2C(=O)O MCULE-6899865755 [0,1,0,0,1,0|2,0,0]=4 1216 B14R2.8053 NC1=CC=CC2=C1C(=CN2)C(=O)O MCULE-9251595450 [0,1,0,0,1,0|1,0,0]=3 1217 B14R2.8053 NC1=CC=CC2=C1C(=NN2)C(=O)O MCULE-1882897164 [0,1,0,0,1,0|2,0,0]=4 1218 B14R2.8053 O=C(O)C1=C2C(=O)C=CC=C2NN1 MCULE-9489688447 [0,1,0,0,1,0|2,0,0]=4 1219 B14R2.8053 O=C(O)C1=CNC2=C1C(=CC=C2)Br MCULE-3014327766 [0,1,0,0,1,0|1,0,0]=3 1220 B14R2.8053 O=C(O)C1=CNC2=C1C(=CC=C2)Cl MCULE-5443336531 [0,1,0,0,1,0|1,0,0]=3 1221 B14R2.8053 O=C(O)C1=CNC2=C1C(=CC=C2)F MCULE-7675935317 [0,1,0,0,1,0|1,0,0]=3 1222 B14R2.8053 O=C(O)C1=CNC2=C1C(=CC=C2)I MCULE-5829691403 [0,1,0,0,1,0|1,0,0]=3 1223 B14R2.8053 O=C(O)C1=CNC2=C1C(=CC=N2)Br MCULE-7111501967 [0,1,0,0,1,0|2,0,0]=4 1224 B14R2.8053 O=C(O)C1=CNC2=C1C(=CC=N2)Cl MCULE-5357531907 [0,1,0,0,1,0|2,0,0]=4 1225 B14R2.8053 O=C(O)C1=CNC2=C1C(=NC=C2)Br MCULE-7076896961 [0,1,0,0,1,0|2,0,0]=4 1226 B14R2.8053 O=C(O)C1=CNC2=C1C(=NC=C2)Cl MCULE-3787469730 [0,1,0,0,1,0|2,0,0]=4 1227 B14R2.8053 O=C(O)C1=CNC2=C1C(=NC=C2)O MCULE-1962703221 [0,1,0,0,1,0|2,0,0]=4 1228 B14R2.8053 O=C(O)C1=CNC2=C1C(=O)C=CN2 MCULE-7160816332 [0,1,0,0,1,0|2,0,0]=4 1229 B14R2.8053 O=C(O)C1=CNC2=CC=NC(=C12)F MCULE-6680500493 [0,1,0,0,1,0|2,0,0]=4 1230 B14R2.8053 O=C(O)C1=CNC2=CN=CC(=C12)Br MCULE-3137615468 [0,1,0,0,1,0|2,0,0]=4 1231 B14R2.8053 O=C(O)C1=CNC2=CN=CC(=C12)F MCULE-5742822039 [0,1,0,0,1,0|2,0,0]=4 1232 B14R2.8053 O=C(O)C1=CNC2=NC=CC(=C12)F MCULE-8797644097 [0,1,0,0,1,0|2,0,0]=4 1233 B14R2.8053 O=C(O)C1=CNC2=NC=CC(=C12)I MCULE-1775081571 [0,1,0,0,1,0|2,0,0]=4 1234 B14R2.8053 O=C(O)C1=COC2=C1C(=CC=C2)Br MCULE-3146660543 [0,1,0,0,1,0|2,0,0]=4 1235 B14R2.8053 O=C(O)C1=COC2=C1C(=CC=C2)F MCULE-2516097940 [0,1,0,0,1,0|2,0,0]=4 1236 B14R2.8053 O=C(O)C1=COC2=CC=CC(=C12)O MCULE-3249126857 [0,1,0,0,1,0|2,0,0]=4 1237 B14R2.8053 O=C(O)C1=CSC2=C1C(=CC=C2)Br MCULE-1998413590 [0,1,0,0,1,0|2,0,0]=4 1238 B14R2.8053 O=C(O)C1=NNC2=C1C(=CC=C2)Br MCULE-1776988102 [0,1,0,0,1,0|2,0,0]=4 1239 B14R2.8053 O=C(O)C1=NNC2=C1C(=CC=C2)Cl MCULE-7606105899 [0,1,0,0,1,0|2,0,0]=4 1240 B14R2.8053 O=C(O)C1=NNC2=C1C(=CC=C2)F MCULE-2546453616 [0,1,0,0,1,0|2,0,0]=4 1241 B14R2.8053 O=C(O)C1=NNC2=CC=CC(=C12)I MCULE-4781102626 [0,1,0,0,1,0|2,0,0]=4 1242 B14R2.8053 O=N(=O)C1=CNC2=C1C(=CC=C2)Cl MCULE-7459943735 [0,1,0,0,1,0|2,0,0]=4 1243 B14R2.25733 CC(=O)C1=CN(C2=C1C=CC=C2)C MCULE-8804639652 [0,1,0,0,1,0|1,0,0]=3 1244 B14R2.25733 CC(=O)C1=CN(C2=C1C=CC=N2)C MCULE-1145416847 [0,1,0,0,1,0|2,0,0]=4 1245 B14R2.25733 CC(=O)C1=CN(C2=C1C=CN=C2)C MCULE-8114811684 [0,1,0,0,1,0|2,0,0]=4 1246 B14R2.25733 CC(=O)C1=CN(C2=C1C=NC=C2)C MCULE-6384649225 [0,1,0,0,1,0|2,0,0]=4 1247 B14R2.25733 CC(=O)C1=CN(C2=CC=CN=C12)C MCULE-6745660431 [0,1,0,0,1,0|2,0,0]=4 1248 B14R2.25733 CC(=O)C1=NN(C2=C1C=CC=C2)C MCULE-5446569752 [0,1,0,0,1,0|2,0,0]=4 1249 B14R2.25733 CC(N)C1=CN(C2=CC=CC=C12)C MCULE-2192565720 [0,1,0,0,1,0|1,0,1]=4 1250 B14R2.25733 CC(N)C1=CN(C2=CC=CC=C12)C MCULE-5055108820 [0,1,0,0,1,0|1,0,1]=4 1251 B14R2.25733 CN1C=C(C2=C1C=CC=C2)C(=N)N MCULE-5313214762 [0,1,0,0,1,0|1,0,0]=3 1252 B14R2.25733 CN1C=C(C2=C1C=CC=C2)C(=O)Cl MCULE-6870058049 [0,1,0,0,1,0|1,0,0]=3 1253 B14R2.25733 CN1C=C(C2=C1C=CC=C2)C(=O)N MCULE-8790085472 [0,1,0,0,1,0|0,0,0]=2 1254 B14R2.25733 CN1C=C(C2=C1C=CC=C2)C(=O)O MCULE-1385678671 [0,1,0,0,1,0|1,0,0]=3 1255 B14R2.25733 CN1C=C(C2=C1C=CC=C2)N(=O)=O MCULE-5098795048 [0,1,0,0,1,0|2,0,0]=4 1256 B14R2.25733 CN1C=C(C2=C1C=CC=N2)C(=O)O MCULE-2865696860 [0,1,0,0,1,0|2,0,0]=4 1257 B14R2.25733 CN1C=C(C2=C1C=CN=C2)C(=O)O MCULE-4455332608 [0,1,0,0,1,0|2,0,0]=4 1258 B14R2.25733 CN1C=C(C2=C1C=NC=C2)C(=O)O MCULE-5251969326 [0,1,0,0,1,0|2,0,0]=4 1259 B14R2.25733 CN1C=C(C2=CC=CN=C12)C(=O)O MCULE-8321222877 [0,1,0,0,1,0|2,0,0]=4 1260 B14R2.25733 CN1N=C(C2=C1C=CC=C2)C(=O)Cl MCULE-9424257055 [0,1,0,0,1,0|2,0,0]=4 1261 B14R2.25733 CN1N=C(C2=C1C=CC=C2)C(=O)N MCULE-3593068702 [0,1,0,0,1,0|1,0,0]=3 1262 B14R2.25733 CN1N=C(C2=CC=CC=C12)C(=O)O MCULE-5318366728 [0,1,0,0,1,0|2,0,0]=4 1263 B14R2.25733 C[C@@H](N)C1=CN(C2=C1C=CC=C2)C MCULE-5415480014 [0,1,0,0,1,0|1,0,1]=4 1264 B14R2.25733 C[C@@H](N)C1=CN(C2=C1C=CC=C2)C MCULE-8610068388 [0,1,0,0,1,0|1,0,1]=4 1265 B14R2.25733 C[C@H](N)C1=CN(C2=C1C=CC=C2)C MCULE-2949678328 [0,1,0,0,1,0|1,0,1]=4 1266 B14R2.25733 C[C@H](N)C1=CN(C2=C1C=CC=C2)C MCULE-8789790136 [0,1,0,0,1,0|1,0,1]=4 1267 B16R2.12 C(N)(CC1=CNC2=C1C=CC=C2)C(=O)O MCULE-7691364516 [0,1,0,0,0,1|1,0,0]=3 1268 B16R2.12 C(N)(CC1=CSC2=C1C=CC=C2)C(=O)O MCULE-9390030100 [0,1,0,0,0,1|2,0,0]=4 1269 B16R2.12 CC(=CC1=CNC2=C1C=CC=C2)C(=O)O MCULE-9019172119 [0,1,0,0,0,1|1,0,1]=4 1270 B16R2.12 CC(CC1=CNC2=CC=CC=C12)C(=O)O MCULE-2892960681 [0,1,0,0,0,1|1,0,0]=3 1271 B16R2.12 CC(SC1=CNC2=C1C=CC=C2)C(=O)O MCULE-1545356214 [0,1,0,0,0,1|1,0,0]=3 1272 B16R2.12 C[C@H](NC1=CSC2=C1C=CC=C2)C(=O)O MCULE-3072834173 [0,1,0,0,0,1|2,0,0]=4 1273 B16R2.12 C[C@H](NC1=CSC2=CC=CC=C12)C(=O)O MCULE-4939358545 [0,1,0,0,0,1|2,0,0]=4 1274 B16R2.12 NC(=O)C(N)CC1=CNC2=C1C=CC=C2 MCULE-3066097949 [0,1,0,0,0,1|0,0,0]=2 1275 B16R2.12 NC(=O)C(N)CC1=CNC2=C1C=CC=C2 MCULE-8443491955 [0,1,0,0,0,1|0,0,0]=2 1276 B16R2.12 NC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-1545475984 [0,1,0,0,0,1|0,0,0]=2 1277 B16R2.12 NC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-2495284243 [0,1,0,0,0,1|0,0,0]=2 1278 B16R2.12 NC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-6670583047 [0,1,0,0,0,1|0,0,0]=2 1279 B16R2.12 NC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-7340384638 [0,1,0,0,0,1|0,0,0]=2 1280 B16R2.12 NC(=O)[C@H](O)CC1=CNC2=C1C=CC=C2 MCULE-6002866157 [0,1,0,0,0,1|0,0,0]=2 1281 B16R2.12 NC(CC1=CNC2=C1C=CC=C2)C(=O)O MCULE-5675773208 [0,1,0,0,0,1|1,0,0]=3 1282 B16R2.12 NC(CC1=CNC2=C1C=CN=C2)C(=O)O MCULE-7914194741 [0,1,0,0,0,1|2,0,0]=4 1283 B16R2.12 NC(CC1=CNC2=C1N=CC=C2)C(=O)O MCULE-2168870848 [0,1,0,0,0,1|2,0,0]=4 1284 B16R2.12 NC(CC1=CNC2=C1N=CC=C2)C(=O)O MCULE-3705960079 [0,1,0,0,0,1|2,0,0]=4 1285 B16R2.12 NC(CC1=CNC2=NC=CC=C12)C(=O)O MCULE-5682942023 [0,1,0,0,0,1|2,0,0]=4 1286 B16R2.12 NC(CC1=CNC2=NC=CC=C12)C(=O)O MCULE-5769182405 [0,1,0,0,0,1|2,0,0]=4 1287 B16R2.12 NC(CC1=COC2=C1C=CC=C2)C(=O)O MCULE-6783788936 [0,1,0,0,0,1|2,0,0]=4 1288 B16R2.12 NC(CC1=CSC2=C1C=CC=C2)C(=O)O MCULE-1466278778 [0,1,0,0,0,1|2,0,0]=4 1289 B16R2.12 N[C@@H](CC1=CNC2=C1C=CC=C2)C(=O)O MCULE-3721322622 [0,1,0,0,0,1|1,0,0]=3 1290 B16R2.12 N[C@@H](CC1=CNC2=C1C=CC=C2)C(=O)O MCULE-8004234494 [0,1,0,0,0,1|1,0,0]=3 1291 B16R2.12 N[C@@H](CC1=CNC2=C1C=CN=C2)C(=O)O MCULE-3547598485 [0,1,0,0,0,1|2,0,0]=4 1292 B16R2.12 N[C@@H](CC1=CNC2=C1C=CN=C2)C(=O)O MCULE-7707361491 [0,1,0,0,0,1|2,0,0]=4 1293 B16R2.12 N[C@@H](CC1=CNC2=C1C=NC=C2)C(=O)O MCULE-7462566193 [0,1,0,0,0,1|2,0,0]=4 1294 B16R2.12 N[C@@H](CC1=CNC2=C1N=CC=C2)C(=O)O MCULE-5719127161 [0,1,0,0,0,1|2,0,0]=4 1295 B16R2.12 N[C@@H](CC1=CNC2=CC=CN=C12)C(=O)O MCULE-2993588407 [0,1,0,0,0,1|2,0,0]=4 1296 B16R2.12 N[C@@H](CC1=CNC2=NC=CC=C12)C(=O)O MCULE-2848201757 [0,1,0,0,0,1|2,0,0]=4 1297 B16R2.12 N[C@@H](CC1=CNC2=NC=CC=C12)C(=O)O MCULE-5628776627 [0,1,0,0,0,1|2,0,0]=4 1298 B16R2.12 N[C@@H](CC1=COC2=C1C=CC=C2)C(=O)O MCULE-4386551750 [0,1,0,0,0,1|2,0,0]=4 1299 B16R2.12 N[C@@H](CC1=CSC2=C1C=CC=C2)C(=O)O MCULE-9652327577 [0,1,0,0,0,1|2,0,0]=4 1300 B16R2.12 N[C@@H](CC1=CSC2=CC=CC=C12)C(=O)O MCULE-6468579383 [0,1,0,0,0,1|2,0,0]=4 1301 B16R2.12 N[C@H](CC1=CNC2=C1C=CC=C2)C(=O)O MCULE-4102614655 [0,1,0,0,0,1|1,0,0]=3 1302 B16R2.12 N[C@H](CC1=CNC2=C1C=CN=C2)C(=O)O MCULE-8686553455 [0,1,0,0,0,1|2,0,0]=4 1303 B16R2.12 N[C@H](CC1=CNC2=CC=CC=C12)C(=O)O MCULE-3038020375 [0,1,0,0,0,1|1,0,0]=3 1304 B16R2.12 N[C@H](CC1=CNC2=CC=CC=C12)C(=O)O MCULE-9808999085 [0,1,0,0,0,1|1,0,0]=3 1305 B16R2.12 N[C@H](CC1=CNC2=NC=CC=C12)C(=O)O MCULE-1273995147 [0,1,0,0,0,1|2,0,0]=4 1306 B16R2.12 N[C@H](CC1=CNC2=NC=CC=C12)C(=O)O MCULE-6851752263 [0,1,0,0,0,1|2,0,0]=4 1307 B16R2.12 N[C@H](CC1=COC2=C1C=CC=C2)C(=O)O MCULE-6842813111 [0,1,0,0,0,1|2,0,0]=4 1308 B16R2.12 N[C@H](CC1=CSC2=C1C=CC=C2)C(=O)O MCULE-3310371569 [0,1,0,0,0,1|2,0,0]=4 1309 B16R2.12 N[C@H](CC1=CSC2=CC=CC=C12)C(=O)O MCULE-3595523397 [0,1,0,0,0,1|2,0,0]=4 1310 B16R2.12 O=C(O)C(=CC1=CNC2=CC=CC=C12)S MCULE-5398915682 [0,1,0,0,0,1|1,0,1]=4 1311 B16R2.12 O=C(O)C(=O)CC1=CNC2=C1C=CC=C2 MCULE-1073478615 [0,1,0,0,0,1|1,0,0]=3 1312 B16R2.12 O=C(O)C(O)CC1=CNC2=C1C=CC=C2 MCULE-9202778593 [0,1,0,0,0,1|1,0,0]=3 1313 B16R2.12 O=C(O)[C@@H](O)CC1=CNC2=C1C=CC=C2 MCULE-9292718284 [0,1,0,0,0,1|1,0,0]=3 1314 B16R2.14 CC(=NO)CCC1=CNC2=C1C=CC=C2 MCULE-4117218273 [0,1,0,0,0,1|1,0,1]=4 1315 B16R2.14 CC(=NO)CSC1=CNC2=C1C=CC=C2 MCULE-3134182243 [0,1,0,0,0,1|1,0,1]=4 1316 B16R2.14 CCC(=O)NCC1=CNC2=CC=CC=C12 MCULE-4306442128 [0,1,0,0,0,1|1,0,0]=3 1317 B16R2.14 COC(=O)C=CC1=CNC2=C1C=CC=C2 MCULE-5021665673 [0,1,0,0,0,1|1,0,1]=4 1318 B16R2.14 COC(=O)CCC1=CNC2=C1C=CC=C2 MCULE-6058936857 [0,1,0,0,0,1|1,0,0]=3 1319 B16R2.14 CSC(=S)NCC1=CNC2=C1C=CC=C2 MCULE-5878389514 [0,1,0,0,0,1|1,1,0]=4 1320 B16R2.14 NNC(=O)CCC1=CNC2=C1C=CC=C2 MCULE-2439340262 [0,1,0,0,0,1|0,0,0]=2 1321 B16R2.14 NNC(=O)CCN1C=NC2=C1C=CC=C2 MCULE-6676301102 [0,1,0,0,0,1|1,0,1]=4 1322 B16R2.520 C=C(C)C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-3165794084 [0,1,0,0,0,1|2,0,0]=4 1323 B16R2.520 C=C(C)C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-4423247369 [0,1,0,0,0,1|2,0,0]=4 1324 B16R2.520 C=C(C)C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-1451859789 [0,1,0,0,0,1|2,0,0]=4 1325 B16R2.520 C=C(C)C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-1911385013 [0,1,0,0,0,1|2,0,0]=4 1326 B16R2.520 CC(=O)CC(=O)C1=CNC2=C1C=CC=C2 MCULE-7778035018 [0,1,0,0,0,1|1,0,0]=3 1327 B16R2.520 CC(CC(=O)O)C1=CNC2=C1C=CC=C2 MCULE-1656451925 [0,1,0,0,0,1|1,0,0]=3 1328 B16R2.520 NC(CC(=O)O)C1=CNC2=C1C=CC=C2 MCULE-2298347249 [0,1,0,0,0,1|1,0,0]=3 1329 B16R2.520 N[C@@H](CC(=O)O)C1=CNC2=C1C=CC=C2 MCULE-4436493722 [0,1,0,0,0,1|1,0,0]=3 1330 B16R2.2947 CN(=O)(C)CCC1=CNC2=C1C=CC=C2 MCULE-1626095060 [0,1,0,0,0,1|2,0,0]=4 1331 B16R2.2947 NS(=O)(=O)NCC1=CSC2=C1C=CC=C2 MCULE-5079585238 [0,1,0,0,0,1|2,0,0]=4 1332 B16R2.2976 CC1=CC2=C(C=C1)C(=CN2)/C=C/C(=O)O MCULE-7011339368 [0,1,0,0,0,1|1,0,1]=4 1333 B16R2.2976 CC1=CC2=C(C=C1)C(=CN2)CCC(=O)O MCULE-1094026609 [0,1,0,0,0,1|1,0,0]=3 1334 B16R2.2976 CC1=CC=C2C(=CNC2=C1)C=CC(=O)O MCULE-7367748076 [0,1,0,0,0,1|1,0,1]=4 1335 B16R2.2976 O=C(O)/C=C/C1=CNC2=C1C=CC(=C2)F MCULE-8415677505 [0,1,0,0,0,1|1,0,1]=4 1336 B16R2.2976 O=C(O)CCC1=CNC2=CC(=CC=C12)Br MCULE-7968399311 [0,1,0,0,0,1|1,0,0]=3 1337 B16R2.2976 O=C(O)CCC1=CNC2=CC(=CC=C12)Cl MCULE-1091258850 [0,1,0,0,0,1|1,0,0]=3 1338 B16R2.2976 O=C(O)CCC1=CNC2=CC(=CC=C12)F MCULE-5084506987 [0,1,0,0,0,1|1,0,0]=3 1339 B16R2.4003 CC(=O)N/N=C/1\C(=O)NC2=C1C=CC=C2 MCULE-5002842208 [0,1,0,0,0,1|2,0,0]=4 1340 B16R2.4003 CC1=C(C2=C(N1)C=CC=C2)/C=C/C(=O)O MCULE-8640887132 [0,1,0,0,0,1|1,0,1]=4 1341 B16R2.4003 CC1=C(C2=C(N1)C=CC=C2)CCC(=O)N MCULE-2768308411 [0,1,0,0,0,1|0,0,0]=2 1342 B16R2.4003 CC1=C(C2=C(N1)C=CC=C2)SCC(=O)O MCULE-9641494982 [0,1,0,0,0,1|1,0,0]=3 1343 B16R2.4003 CC1=C(C2=C(O1)C=CC=C2)CNC(=O)N MCULE-1200522848 [0,1,0,0,0,1|1,0,0]=3 1344 B16R2.4003 CC1=C(C2=CC=CC=C2N1)CCC(=O)O MCULE-2157412879 [0,1,0,0,0,1|1,0,0]=3 1345 B16R2.4003 CC1=C(C2=CC=CN=C2N1)CCC(=O)O MCULE-2514335887 [0,1,0,0,0,1|2,0,0]=4 1346 B16R2.4003 CC1=NC2=CC=CC=C2N1CCC(=O)N MCULE-4674227563 [0,1,0,0,0,1|1,0,1]=4 1347 B16R2.4003 NC(=N/N=C/1\C(=O)NC2=CC=CC=C12)N MCULE-8030293047 [0,1,0,0,0,1|2,0,0]=4 1348 B16R2.4003 NC(=N/N=C/1\C(=O)NC2=CC=CC=C12)N MCULE-8477884975 [0,1,0,0,0,1|2,0,0]=4 1349 B16R2.4003 NC(=O)CCN1C(=O)OC2=C1C=CC=C2 MCULE-8942404337 [0,1,0,0,0,1|2,0,0]=4 1350 B16R2.4003 NC(=O)N/N=C/1\C(=O)NC2=CC=CC=C12 MCULE-5648757054 [0,1,0,0,0,1|1,0,0]=3 1351 B16R2.4003 NC(=S)N/N=C/1\C(=O)NC2=C1C=CC=C2 MCULE-6620092921 [0,1,0,0,0,1|1,1,0]=4 1352 B16R2.4003 O=C(O)CCC1C(=O)NC2=C1C=CC=C2 MCULE-5570047144 [0,1,0,0,0,1|1,0,1]=4 1353 B16R2.4003 O=C(O)CCN1C(=O)NC2=C1C=CC=C2 MCULE-8426898486 [0,1,0,0,0,1|2,0,0]=4 1354 B16R2.15551 CC(=O)CCC1=CNC2=C1C=C(C=C2)Br MCULE-9077149693 [0,1,0,0,0,1|1,0,0]=3 1355 B16R2.15551 CC(=O)CCC1=CNC2=CC=C(C=C12)F MCULE-9993709905 [0,1,0,0,0,1|1,0,0]=3 1356 B16R2.15551 CC1=CC2=C(C=C1)NC=C2/C=C/C(=O)O MCULE-3649831392 [0,1,0,0,0,1|1,0,1]=4 1357 B16R2.15551 CC1=CC2=C(C=C1)NC=C2CCC(=O)N MCULE-3339794781 [0,1,0,0,0,1|0,0,0]=2 1358 B16R2.15551 CC1=CC2=C(C=C1)NC=C2CCC(=O)O MCULE-1239455157 [0,1,0,0,0,1|1,0,0]=3 1359 B16R2.15551 O=C(O)/C=C/C1=CNC2=C1C=C(C=C2)Cl MCULE-8006257909 [0,1,0,0,0,1|1,0,1]=4 1360 B16R2.15551 O=C(O)CCC1=CNC2=C1C=C(C=C2)Br MCULE-3024032932 [0,1,0,0,0,1|1,0,0]=3 1361 B16R2.15551 O=C(O)CCC1=CNC2=C1C=C(C=C2)I MCULE-5257779988 [0,1,0,0,0,1|1,0,0]=3 1362 B16R2.15551 O=C(O)CCC1=CNC2=C1C=C(C=C2)O MCULE-4117735882 [0,1,0,0,0,1|1,0,0]=3 1363 B16R2.15551 O=C(O)CCC1=CNC2=CC=C(C=C12)Cl MCULE-6818418889 [0,1,0,0,0,1|1,0,0]=3 1364 B16R2.15551 O=C(O)CCC1=CNC2=CC=C(C=C12)F MCULE-4199273131 [0,1,0,0,0,1|1,0,0]=3 1365 B16R2.22833 CC1=C2NC=C(C2=CC=C1)CCC(=O)O MCULE-4873321993 [0,1,0,0,0,1|1,0,0]=3 1366 B16R2.22833 O=C(O)CCC1=CNC2=C(C=CC=C12)Br MCULE-3881669082 [0,1,0,0,0,1|1,0,0]=3 1367 B16R2.22833 O=C(O)CCC1=CNC2=C(C=CC=C12)F MCULE-5570346888 [0,1,0,0,0,1|1,0,0]=3 1368 B16R2.22904 CC1=C2C(=CNC2=CC=C1)CCC(=O)O MCULE-3911363614 [0,1,0,0,0,1|1,0,0]=3 1369 B16R2.22904 O=C(O)CCC1=CNC2=CC=CC(=C12)Br MCULE-4118032651 [0,1,0,0,0,1|1,0,0]=3 1370 B16R2.22904 O=C(O)CCC1=CNC2=CC=CC(=C12)Cl MCULE-4256140437 [0,1,0,0,0,1|1,0,0]=3 1371 B16R2.22904 O=C(O)CCC1=CNC2=CC=CC(=C12)F MCULE-7647345792 [0,1,0,0,0,1|1,0,0]=3 1372 B16R2.104522 CC(=O)/C=C/C1=CN(C2=C1C=CC=C2)C MCULE-1922733032 [0,1,0,0,0,1|1,0,1]=4 1373 B16R2.104522 CC(=O)C=CC1=CN(C2=C1C=CC=C2)C MCULE-8021518100 [0,1,0,0,0,1|1,0,1]=4 1374 B16R2.104522 CN1C=C(C2=C1C=CC=C2)/C=C/C(=O)O MCULE-5303153365 [0,1,0,0,0,1|1,0,1]=4 1375 B16R2.104522 CN1C=C(C2=C1C=CC=C2)C=CC(=O)O MCULE-2015820777 [0,1,0,0,0,1|1,0,1]=4 1376 B16R2.104522 CN1C=C(C2=C1C=CC=C2)CCC(=O)O MCULE-1723021666 [0,1,0,0,0,1|1,0,0]=3 1377 B16R2.104522 CN1C=C(C2=C1C=CC=C2)SCC(=O)N MCULE-3627246897 [0,1,0,0,0,1|0,0,0]=2 1378 B16R2.104522 CN1C=C(C2=C1C=CC=C2)SCC(=O)O MCULE-6156123962 [0,1,0,0,0,1|1,0,0]=3 1379 B16R2.104522 CN1C=[N+](C2=C1C=CC=C2)CCC(=O)N MCULE-4973059418 [0,1,0,0,0,1|1,0,0]=3 1380 B16R2.104522 CN1C=[N+](C2=C1C=CC=C2)CCC(=O)N MCULE-9879778332 [0,1,0,0,0,1|1,0,0]=3 1381 B16R2.104522 CN1N=C(C2=CC=CC=C12)OCC(=O)O MCULE-9024504068 [0,1,0,0,0,1|2,0,0]=4 1382 B16R2.3989 CC(=O)C=C1NC2=C(C=CC=C2)NC1=O MCULE-1804676752 [0,1,0,0,0,1|1,0,1]=4 1383 B16R2.3989 CC(=O)CC1=CC2=C(C=CC=C2)OC1=O MCULE-8120360089 [0,1,0,0,0,1|2,0,0]=4 1384 B16R2.3989 CC(=O)CC1=NC2=CC=CC=C2N=C1O MCULE-5060091669 [0,1,0,0,0,1|1,0,1]=4 1385 B16R2.3989 CC(=O)NC1=CC2=CC=CC=C2NC1=O MCULE-6086013356 [0,1,0,0,0,1|2,0,0]=4 1386 B16R2.3989 NC(=O)CC1NC2=CC=CC=C2NC1=O MCULE-1945149910 [0,1,0,0,0,1|0,0,1]=3 1387 B16R2.3989 NC(=O)CC1NC2=CC=CC=C2NC1=O MCULE-9340297586 [0,1,0,0,0,1|0,0,1]=3 1388 B16R2.3989 NC(=O)CC1SC2=CC=CC=C2NC1=O MCULE-8252691129 [0,1,0,0,0,1|0,0,1]=3 1389 B16R2.3989 NC(=O)CN1CC2=C(C=CC=C2)OC1=O MCULE-5438016839 [0,1,0,0,0,1|2,0,0]=4 1390 B16R2.3989 NC(=O)C[C@@H]1NC2=CC=CC=C2N=C1O MCULE-6854733824 [0,1,0,0,0,1|0,0,2]=4 1391 B16R2.3989 NC(=S)NC1=NC2=C(C=CC=C2)NC1=O MCULE-6650688167 [0,1,0,0,0,1|1,1,0]=4 1392 B16R2.3989 O=C(O)CC1=CC2=C(C=CC=C2)NC1=O MCULE-7818937255 [0,1,0,0,0,1|1,0,0]=3 1393 B16R2.3989 O=C(O)CC1=CC2=C(C=CC=C2)OC1=O MCULE-5591420389 [0,1,0,0,0,1|2,0,0]=4 1394 B16R2.3989 O=C(O)CC1CC2=CC=CC=C2NC1=O MCULE-5348834434 [0,1,0,0,0,1|1,0,1]=4 1395 B16R2.3989 O=C(O)CC1NC2=CC=CC=C2NC1=O MCULE-8421596240 [0,1,0,0,0,1|1,0,1]=4 1396 B16R2.3989 O=C(O)CC1SC2=CC=CC=C2NC1=O MCULE-2004277248 [0,1,0,0,0,1|1,0,1]=4 1397 B16R2.5347 CNC(=O)CC1=CC2=C(C=CC=C2)C=C1 MCULE-9737167129 [0,1,0,0,0,1|1,0,0]=3 1398 B16R2.5347 CNC(=O)CC1=NN=C2C=CC=CC2=N1 MCULE-7942725213 [0,1,0,0,0,1|1,0,1]=4 1399 B16R2.5347 CNC(=O)OC1=CC2=C(C=CC=C2)C=C1 MCULE-4998762736 [0,1,0,0,0,1|2,0,0]=4 1400 B16R2.5347 COC(=O)CC1=CC2=C(C=CC=C2)C=C1 MCULE-6911673371 [0,1,0,0,0,1|2,0,0]=4 1401 B16R2.5347 COC(=O)CC1=CC2=CC=CC=C2N=C1 MCULE-6079947375 [0,1,0,0,0,1|1,0,1]=4 1402 B16R2.5347 COC(=O)CC1=NC2=C(C=CC=C2)C=C1 MCULE-5684486297 [0,1,0,0,0,1|2,0,0]=4 1403 B16R2.5347 N=C(CC1=CC=C2C=CC=CC2=C1)NO MCULE-7686454981 [0,1,0,0,0,1|2,0,0]=4 1404 B16R2.5347 NCC(=O)NC1=CC2=C(C=CC=C2)C=C1 MCULE-4789774618 [0,1,0,0,0,1|2,0,0]=4 1405 B16R2.5347 NCC(=O)NC1=CC2=C(C=CC=C2)N=C1 MCULE-9317647779 [0,1,0,0,0,1|1,0,1]=4 1406 B16R2.5347 NCC(=O)NC1=CC=C2C=CC=CC2=C1 MCULE-5488091337 [0,1,0,0,0,1|2,0,0]=4 1407 B16R2.5347 NNC(=O)CC1=CC2=C(C=CC=C2)C=C1 MCULE-8768512541 [0,1,0,0,0,1|1,0,0]=3 1408 B16R2.5347 NNC(=O)CC1=NN=C2C=CC=CC2=N1 MCULE-5261032329 [0,1,0,0,0,1|1,0,1]=4 1409 B16R2.5347 O=C(CCl)CC1=CC2=CC=CC=C2C=C1 MCULE-8273100275 [0,1,0,0,0,1|2,0,0]=4 1410 B16R2.6284 CC(C(=O)O)C1=CC2=C(C=CC=C2)C=C1 MCULE-2468277732 [0,1,0,0,0,1|2,0,0]=4 1411 B16R2.6284 NC(=O)C(=S)C1=CC=C2C=CC=CC2=N1 MCULE-8272811151 [0,1,0,0,0,1|1,0,1]=4 1412 B16R2.6284 NC(C(=O)O)C1=CC2=C(C=CC=C2)C=C1 MCULE-2490098737 [0,1,0,0,0,1|2,0,0]=4 1413 B16R2.6284 NC(C(=O)O)C1=CC2=CC=CC=C2C=C1 MCULE-3765393506 [0,1,0,0,0,1|2,0,0]=4 1414 B16R2.6284 NC(C(=O)O)C1=CC2=CC=CC=C2C=C1 MCULE-5950507526 [0,1,0,0,0,1|2,0,0]=4 1415 B16R2.6284 NC(C(=O)O)C1=CC2=CC=CC=C2C=C1 MCULE-7668815678 [0,1,0,0,0,1|2,0,0]=4 1416 B16R2.6284 N[C@@H](C(=O)O)C1=CC2=CC=CC=C2C=C1 MCULE-3206034157 [0,1,0,0,0,1|2,0,0]=4 1417 B16R2.6284 N[C@@H](C(=O)O)C1=CC=C2C=CC=CC2=C1 MCULE-1399497830 [0,1,0,0,0,1|2,0,0]=4 1418 B16R2.6284 N[C@@H](C(=O)O)C1=CC=C2C=CC=CC2=C1 MCULE-3558773715 [0,1,0,0,0,1|2,0,0]=4 1419 B16R2.6284 N[C@@H](C(=O)O)C1=CC=C2C=CC=CC2=C1 MCULE-5476835776 [0,1,0,0,0,1|2,0,0]=4 1420 B16R2.6284 N[C@H](C(=O)O)C1=CC2=CC=CC=C2C=C1 MCULE-9421690525 [0,1,0,0,0,1|2,0,0]=4 1421 B16R2.6284 N[C@H](C(=O)O)C1=CC=C2C=CC=CC2=C1 MCULE-3758730325 [0,1,0,0,0,1|2,0,0]=4 1422 B16R2.6284 N[C@H](C(=O)O)C1=CC=C2C=CC=CC2=C1 MCULE-4035896271 [0,1,0,0,0,1|2,0,0]=4 1423 B16R2.6284 O=C(O)C(Cl)C1=CC2=CC=CC=C2C=C1 MCULE-9376170097 [0,1,0,0,0,1|2,0,0]=4 1424 B16R2.6284 O=C(O)[C@@H](O)C1=CC=C2C=CC=CC2=C1 MCULE-1068199703 [0,1,0,0,0,1|2,0,0]=4 1425 B16R2.6284 O=C(O)[C@H](O)C1=CC=C2C=CC=CC2=C1 MCULE-5186959600 [0,1,0,0,0,1|2,0,0]=4 1426 B16R2.11988 NC(=O)CC1=CC2=CC=C(C=C2C=C1)Br MCULE-9117755495 [0,1,0,0,0,1|1,0,0]=3 1427 B16R2.11988 O=C(O)CC1=CC=C2C=C(C=CC2=C1)Br MCULE-5761733694 [0,1,0,0,0,1|2,0,0]=4 1428 B16R2.11988 O=C(O)CC1=CC=C2C=C(C=CC2=C1)O MCULE-7326864861 [0,1,0,0,0,1|2,0,0]=4 1429 B16R2.24933 NC(=O)CC1=NC2=CC=CC=C2C(=O)N1 MCULE-2328453251 [0,1,0,0,0,1|2,0,0]=4 1430 B16R2.83538 NC(=O)CN1C=NC2=CC=CC=C2C1=O MCULE-9758389057 [0,1,0,0,0,1|1,0,1]=4 1431 B16R2.83538 NC(=O)OC1=C(C2=CC=CC=C2C=C1)Br MCULE-4330236971 [0,1,0,0,0,1|2,0,0]=4 1432 B16R2.83538 O=C(O)CC1=C(C2=C(C=CC=C2)C=C1)Br MCULE-6004652966 [0,1,0,0,0,1|2,0,0]=4 1433 B16R2.83538 O=C(O)CC1=CNC2=CC=CC=C2C1=O MCULE-1003972607 [0,1,0,0,0,1|1,0,0]=3 1434 B16R2.126902 CC(=O)CC1=NC2=C(C=CC=C2O)C=C1 MCULE-6711923376 [0,1,0,0,0,1|2,0,0]=4 1435 B16R2.333 CC1=C(C2=CC=CC=C2C=C1)CC(=O)O MCULE-6236664179 [0,1,0,0,0,1|2,0,0]=4 1436 B16R2.333 O=C(O)CC1=C(C=CC2=CC=CC=C12)F MCULE-9594341579 [0,1,0,0,0,1|2,0,0]=4 1437 B16R2.333 O=C(O)CC1=C2C=CC=CC2=CC=C1O MCULE-3755798304 [0,1,0,0,0,1|2,0,0]=4 1438 B16R2.2986 O=C(O)CC1=C2C=CC(=CC2=CC=C1)O MCULE-2735674873 [0,1,0,0,0,1|2,0,0]=4 1439 B16R2.2986 O=C(O)CC1=C2C=CC(=CC2=NC=N1)Cl MCULE-2063311320 [0,1,0,0,0,1|1,0,1]=4 1440 B16R2.3995 NC(=O)CC1=NC(=NC2=CC=CC=C12)Cl MCULE-5034369529 [0,1,0,0,0,1|0,0,1]=3 1441 B16R2.3995 O=C(O)CC1=C2C=CC=CC2=CC(=C1)Cl MCULE-2383966189 [0,1,0,0,0,1|2,0,0]=4 1442 B16R2.3995 O=C(O)CC1=C2C=CC=CC2=NC(=N1)Cl MCULE-6905296757 [0,1,0,0,0,1|1,0,1]=4 1443 B16R2.3995 O=C(O)CC1=CC(=O)NC2=CC=CC=C12 MCULE-4146125331 [0,1,0,0,0,1|1,0,0]=3 1444 B16R2.3995 O=C(O)CC1=CC(=O)OC2=CC=CC=C12 MCULE-4275715076 [0,1,0,0,0,1|2,0,0]=4 1445 B16R2.3995 O=C(O)CC1CC(=O)NC2=CC=CC=C12 MCULE-7458524432 [0,1,0,0,0,1|1,0,1]=4 1446 B16R2.3995 O=C(O)CN1CC(=O)NC2=C1C=CC=C2 MCULE-1547277567 [0,1,0,0,0,1|2,0,0]=4 1447 B16R2.24414 CC1=CC=C(C2=C1C=CC=C2)CC(=O)O MCULE-3899545249 [0,1,0,0,0,1|2,0,0]=4 1448 B16R2.24414 N=C1C=CN(C2=CC=CC=C12)CC(=O)N MCULE-9077510917 [0,1,0,0,0,1|2,0,0]=4 1449 B16R2.24414 NC(=O)CN1C=CC(=O)C2=C1C=CC=C2 MCULE-9685455913 [0,1,0,0,0,1|2,0,0]=4 1450 B16R2.24414 NC(=O)CN1C=CC(=[NH2+])C2=CC=CC=C12 MCULE-6701836804 [0,1,0,0,0,1|2,0,0]=4 1451 B16R2.24414 NC(=O)CN1C=NC(=O)C2=CC=CC=C12 MCULE-1954076225 [0,1,0,0,0,1|1,0,1]=4 1452 B16R2.24414 O=C(O)CC1=C2C=CC=CC2=C(C=C1)Br MCULE-3069727519 [0,1,0,0,0,1|2,0,0]=4 1453 B16R2.24414 O=C(O)CC1=CC=C(C2=CC=CC=C12)F MCULE-4456424165 [0,1,0,0,0,1|2,0,0]=4 1454 B16R2.24414 O=C(O)CC1=NNC(=O)C2=C1C=CC=C2 MCULE-1747279667 [0,1,0,0,0,1|2,0,0]=4 1455 B16R2.126882 O=C(O)CC1=C2C(=CC=CC2=NC=N1)Cl MCULE-7785774417 [0,1,0,0,0,1|1,0,1]=4 1456 B16R2.126882 O=C(O)CC1=C2C(=CC=CC2=NC=N1)F MCULE-5445534614 [0,1,0,0,0,1|1,0,1]=4 1457 B16R2.170412 CCC(=O)CC1=C2C=CC=CC2=CC=C1 MCULE-8407980606 [0,1,0,0,0,1|2,0,0]=4 1458 B16R2.170412 CNC(=O)NC1=C2C=CC=CC2=CC=C1 MCULE-1800286325 [0,1,0,0,0,1|2,0,0]=4 1459 B16R2.170412 CNC(=O)NC1=CC=NC2=CC=CC=C12 MCULE-8134062601 [0,1,0,0,0,1|1,0,1]=4 1460 B16R2.170412 CNC(=O)OC1=C2C=CC=CC2=CC=C1 MCULE-7779321694 [0,1,0,0,0,1|2,0,0]=4 1461 B16R2.170412 COC(=O)CC1=C2C=CC=CC2=CC=C1 MCULE-6528586657 [0,1,0,0,0,1|2,0,0]=4 1462 B16R2.170412 COC(=O)CC1=NC=CC2=C1C=CC=C2 MCULE-2390940897 [0,1,0,0,0,1|2,0,0]=4 1463 B16R2.170412 COC(=O)CC1=NC=NC2=C1C=CC=C2 MCULE-1033912073 [0,1,0,0,0,1|1,0,1]=4 1464 B16R2.170412 N/C(=N\O)/CC1=CC=CC2=CC=CC=C12 MCULE-2782743976 [0,1,0,0,0,1|1,0,1]=4 1465 B16R2.170412 NCC(=O)NC1=C2C=CC=CC2=CC=C1 MCULE-3685192967 [0,1,0,0,0,1|2,0,0]=4 1466 B16R2.170412 NCC(=O)NC1=C2C=CC=CC2=CC=C1 MCULE-5301672977 [0,1,0,0,0,1|2,0,0]=4 1467 B16R2.170412 NNC(=O)CC1=CC=CC2=CC=CC=C12 MCULE-1159690001 [0,1,0,0,0,1|1,0,0]=3 1468 B16R2.170412 NNC(=O)NC1=C2C=CC=CC2=CC=C1 MCULE-8164900412 [0,1,0,0,0,1|2,0,0]=4 1469 B16R2.170412 O=C(CC1=C2C=CC=CC2=CC=C1)NO MCULE-4696425449 [0,1,0,0,0,1|1,0,0]=3 1470 B16R2.170412 O=C(CCl)CC1=C2C=CC=CC2=CC=C1 MCULE-3006967928 [0,1,0,0,0,1|2,0,0]=4 1471 B16R2.170412 O=C(NO)NC1=CC=CC2=CC=CC=C12 MCULE-3373678788 [0,1,0,0,0,1|2,0,0]=4 1472 B16R2.244415 CC(C(=O)O)C1=C2C=CC=CC2=CC=C1 MCULE-2048793198 [0,1,0,0,0,1|2,0,0]=4 1473 B16R2.244415 NC(C(=O)O)C1=C2C=CC=CC2=CC=C1 MCULE-1668976715 [0,1,0,0,0,1|2,0,0]=4 1474 B16R2.244415 NC(C(=O)O)C1=C2C=CC=CC2=CC=C1 MCULE-3817950079 [0,1,0,0,0,1|2,0,0]=4 1475 B16R2.244415 NC(C(=O)O)C1=C2C=CC=CC2=CC=C1 MCULE-7290075140 [0,1,0,0,0,1|2,0,0]=4 1476 B16R2.244415 NC(C(=O)O)C1=CC=CC2=CC=CC=C12 MCULE-7446621392 [0,1,0,0,0,1|2,0,0]=4 1477 B16R2.244415 N[C@@H](C(=O)O)C1=C2C=CC=CC2=CC=C1 MCULE-2114748931 [0,1,0,0,0,1|2,0,0]=4 1478 B16R2.244415 N[C@@H](C(=O)O)C1=C2C=CC=CC2=CC=C1 MCULE-4127798936 [0,1,0,0,0,1|2,0,0]=4 1479 B16R2.244415 N[C@@H](C(=O)O)C1=C2C=CC=CC2=CC=C1 MCULE-5110533242 [0,1,0,0,0,1|2,0,0]=4 1480 B16R2.244415 N[C@@H](C(=O)O)C1=C2C=CC=CC2=CC=C1 MCULE-7484069804 [0,1,0,0,0,1|2,0,0]=4 1481 B16R2.244415 N[C@H](C(=O)O)C1=C2C=CC=CC2=CC=C1 MCULE-3930483477 [0,1,0,0,0,1|2,0,0]=4 1482 B16R2.244415 N[C@H](C(=O)O)C1=C2C=CC=CC2=CC=C1 MCULE-8649538702 [0,1,0,0,0,1|2,0,0]=4 1483 B16R2.244415 N[C@H](C(=O)O)C1=C2C=CC=CC2=CC=C1 MCULE-9245872714 [0,1,0,0,0,1|2,0,0]=4 1484 B16R2.244415 N[C@H](C(=O)O)C1=CC=CC2=C1C=CC=C2 MCULE-8520686749 [0,1,0,0,0,1|2,0,0]=4 1485 B16R2.5 CCCC(=O)OC1=CNC2=C1C=CC=C2 MCULE-1846748781 [0,2,0,0,0,0|2,0,0]=4 1486 B16R2.5 CCOC(=O)CC1=CNC2=CC=CC=C12 MCULE-8396851750 [0,2,0,0,0,0|1,0,0]=3 1487 B16R2.5 CCOC(=O)CC1=COC2=C1C=CC=C2 MCULE-1498768624 [0,2,0,0,0,0|2,0,0]=4 1488 B16R2.5 CCOC(=O)CC1=NNC2=C1C=CC=C2 MCULE-1419093054 [0,2,0,0,0,0|2,0,0]=4 1489 B16R2.5 CNC[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-1587513374 [0,2,0,0,0,0|1,0,1]=4 1490 B16R2.140 COC(=O)CC1=CNC2=C(C=CC=C12)C MCULE-4118518405 [0,2,0,0,0,0|1,0,0]=3 1491 B16R2.140 COC(=O)CC1=CNC2=C1C=CC=C2Br MCULE-8871635786 [0,2,0,0,0,0|1,0,0]=3 1492 B16R2.140 COC(=O)CC1=CNC2=C1C=CC=C2Cl MCULE-9281792264 [0,2,0,0,0,0|1,0,0]=3 1493 B16R2.140 COC(=O)CC1=CNC2=C1C=CC=C2F MCULE-2689579643 [0,2,0,0,0,0|1,0,0]=3 1494 B16R2.140 COC(=O)CC1=COC2=C1C=CC=C2O MCULE-3073120077 [0,2,0,0,0,0|2,0,0]=4 1495 B16R2.2224 CNC(=O)C(=O)C1=CNC2=C1C=CC=C2 MCULE-1913207582 [0,2,0,0,0,0|0,0,1]=3 1496 B16R2.2224 COC(=O)C(=O)C1=CNC2=CC=CC=C12 MCULE-5250471628 [0,2,0,0,0,0|1,0,1]=4 1497 B16R2.2224 COC(=O)C(N)C1=CNC2=CC=CC=C12 MCULE-7931476219 [0,2,0,0,0,0|1,0,0]=3 1498 B16R2.2224 COC(=O)[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-2872676495 [0,2,0,0,0,0|1,0,0]=3 1499 B16R2.2224 COC(=O)[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-5614059548 [0,2,0,0,0,0|1,0,0]=3 1500 B16R2.2224 COC(=O)[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-7216198568 [0,2,0,0,0,0|2,0,0]=4 1501 B16R2.2224 COC(=O)[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-9837705325 [0,2,0,0,0,0|2,0,0]=4 1502 B16R2.2224 COC(=O)[C@H](N)C1=CNC2=CC=CC=C12 MCULE-7785759347 [0,2,0,0,0,0|1,0,0]=3 1503 B16R2.2224 COC(=O)[C@H](N)C1=CNC2=CC=CC=C12 MCULE-8332398993 [0,2,0,0,0,0|1,0,0]=3 1504 B16R2.2224 COC(=O)[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-2273644001 [0,2,0,0,0,0|2,0,0]=4 1505 B16R2.2224 COC(=O)[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-8352184736 [0,2,0,0,0,0|2,0,0]=4 1506 B16R2.33556 CCC(N)CC1=CN(C2=C1C=CC=C2)C MCULE-4645482040 [0,2,0,0,0,0|1,0,1]=4 1507 B16R2.33556 CCC(N)CC1=CN(C2=C1C=CC=C2)C MCULE-9518606643 [0,2,0,0,0,0|1,0,1]=4 1508 B16R2.33556 COC(=O)CC1=CN(C2=C1C=CC=C2)C MCULE-5164673542 [0,2,0,0,0,0|1,0,0]=3 1509 B16R2.33562 CC1=CC2=C(N1CC(=O)NN)C=CC=C2 MCULE-7539123400 [0,2,0,0,0,0|2,0,0]=4 1510 B16R2.33562 CC1=NC2=C(N1CC(=O)NN)C=CC=C2 MCULE-9777391726 [0,2,0,0,0,0|1,0,1]=4 1511 B16R2.33562 CNC(=O)CC1=C(SC2=C1C=CC=C2)Cl MCULE-6079059988 [0,2,0,0,0,0|1,0,0]=3 1512 B16R2.33562 COC(=O)CC1=C(NC2=CC=CC=C12)Br MCULE-6271250285 [0,2,0,0,0,0|1,0,0]=3 1513 B16R2.33562 COC(=O)CC1=C(NC2=CC=CC=C12)C MCULE-9476781847 [0,2,0,0,0,0|1,0,0]=3 1514 B16R2.33562 COC(=O)CC1=C(NC2=NC=CC=C12)C MCULE-1042139832 [0,2,0,0,0,0|2,0,0]=4 1515 B16R2.33562 COC(=O)CC1C(=O)NC2=C1C=CC=C2 MCULE-5102340296 [0,2,0,0,0,0|1,0,1]=4 1516 B16R2.33562 COC(=O)CN1C(=O)NC2=CC=CC=C12 MCULE-1755868093 [0,2,0,0,0,0|2,0,0]=4 1517 B16R2.33562 NNC(=O)CN1C(=O)OC2=CC=CC=C12 MCULE-8814405269 [0,2,0,0,0,0|2,0,0]=4 1518 B16R2.34357 COC(=O)CC1=CNC2=C1C=CC(=C2)Br MCULE-5241200650 [0,2,0,0,0,0|1,0,0]=3 1519 B16R2.34357 COC(=O)CC1=CNC2=C1C=CC(=C2)C MCULE-2121159076 [0,2,0,0,0,0|1,0,0]=3 1520 B16R2.34357 COC(=O)CC1=CNC2=C1C=CC(=C2)Cl MCULE-7152874237 [0,2,0,0,0,0|1,0,0]=3 1521 B16R2.34357 COC(=O)CC1=CNC2=C1C=CC(=C2)F MCULE-2275497584 [0,2,0,0,0,0|1,0,0]=3 1522 B16R2.34357 COC(=O)CC1=COC2=CC(=CC=C12)C MCULE-7947826498 [0,2,0,0,0,0|2,0,0]=4 1523 B16R2.34357 COC(=O)CC1=COC2=CC(=CC=C12)O MCULE-9842002749 [0,2,0,0,0,0|2,0,0]=4 1524 B16R2.34357 COC(=O)CC1=NNC2=CC(=CC=C12)N MCULE-7068368360 [0,2,0,0,0,0|2,0,0]=4 1525 B16R2.176317 CCC(N)CC1=CNC2=C1C(=CC=C2)C MCULE-9940652037 [0,2,0,0,0,0|1,0,1]=4 1526 B16R2.176317 CNC(=O)CC1=CNC2=CC=CC(=C12)O MCULE-7923149005 [0,2,0,0,0,0|0,0,0]=2 1527 B16R2.176317 COC(=O)CC1=CNC2=C1C(=CC=C2)C MCULE-2365365230 [0,2,0,0,0,0|1,0,0]=3 1528 B16R2.176317 COC(=O)CC1=CNC2=C1C(=CC=C2)Cl MCULE-1268472434 [0,2,0,0,0,0|1,0,0]=3 1529 B16R2.176317 COC(=O)CC1=CNC2=C1C(=CC=C2)F MCULE-5895704791 [0,2,0,0,0,0|1,0,0]=3 1530 B16R2.176317 COC(=O)CC1=CNC2=CC=CC(=C12)Br MCULE-5819411696 [0,2,0,0,0,0|1,0,0]=3 1531 B16R2.176317 COC(=O)CC1=CNC2=NC=CC(=C12)Br MCULE-6949038056 [0,2,0,0,0,0|2,0,0]=4 1532 B16R2.176317 COC(=O)CC1=CNC2=NC=CC(=C12)Cl MCULE-4232973441 [0,2,0,0,0,0|2,0,0]=4 1533 B16R2.176359 CCC(=O)OC1=CNC2=CC=C(C=C12)N MCULE-8519093170 [0,2,0,0,0,0|2,0,0]=4 1534 B16R2.176359 CCC(N)CC1=CNC2=C1C=C(C=C2)F MCULE-1870500907 [0,2,0,0,0,0|1,0,1]=4 1535 B16R2.176359 CCC(N)CC1=CNC2=CC=C(C=C12)F MCULE-1447048828 [0,2,0,0,0,0|1,0,1]=4 1536 B16R2.176359 CNC(=O)CC1=COC2=CC=C(C=C12)F MCULE-5548239145 [0,2,0,0,0,0|1,0,0]=3 1537 B16R2.176359 CNC(=O)CC1=CSC2=C1C=C(C=C2)Cl MCULE-7279311100 [0,2,0,0,0,0|1,0,0]=3 1538 B16R2.176359 CNC(=O)CN1C=CC2=C1C=C(C=C2)N MCULE-5499817674 [0,2,0,0,0,0|2,0,0]=4 1539 B16R2.176359 COC(=O)CC1=CNC2=C1C=C(C=C2)Br MCULE-8974283983 [0,2,0,0,0,0|1,0,0]=3 1540 B16R2.176359 COC(=O)CC1=CNC2=C1C=C(C=C2)C MCULE-7107797497 [0,2,0,0,0,0|1,0,0]=3 1541 B16R2.176359 COC(=O)CC1=CNC2=C1C=C(C=C2)Cl MCULE-3716991328 [0,2,0,0,0,0|1,0,0]=3 1542 B16R2.176359 COC(=O)CC1=CNC2=C1C=C(C=C2)F MCULE-7247225475 [0,2,0,0,0,0|1,0,0]=3 1543 B16R2.176359 COC(=O)CC1=CNC2=C1C=C(C=C2)O MCULE-4350899608 [0,2,0,0,0,0|1,0,0]=3 1544 B16R2.176359 COC(=O)CC1=CNC2=NC=C(C=C12)Br MCULE-6997455365 [0,2,0,0,0,0|2,0,0]=4 1545 B16R2.176359 COC(=O)CC1=CSC2=C1C=C(C=C2)C MCULE-2083056098 [0,2,0,0,0,0|2,0,0]=4 1546 B16R2.176359 COC(=O)CC1=CSC2=C1C=C(C=C2)Cl MCULE-8672467752 [0,2,0,0,0,0|2,0,0]=4 1547 B16R2.176359 O=C(CC1=CNC2=CC=C(C=C12)Br)NO MCULE-9444445551 [0,2,0,0,0,0|0,0,0]=2 1548 B16R2.2977 CC(C)(N)CC1=CNC2=C1C=CC(=C2)F MCULE-8944126334 [0,2,0,0,0,0|1,0,1]=4 1549 B16R2.2482 CCC1=CC2=C(C=C1)C(=CO2)CC(=O)O MCULE-4813823916 [0,2,0,0,0,0|2,0,0]=4 1550 B16R2.2482 COC1=CC2=C(C=C1)C(=CN2)CC(C)N MCULE-5432591772 [0,2,0,0,0,0|1,0,1]=4 1551 B16R2.2482 COC1=CC2=C(C=C1)C(=CN2)CC(C)N MCULE-9723713983 [0,2,0,0,0,0|1,0,1]=4 1552 B16R2.2482 COC1=CC=C2C(=C1)NC=C2OC(=O)C MCULE-7357990189 [0,2,0,0,0,0|2,0,0]=4 1553 B16R2.2482 COC1=CC=C2C(=CNC2=C1)CC(=O)O MCULE-8621631619 [0,2,0,0,0,0|1,0,0]=3 1554 B16R2.2482 COC1=CC=C2C(=COC2=C1)CC(=O)O MCULE-6656731637 [0,2,0,0,0,0|2,0,0]=4 1555 B16R2.2482 N#CC1=CC2=C(C=C1)N(C=C2)CC(=O)N MCULE-4749642677 [0,2,0,0,0,0|2,0,0]=4 1556 B16R2.2982 CC1=CC=C2C(=C1)NC(=O)C2CC(=O)O MCULE-9166667219 [0,2,0,0,0,0|1,0,1]=4 1557 B16R2.2982 CC1=CC=C2C(=C1)OC(=C2CC(=O)Cl)Br MCULE-3240183807 [0,2,0,0,0,0|2,0,0]=4 1558 B16R2.2982 CC1=CC=C2C(=C1)OC(=C2CC(=O)N)Br MCULE-5009725648 [0,2,0,0,0,0|1,0,0]=3 1559 B16R2.2982 CC1=CC=C2C(=C1)OC(=C2CC(=O)O)Br MCULE-3283492492 [0,2,0,0,0,0|2,0,0]=4 1560 B16R2.2982 CC1=CC=C2C(=C1)OC(=C2CC(=O)O)Cl MCULE-7259884390 [0,2,0,0,0,0|2,0,0]=4 1561 B16R2.2982 NC(=O)CN1C(=O)OC2=C1C=CC(=C2)Br MCULE-4758497669 [0,2,0,0,0,0|2,0,0]=4 1562 B16R2.2982 NC(=O)CN1C(=O)OC2=C1C=CC(=C2)Cl MCULE-5136370194 [0,2,0,0,0,0|2,0,0]=4 1563 B16R2.2982 NC(=O)CN1C(=O)OC2=C1C=CC(=C2)N MCULE-2400213520 [0,2,0,0,0,0|2,0,0]=4 1564 B16R2.2982 O=C(O)CC1C(=O)NC2=C1C=CC(=C2)F MCULE-2209744899 [0,2,0,0,0,0|1,0,1]=4 1565 B16R2.2982 O=C(O)CN1C(=O)NC2=CC(=CC=C12)F MCULE-7925998832 [0,2,0,0,0,0|2,0,0]=4 1566 B16R2.12530 CC1=CC2=C(C=C1)C(=CN2)C(=O)C(=O)N MCULE-5505188874 [0,2,0,0,0,0|0,0,1]=3 1567 B16R2.12530 CC1=CC2=C(C=C1)C(=CN2)C(=O)C(=O)O MCULE-5172204302 [0,2,0,0,0,0|1,0,1]=4 1568 B16R2.12530 O=C(O)C(=O)C1=CNC2=C1C=CC(=C2)Br MCULE-3969672402 [0,2,0,0,0,0|1,0,1]=4 1569 B16R2.12530 O=C(O)C(=O)C1=CNC2=C1C=CC(=C2)Cl MCULE-7893574558 [0,2,0,0,0,0|1,0,1]=4 1570 B16R2.12530 O=C(O)C(=O)C1=CNC2=C1C=CC(=C2)F MCULE-1736408912 [0,2,0,0,0,0|1,0,1]=4 1571 B16R2.13690 CC(=O)OC1=CNC2=C1C=C(C(=C2)Cl)Br MCULE-9796876469 [0,2,0,0,0,0|2,0,0]=4 1572 B16R2.13690 CC(=O)OC1=CNC2=CC(=C(C=C12)F)F MCULE-7888901552 [0,2,0,0,0,0|2,0,0]=4 1573 B16R2.13690 CC(N)CC1=CNC2=C1C=C(C(=C2)Cl)F MCULE-3586873655 [0,2,0,0,0,0|1,0,1]=4 1574 B16R2.13690 CC(N)CC1=CNC2=C1C=C(C(=C2)Cl)F MCULE-7912179263 [0,2,0,0,0,0|1,0,1]=4 1575 B16R2.13690 CC1=C(C=C2C(=C1)N=CN2CC(=O)N)C MCULE-1106614247 [0,2,0,0,0,0|1,0,1]=4 1576 B16R2.13690 CC1=C(C=C2C(=COC2=C1)CC(=O)O)C MCULE-1209102629 [0,2,0,0,0,0|2,0,0]=4 1577 B16R2.13690 CC1=C(C=C2C(=COC2=C1)CC(=O)O)Cl MCULE-6141188211 [0,2,0,0,0,0|2,0,0]=4 1578 B16R2.13690 CC1=C(C=C2C(=COC2=C1)CC(=O)[O-])Cl MCULE-8194813673 [0,2,0,0,0,0|2,0,0]=4 1579 B16R2.13690 CC1=CC2=C(C=C1Br)NC=C2CC(=O)O MCULE-9478990719 [0,2,0,0,0,0|1,0,0]=3 1580 B16R2.13690 CC1=CC2=C(C=C1Cl)C(=CO2)CC(=O)N MCULE-4168320013 [0,2,0,0,0,0|1,0,0]=3 1581 B16R2.13690 CC1=CC2=C(C=C1Cl)OC=C2CC(=O)O MCULE-1435852409 [0,2,0,0,0,0|2,0,0]=4 1582 B16R2.13690 C[C@H](N)CC1=CNC2=C1C=C(C(=C2)Cl)F MCULE-7056665602 [0,2,0,0,0,0|1,0,1]=4 1583 B16R2.13690 C[C@H](N)CC1=CNC2=C1C=C(C(=C2)Cl)F MCULE-8238390137 [0,2,0,0,0,0|1,0,1]=4 1584 B16R2.13690 C[C@H](N)CC1=CNC2=CC(=C(C=C12)F)Cl MCULE-3220872637 [0,2,0,0,0,0|1,0,1]=4 1585 B16R2.13690 C[C@H](N)CC1=CNC2=CC(=C(C=C12)F)Cl MCULE-9024380249 [0,2,0,0,0,0|1,0,1]=4 1586 B16R2.13690 O=C(O)CC1=CNC2=C1C=C(C(=C2)Br)F MCULE-5446881153 [0,2,0,0,0,0|1,0,0]=3 1587 B16R2.13690 O=C(O)CC1=CNC2=C1C=C(C(=C2)Cl)Br MCULE-4717775240 [0,2,0,0,0,0|1,0,0]=3 1588 B16R2.13690 O=C(O)CC1=CNC2=C1C=C(C(=C2)F)Br MCULE-3450911249 [0,2,0,0,0,0|1,0,0]=3 1589 B16R2.13690 O=C(O)CC1=CNC2=C1C=C(C(=C2)F)F MCULE-5180063604 [0,2,0,0,0,0|1,0,0]=3 1590 B16R2.16135 CC1=CC(=C2C(=COC2=C1)CC(=O)O)C MCULE-1255642174 [0,2,0,0,0,0|2,0,0]=4 1591 B16R2.16135 O=C(O)CC1=CNC2=C1C(=CC(=C2)Br)F MCULE-9849636035 [0,2,0,0,0,0|1,0,0]=3 1592 B16R2.16135 O=C(O)CC1=CNC2=C1C(=CC(=C2)Cl)Cl MCULE-2173470530 [0,2,0,0,0,0|1,0,0]=3 1593 B16R2.16135 O=C(O)CC1=CNC2=C1C(=CC(=C2)F)F MCULE-7068548149 [0,2,0,0,0,0|1,0,0]=3 1594 B16R2.24545 CC1=C(C2=C(C=C1)C(=CO2)CC(=O)N)C MCULE-7291254443 [0,2,0,0,0,0|1,0,0]=3 1595 B16R2.24545 CC1=C(C2=C(C=C1)C(=CO2)CC(=O)O)C MCULE-9645680991 [0,2,0,0,0,0|2,0,0]=4 1596 B16R2.24545 CC1=C(C2=C(C=C1)C(=CO2)CC(=O)[O-])C MCULE-6016111220 [0,2,0,0,0,0|2,0,0]=4 1597 B16R2.24545 CC1=C(C=CC2=C1NC=C2CC(=O)O)Br MCULE-3362779435 [0,2,0,0,0,0|1,0,0]=3 1598 B16R2.24545 CC1=C(C=CC2=C1NC=C2CC(=O)O)F MCULE-4610128055 [0,2,0,0,0,0|1,0,0]=3 1599 B16R2.24545 CC1=C(C=CC2=C1OC=C2CC(=O)O)O MCULE-4730982523 [0,2,0,0,0,0|2,0,0]=4 1600 B16R2.24545 O=C(O)CC1=COC2=C1C=CC(=C2Cl)Cl MCULE-7998512049 [0,2,0,0,0,0|2,0,0]=4 1601 B16R2.24545 O=C(O)CC1=COC2=C1C=CC(=C2F)F MCULE-1357865138 [0,2,0,0,0,0|2,0,0]=4 1602 B16R2.24600 CN1C=C(C2=CC=C(C=C12)F)CC(=O)O MCULE-8800995139 [0,2,0,0,0,0|1,0,0]=3 1603 B16R2.1625 CCC1=C(C2=C(O1)C=CC=C2)CC(=O)O MCULE-4674350728 [0,2,0,0,0,0|2,0,0]=4 1604 B16R2.1625 CCC1=NC2=C(N1CC(=O)N)C=CC=C2 MCULE-1603519668 [0,2,0,0,0,0|1,0,1]=4 1605 B16R2.1625 CSC1=NC2=CC=CC=C2N1CC(=O)N MCULE-8905646143 [0,2,0,0,0,0|1,0,1]=4 1606 B16R2.4001 CC(=O)CC1(C(=O)NC2=CC=CC=C12)O MCULE-8072913034 [0,2,0,0,0,0|1,0,1]=4 1607 B16R2.4001 CC(=O)C[C@@]1(C(=O)NC2=C1C=CC=C2)O MCULE-8889699233 [0,2,0,0,0,0|1,0,1]=4 1608 B16R2.4002 CC1=C(C2=C(N1)C=CC=C2)C(=O)C(=O)N MCULE-7922823436 [0,2,0,0,0,0|0,0,1]=3 1609 B16R2.4002 CC1=C(C2=C(N1)C=CC=C2)C(=O)C(=O)O MCULE-1693222774 [0,2,0,0,0,0|1,0,1]=4 1610 B16R2.4002 CC1=C(C2=CC=CN=C2N1)C(C)C(=O)O MCULE-6375616302 [0,2,0,0,0,0|2,0,0]=4 1611 B16R2.12021 CC(=O)NC1=C(NC2=C1C=C(C=C2)Br)O MCULE-1423673413 [0,2,0,0,0,0|2,0,0]=4 1612 B16R2.12021 CC(=O)NC1=C(NC2=CC=C(C=C12)C)O MCULE-2628046088 [0,2,0,0,0,0|2,0,0]=4 1613 B16R2.12021 CC(=O)NC1=C(NC2=CC=C(C=C12)Cl)O MCULE-1259305036 [0,2,0,0,0,0|2,0,0]=4 1614 B16R2.12021 CC1=C(C2=C(C1)C=CC(=C2)F)CC(=O)O MCULE-5441785746 [0,2,0,0,0,0|2,0,0]=4 1615 B16R2.12021 CC1=C(C2=C(N1)C=CC(=C2)Cl)CC(=O)O MCULE-8767692339 [0,2,0,0,0,0|1,0,0]=3 1616 B16R2.12021 CC1=C(C2=C(N1)C=CC(=C2)F)CC(=O)Cl MCULE-9611376819 [0,2,0,0,0,0|1,0,0]=3 1617 B16R2.12021 CC1=C(C2=C(N1)C=CC(=C2)O)CC(=O)O MCULE-9613804428 [0,2,0,0,0,0|1,0,0]=3 1618 B16R2.12021 CC1=C(C2=CC(=CC=C2N1)Br)CC(=O)O MCULE-4949681845 [0,2,0,0,0,0|1,0,0]=3 1619 B16R2.12021 CC1=C(C2=CC(=CC=C2N1)F)CC(=O)O MCULE-8380189353 [0,2,0,0,0,0|1,0,0]=3 1620 B16R2.12021 CC1=CC2=C(C=C1)NC(=C2CC(=O)O)C MCULE-4762505446 [0,2,0,0,0,0|1,0,0]=3 1621 B16R2.12021 CC1=CC=C2NC(=O)C(C2=C1)CC(=O)O MCULE-8124780610 [0,2,0,0,0,0|1,0,1]=4 1622 B16R2.12021 NC(=O)CC1=C(OC2=CC=C(C=C12)F)Br MCULE-9561005690 [0,2,0,0,0,0|1,0,0]=3 1623 B16R2.12021 NC(=S)CC1=C(SC2=CC=C(C=C12)Cl)Cl MCULE-8468582914 [0,2,0,0,0,0|1,1,0]=4 1624 B16R2.12021 O=C(O)CC1=C(OC2=CC=C(C=C12)F)Br MCULE-7395616119 [0,2,0,0,0,0|2,0,0]=4 1625 B16R2.12021 O=C(O)CC1C(=O)NC2=C1C=C(C=C2)Br MCULE-3720217045 [0,2,0,0,0,0|1,0,1]=4 1626 B16R2.12021 O=C(O)CC1C(=O)NC2=C1C=C(C=C2)Cl MCULE-6379783971 [0,2,0,0,0,0|1,0,1]=4 1627 B16R2.12021 O=C(O)CC1C(=O)NC2=CC=C(C=C12)F MCULE-3325931898 [0,2,0,0,0,0|1,0,1]=4 1628 B16R2.12021 O=C(O)CN1C(=O)NC2=C1C=C(C=C2)F MCULE-1707257859 [0,2,0,0,0,0|2,0,0]=4 1629 B16R2.22910 O=C(O)CN1C(=O)NC2=CC=CC(=C12)F MCULE-7730987257 [0,2,0,0,0,0|2,0,0]=4 1630 B16R2.44951 CC(=O)C=C1C(=O)N(C2=CC=CC=C12)C MCULE-8013713200 [0,2,0,0,0,0|1,0,1]=4 1631 B16R2.44951 CC(=O)C[N+]1=C(N(C2=C1C=CC=C2)N)N MCULE-3708931674 [0,2,0,0,0,0|2,0,0]=4 1632 B16R2.44951 CC(=O)C[N+]1=C(N(C2=C1C=CC=C2)N)N MCULE-6705842602 [0,2,0,0,0,0|2,0,0]=4 1633 B16R2.44951 CC1=C(C2=C(N1C)C=CC=C2)CC(=O)O MCULE-9689262187 [0,2,0,0,0,0|1,0,0]=3 1634 B16R2.44951 CC1=C(C2=CC=CC=C2N1C)CC(C)N MCULE-8977441084 [0,2,0,0,0,0|1,0,1]=4 1635 B16R2.44951 CN1C(=N)N(C2=C1C=CC=C2)CC(=O)N MCULE-8471041583 [0,2,0,0,0,0|1,0,0]=3 1636 B16R2.44951 CN1C(=N)N(C2=C1C=CC=C2)CC(=O)O MCULE-6731549094 [0,2,0,0,0,0|2,0,0]=4 1637 B16R2.44951 CN1C(=N)N(C2=C1C=CC=C2)CC(=O)O MCULE-6948635818 [0,2,0,0,0,0|2,0,0]=4 1638 B16R2.44951 CN1C(=O)C(C2=C1C=CC=C2)CC(=O)O MCULE-4784739012 [0,2,0,0,0,0|1,0,1]=4 1639 B16R2.44951 CN1C(=O)N(C2=C1C=CC=C2)CC(=O)O MCULE-2959299069 [0,2,0,0,0,0|2,0,0]=4 1640 B16R2.44951 CN1C(=O)N(C2=CC=CC=C12)CC(=O)N MCULE-6585674667 [0,2,0,0,0,0|1,0,0]=3 1641 B16R2.44951 CN1C(=[NH2+])N(C2=C1C=CC=C2)CC(=O)N MCULE-9437948949 [0,2,0,0,0,0|1,0,0]=3 1642 B16R2.44951 CN1C(=[NH2+])N(C2=C1C=CC=C2)CC(=O)O MCULE-8364682986 [0,2,0,0,0,0|2,0,0]=4 1643 B16R2.44951 CN1C2=C(C=CC=C2)[N+](=C1N)CC(=O)N MCULE-1708208159 [0,2,0,0,0,0|1,0,0]=3 1644 B16R2.44951 CN1C2=C(C=CC=C2)[N+](=C1N)CC(=O)N MCULE-3852234096 [0,2,0,0,0,0|1,0,0]=3 1645 B16R2.44951 NC(=O)CN1C(=O)C(=O)C2=C1C=CC=C2 MCULE-8600773741 [0,2,0,0,0,0|2,0,0]=4 1646 B16R2.93202 CC1=C(C2=CC=CC(=C2N1)Cl)CC(=O)O MCULE-7338872975 [0,2,0,0,0,0|1,0,0]=3 1647 B16R2.93202 CC1=C(C2=CC=CC(=C2N1)F)CC(=O)O MCULE-7181079730 [0,2,0,0,0,0|1,0,0]=3 1648 B16R2.93202 CC1=C2NC(=C(C2=CC=C1)CC(=O)O)C MCULE-7393313492 [0,2,0,0,0,0|1,0,0]=3 1649 B16R2.93202 CC1=C2NC(=O)C(C2=CC=C1)CC(=O)O MCULE-6437266692 [0,2,0,0,0,0|1,0,1]=4 1650 B16R2.93202 O=C(O)CC1C(=O)NC2=C(C=CC=C12)Br MCULE-3857276443 [0,2,0,0,0,0|1,0,1]=4 1651 B16R2.93202 O=C(O)CC1C(=O)NC2=C(C=CC=C12)F MCULE-1485858044 [0,2,0,0,0,0|1,0,1]=4 1652 B16R2.93202 O=C(O)CN1C(=O)NC2=C1C=CC=C2F MCULE-8851703685 [0,2,0,0,0,0|2,0,0]=4 1653 B16R2.495 CC(C)(C(=O)O)C1=CNC2=CC=CC=C12 MCULE-7236703743 [0,2,0,0,0,0|1,0,0]=3 1654 B16R2.15550 CC1=CC2=C(C=C1)NC=C2C(=O)C(=O)O MCULE-1023323448 [0,2,0,0,0,0|1,0,1]=4 1655 B16R2.15550 NC(=O)C(=O)C1=CNC2=CC=C(C=C12)Br MCULE-1776489412 [0,2,0,0,0,0|0,0,1]=3 1656 B16R2.15550 O=C(O)C(=O)C1=CNC2=C1C=C(C=C2)Cl MCULE-1103045223 [0,2,0,0,0,0|1,0,1]=4 1657 B16R2.15550 O=C(O)C(=O)C1=CNC2=CC=C(C=C12)Br MCULE-6009643390 [0,2,0,0,0,0|1,0,1]=4 1658 B16R2.15550 O=C(O)C(=O)C1=CNC2=CC=C(C=C12)F MCULE-8705919923 [0,2,0,0,0,0|1,0,1]=4 1659 B16R2.22832 CC1=CC=CC2=C1NC=C2C(=O)C(=O)O MCULE-3300578987 [0,2,0,0,0,0|1,0,1]=4 1660 B16R2.22832 O=C(O)C(=O)C1=CNC2=C(C=CC=C12)Cl MCULE-7427154099 [0,2,0,0,0,0|1,0,1]=4 1661 B16R2.22832 O=C(O)C(=O)C1=CNC2=C1C=CC=C2Br MCULE-4457875261 [0,2,0,0,0,0|1,0,1]=4 1662 B16R2.22832 O=C(O)C(=O)C1=CNC2=C1C=CC=C2F MCULE-6418571175 [0,2,0,0,0,0|1,0,1]=4 1663 B16R2.104521 CC(C(=O)O)C1=CN(C2=C1C=CC=C2)C MCULE-6306789821 [0,2,0,0,0,0|1,0,0]=3 1664 B16R2.104521 CN1C=C(C2=C1C=CC=C2)C(=O)C(=O)N MCULE-6032095067 [0,2,0,0,0,0|0,0,1]=3 1665 B16R2.104521 CN1C=C(C2=C1C=CC=C2)C(=O)C(=O)O MCULE-9433877360 [0,2,0,0,0,0|1,0,1]=4 1666 B16R2.126921 CC1=C2C(=CC=C1)NC=C2C(=O)C(=O)O MCULE-8363527446 [0,2,0,0,0,0|1,0,1]=4 1667 B16R2.126921 O=C(O)C(=O)C1=CNC2=C1C(=CC=C2)Br MCULE-8650357595 [0,2,0,0,0,0|1,0,1]=4 1668 B16R2.126921 O=C(O)C(=O)C1=CNC2=C1C(=CC=C2)Cl MCULE-6889514691 [0,2,0,0,0,0|1,0,1]=4 1669 B16R2.126921 O=C(O)C(=O)C1=CNC2=CC=CC(=C12)F MCULE-2054145492 [0,2,0,0,0,0|1,0,1]=4 1670 B16R2.15549 CC(=O)NC1=CNC2=CC=C(C(=C12)Cl)Br MCULE-1568382692 [0,2,0,0,0,0|2,0,0]=4 1671 B16R2.15549 CC(=O)OC1=CNC2=CC=C(C(=C12)Cl)Br MCULE-7021148032 [0,2,0,0,0,0|2,0,0]=4 1672 B16R2.15549 CC1=C(C2=C(C=C1)NC=C2CC(=O)O)Br MCULE-9491568960 [0,2,0,0,0,0|1,0,0]=3 1673 B16R2.42567 CCC1=CC2=C(C=C1)NC=C2CC(=O)O MCULE-6001520163 [0,2,0,0,0,0|1,0,0]=3 1674 B16R2.42567 CCC1=CC=C2OC=C(C2=C1)CC(=O)N MCULE-6682829780 [0,2,0,0,0,0|1,0,0]=3 1675 B16R2.42567 CCC1=CC=C2OC=C(C2=C1)CC(=O)O MCULE-5885758404 [0,2,0,0,0,0|2,0,0]=4 1676 B16R2.42567 COC1=CC2=C(C=C1)NC=C2CC(=O)N MCULE-3391234212 [0,2,0,0,0,0|0,0,0]=2 1677 B16R2.42567 COC1=CC2=C(C=C1)NC=C2CC(=O)O MCULE-9997753194 [0,2,0,0,0,0|1,0,0]=3 1678 B16R2.42567 COC1=CC2=C(C=C1)NN=C2CC(=O)O MCULE-3956463264 [0,2,0,0,0,0|2,0,0]=4 1679 B16R2.42567 COC1=CC=C2NC=C(C2=C1)CC(C)N MCULE-9717144052 [0,2,0,0,0,0|1,0,1]=4 1680 B16R2.42567 COC1=CC=C2OC=C(C2=C1)CC(=O)O MCULE-4975434460 [0,2,0,0,0,0|2,0,0]=4 1681 B16R2.42567 N#CC1=CC2=C(C=C1)C=CN2CC(=O)N MCULE-3052711802 [0,2,0,0,0,0|2,0,0]=4 1682 B16R2.45232 CC1=CC(=CC2=C1NC=C2CC(=O)O)F MCULE-9216023002 [0,2,0,0,0,0|1,0,0]=3 1683 B16R2.45232 CC1=CC2=C(NC=C2CC(=O)O)C(=C1)Br MCULE-2052705554 [0,2,0,0,0,0|1,0,0]=3 1684 B16R2.45232 O=C(O)CC1=CNC2=C1C=C(C=C2Br)F MCULE-4550781312 [0,2,0,0,0,0|1,0,0]=3 1685 B16R2.45232 O=C(O)CC1=CNC2=C1C=C(C=C2Cl)F MCULE-2234339527 [0,2,0,0,0,0|1,0,0]=3 1686 B16R2.45232 O=C(O)CC1=CNC2=C1C=C(C=C2F)Br MCULE-6935980007 [0,2,0,0,0,0|1,0,0]=3 1687 B16R2.45232 O=C(O)CC1=CNC2=C1C=C(C=C2F)F MCULE-8421405640 [0,2,0,0,0,0|1,0,0]=3 1688 B16R2.97889 CC(=O)OC1=CN(C2=C1C=C(C=C2)Br)C MCULE-8043279096 [0,2,0,0,0,0|2,0,0]=4 1689 B16R2.97889 CC(N)CC1=CN(C2=C1C=C(C=C2)F)C MCULE-9932375132 [0,2,0,0,0,0|1,0,1]=4 1690 B16R2.97889 CC(N)CC1=CN(C2=CC=C(C=C12)F)C MCULE-4950137939 [0,2,0,0,0,0|1,0,1]=4 1691 B16R2.97889 CC1=CC=C2C(=C1)C(=CN2C)CC(C)N MCULE-5523270893 [0,2,0,0,0,0|1,0,1]=4 1692 B16R2.97889 CC1=CC=C2C(=C1)C(=CN2C)CC(C)N MCULE-8266203759 [0,2,0,0,0,0|1,0,1]=4 1693 B16R2.97889 CN1C=C(C2=CC(=CC=C12)F)CC(=O)O MCULE-5417970250 [0,2,0,0,0,0|1,0,0]=3 1694 B16R2.22914 CC1=C2C(=CC=C1)C(=CN2C)CC(C)N MCULE-5523625328 [0,2,0,0,0,0|1,0,1]=4 1695 B16R2.24324 CC1=CC=C(C2=C1NC=C2CC(=O)O)Br MCULE-9422493628 [0,2,0,0,0,0|1,0,0]=3 1696 B16R2.24324 O=C(O)CC1=CNC2=C1C(=CC=C2Br)Cl MCULE-5442711094 [0,2,0,0,0,0|1,0,0]=3 1697 B16R2.24324 O=C(O)CC1=CNC2=C1C(=CC=C2Br)F MCULE-8757920124 [0,2,0,0,0,0|1,0,0]=3 1698 B16R2.24324 O=C(O)CC1=CNC2=C1C(=CC=C2Cl)Cl MCULE-3850158869 [0,2,0,0,0,0|1,0,0]=3 1699 B16R2.24324 O=C(O)CC1=CNC2=C1C(=CC=C2F)Br MCULE-2998108545 [0,2,0,0,0,0|1,0,0]=3 1700 B16R2.24324 O=C(O)CC1=CNC2=C1C(=CC=C2F)Cl MCULE-9813146032 [0,2,0,0,0,0|1,0,0]=3 1701 B16R2.24324 O=C(O)CC1=CNC2=C1C(=CC=C2F)F MCULE-8714235392 [0,2,0,0,0,0|1,0,0]=3 1702 B16R2.36785 CCC1=C2NC=C(C2=CC=C1)CC(=O)O MCULE-9878259489 [0,2,0,0,0,0|1,0,0]=3 1703 B16R2.36785 COC1=C2NC=C(C2=CC=C1)CC(=O)C MCULE-5719662006 [0,2,0,0,0,0|1,0,0]=3 1704 B16R2.36785 COC1=C2OC=C(C2=CC=C1)CC(=O)O MCULE-7870256181 [0,2,0,0,0,0|2,0,0]=4 1705 B16R2.36785 COC1=CC=CC2=C1NC=C2CC(=O)O MCULE-3161112076 [0,2,0,0,0,0|1,0,0]=3 1706 B16R2.36851 COC1=C2C(=CC=C1)NC=C2OC(=O)C MCULE-5686075037 [0,2,0,0,0,0|2,0,0]=4 1707 B16R2.36851 COC1=C2C(=CNC2=CC=C1)CC(=O)C MCULE-8110245462 [0,2,0,0,0,0|1,0,0]=3 1708 B16R2.36851 COC1=C2C(=CNC2=CC=C1)CC(=O)O MCULE-8704760247 [0,2,0,0,0,0|1,0,0]=3 1709 B16R2.36851 N#CC1=CC=CC2=C1C(=CN2)CC(=O)O MCULE-5823568639 [0,2,0,0,0,0|1,0,0]=3 1710 B16R2.75436 CCN1C=C(C2=C1C=CC=C2)CC(=O)O MCULE-1897380721 [0,2,0,0,0,0|1,0,0]=3 1711 B16R2.75436 CCN1C=C(C2=CC=CC=C12)CC(C)N MCULE-6607170541 [0,2,0,0,0,0|1,0,1]=4 1712 B16R2.75436 CCN1C=C(C2=CC=CC=C12)CC(C)N MCULE-9492380703 [0,2,0,0,0,0|1,0,1]=4 1713 B16R2.75436 N#CC1=CN(C2=C1C=CC=C2)CC(=O)N MCULE-8422562928 [0,2,0,0,0,0|2,0,0]=4 1714 B16R2.75436 NC(=O)CN1C=C(C2=CC=CC=C12)C=O MCULE-4225582006 [0,2,0,0,0,0|2,0,0]=4 1715 B14R2.450 CN1C(=CC2=CC=CC=C12)C(=O)N MCULE-9186583687 [0,0,1,1,0,0|0,0,2]=4 1716 B14R2.781 NC(=O)C1=CC2=C(C=CC=C2)C=C1 MCULE-6174673409 [0,0,1,1,0,0|1,0,1]=4 1717 B14R2.781 NC(=O)C1=CC2=CC=CC=C2N=C1 MCULE-1251683213 [0,0,1,1,0,0|0,0,2]=4 1718 B14R2.781 NC(=O)C1CNC2=C(C1)C=CC=C2 MCULE-9617431368 [0,0,1,1,0,0|0,0,2]=4 1719 B14R2.781 NC(=O)C1CNC2=C(O1)C=CC=C2 MCULE-2961715242 [0,0,1,1,0,0|1,0,1]=4 1720 B14R2.256 NC1=C(C=CC=C1)C2=NNC(=O)O2 MCULE-9518145396 [0,0,1,1,0,0|2,0,0]=4 1721 B14R2.256 O=C1CC(=NN1)C2=C(C=CC=C2)O MCULE-4850323466 [0,0,1,1,0,0|2,0,0]=4 1722 B14R2.19 O=C1CS/C(=N/C2=CC=CC=C2)/N1 MCULE-1850852468 [0,0,1,1,0,0|1,0,1]=4 1723 B14R2.19 O=C1CSC(=N1)NC2=CC=CC=C2 MCULE-3329101058 [0,0,1,1,0,0|1,0,1]=4 1724 B14R2.21 O=C1C=CC=C(N1)C2=CC=CC=C2 MCULE-3378297584 [0,0,1,1,0,0|1,0,1]=4 1725 B14R2.21 O=C1CCCN(N1)C2=CC=CC=C2 MCULE-1204287426 [0,0,1,1,0,0|0,0,2]=4 1726 B14R2.31359 NC(=O)C1=CC=CC2=C1C=CC=C2 MCULE-5769562616 [0,0,1,1,0,0|1,0,1]=4 1727 B14R2.31359 NC(=O)C1=CC=NC2=CC=CC=C12 MCULE-9133730215 [0,0,1,1,0,0|0,0,2]=4 1728 B14R2.31359 NC(=O)C1CCNC2=C1C=CC=C2 MCULE-3988453690 [0,0,1,1,0,0|0,0,2]=4 1729 B14R2.768 NC(=S)CC1=CN2C=CC=CC2=N1 MCULE-8690911535 [0,0,1,1,0,0|1,1,0]=4 1730 B14R2.768 O=C(O)CC1=CN2C=CC=CC2=N1 MCULE-1678874638 [0,0,1,1,0,0|2,0,0]=4 1731 B14R2.768 O=C(O)CC1=CN2C=CC=CC2=N1 MCULE-3871800479 [0,0,1,1,0,0|2,0,0]=4 1732 B14R2.768 O=C(O)CC1=NN2C=CC=CC2=C1 MCULE-7592207652 [0,0,1,1,0,0|2,0,0]=4 1733 B14R2.598 NC1=NC(=C(S1)C2=CC=CC=C2)N MCULE-1240660911 [0,0,1,1,0,0|2,0,0]=4 1734 B14R2.598 NC1=NC(=C(S1)C2=CC=CC=C2)N MCULE-4665091800 [0,0,1,1,0,0|2,0,0]=4 1735 B14R2.598 O=C1C=C(C(=O)N1)C2=CC=CC=C2 MCULE-2828609657 [0,0,1,1,0,0|1,0,1]=4 1736 B14R2.598 O=C1CC(C(=O)N1)C2=CC=CC=C2 MCULE-2407232261 [0,0,1,1,0,0|1,0,1]=4 1737 B14R2.598 O=C1CN(C(=O)N1)C2=CC=CC=C2 MCULE-7775529135 [0,0,1,1,0,0|2,0,0]=4 1738 B14R2.598 O=C1CN(C(=S)N1)C2=CC=CC=C2 MCULE-4695567195 [0,0,1,1,0,0|2,0,0]=4 1739 B14R2.1146 NCC1=CC(=O)NC2=C1C=CC=C2 MCULE-8162042910 [0,0,1,1,0,0|0,0,2]=4 1740 B14R2.1146 NCC1=CC(=O)NC2=C1C=CC=C2 MCULE-9697266563 [0,0,1,1,0,0|0,0,2]=4 1741 B14R2.4586 CC1=C(C1C(=O)N)C2=CC=CC=C2 MCULE-2390983734 [0,0,1,1,0,0|1,0,0]=3 1742 B14R2.4586 CC1=C(C1C(=O)O)C2=CC=CC=C2 MCULE-7914632483 [0,0,1,1,0,0|2,0,0]=4 1743 B14R2.9440 CC(=O)OC1=C2NC=CC2=CC=C1 MCULE-4014270069 [0,0,1,1,0,0|2,0,0]=4 1744 B14R2.9440 NC(=S)NC1=C2NC=CC2=CC=C1 MCULE-1187801984 [0,0,1,1,0,0|1,1,0]=4 1745 B14R2.9440 O=C(O)CC1=CC=CC2=C1NC=C2 MCULE-8841130576 [0,0,1,1,0,0|1,0,0]=3 1746 B14R3.49 C1=CC2=C(C=C1)C3=C(N2)CNC3 MCULE-7964694827 [1,0,0,1,0,0|2,0,0]=4 1747 B14R3.49 C1=CC=C2C(=C1)NC3=C2CCC3 MCULE-5827398027 [1,0,0,1,0,0|1,0,1]=4 1748 B14R3.49 C1=CC=C2C(=C1)NC3=C2CNC3 MCULE-3868380732 [1,0,0,1,0,0|2,0,0]=4 1749 B16R3.2637 NC1=CC2=C(C=C1)C3=CC=CC=C3N2 MCULE-6046693396 [0,0,0,1,0,1|1,0,1]=4 1750 B16R3.2637 NC1=CC=C2C(=N1)NC3=C2C=CC=C3 MCULE-7770737025 [0,0,0,1,0,1|1,0,1]=4 1751 B16R3.2637 NC1=NC2=C(N=N1)C3=CC=CC=C3N2 MCULE-3634381393 [0,0,0,1,0,1|2,0,0]=4 1752 B16R3.2637 NC1CCC2=C(C1)NC3=C2C=CC=C3 MCULE-7431006251 [0,0,0,1,0,1|1,0,1]=4 1753 B16R3.2637 O=C1CC2=C(CN1)C3=C(N2)C=CC=C3 MCULE-3979644775 [0,0,0,1,0,1|1,0,0]=3 1754 B16R3.2637 O=C1CCC2=C(C1)NC3=C2C=CC=C3 MCULE-1954151692 [0,0,0,1,0,1|1,0,0]=3 1755 B16R3.2637 O=C1N=C2NC3=CC=CC=C3C2=NN1 MCULE-4521836550 [0,0,0,1,0,1|1,0,1]=4 1756 B16R3.17569 O=C1CCC2=CNC3=C2C(=CC=C3)N1 MCULE-1424890738 [0,0,0,1,0,1|0,0,0]=2 1757 B16R3.335 O=C1CC2=C(O1)C3=C(C=CC=C3)C=C2 MCULE-4027347130 [0,0,0,1,0,1|2,0,0]=4 1758 B16R3.2273 O=C1CC2SC3=C(C=CC=C3)N=C2N1 MCULE-2724993025 [0,0,0,1,0,1|0,0,2]=4 1759 B16R3.2273 O=C1NC2=C(O1)C=C3C=CC=CC3=C2 MCULE-7571257344 [0,0,0,1,0,1|2,0,0]=4 1760 B16R3.2273 O=C1NC2=CC3=CC=CC=C3C=C2N1 MCULE-7416103827 [0,0,0,1,0,1|2,0,0]=4 1761 B16R3.2583 NC1=CC2=C(C=C1)NC3=CC=CC=C23 MCULE-5800187400 [0,1,0,1,0,0|1,0,1]=4 1762 B16R3.2583 NC1=CC2=C(C=N1)NC3=C2C=CC=C3 MCULE-7441317947 [0,1,0,1,0,0|1,0,1]=4 1763 B16R3.2583 NC1CCC2=C(C1)C3=CC=CC=C3N2 MCULE-3649161710 [0,1,0,1,0,0|1,0,1]=4 1764 B16R3.2583 NC1CCC2=C(C1)C3=CC=CC=C3N2 MCULE-4789002335 [0,1,0,1,0,0|1,0,1]=4 1765 B16R3.2583 N[C@@H]1CCC2=C(C1)C3=C(N2)C=CC=C3 MCULE-2153037710 [0,1,0,1,0,0|1,0,1]=4 1766 B16R3.2583 N[C@@H]1CCC2=C(C1)C3=CC=CC=C3N2 MCULE-1614449060 [0,1,0,1,0,0|1,0,1]=4 1767 B16R3.2583 N[C@H]1CCC2=C(C1)C3=CC=CC=C3N2 MCULE-4777384764 [0,1,0,1,0,0|1,0,1]=4 1768 B16R3.2583 N[C@H]1CCC2=C(C1)C3=CC=CC=C3N2 MCULE-8998431018 [0,1,0,1,0,0|1,0,1]=4 1769 B16R3.2583 O=C1CCC2=C(C1)C3=C(N2)C=CC=C3 MCULE-6291596002 [0,1,0,1,0,0|1,0,0]=3 1770 B16R3.2583 O=C1CN2C(=NN1)SC3=C2C=CC=C3 MCULE-7348634644 [0,1,0,1,0,0|2,0,0]=4 1771 B16R3.2583 O=C1CN2C3=CC=CC=C3N=C2CN1 MCULE-6444267496 [0,1,0,1,0,0|1,0,1]=4 1772 B16R3.12359 NC1(CC1)CC2=CNC3=C2C=CC=C3 MCULE-6986158134 [0,1,0,1,0,0|1,0,1]=4 1773 B16R3.12359 NC1(CC1)CC2=CNC3=C2C=CC=C3 MCULE-9324862197 [0,1,0,1,0,0|1,0,1]=4 1774 B16R3.26868 CN1C(=O)CN2C1=NC3=C2C=CC=C3 MCULE-2347238455 [0,1,0,1,0,0|1,0,1]=4 1775 B16R3.34961 O=C1CC2=COC3=C2C(=CC(=C3)O)O1 MCULE-9828939463 [0,1,0,1,0,0|2,0,0]=4 1776 B16R3.18423 CC1=CC2=C(C=C1)NC3=C2CC(C3)N MCULE-2089968926 [0,1,0,1,0,0|1,0,1]=4 1777 B16R3.18423 NC1CC2=C(C1)C3=C(N2)C=CC(=C3)Br MCULE-6659664332 [0,1,0,1,0,0|1,0,1]=4 1778 B16R3.13500 CN1C2=NC(=O)CN2C3=C1C=CC=C3 MCULE-7937441587 [0,1,0,1,0,0|1,0,1]=4 1779 B12R1.75 C#CC1=CC=CC=C1CC(=O)N MCULE-7637904994 [0,0,1,0,1,0|1,0,1]=4 1780 B12R1.75 CNC1=CC=CC=C1CC(=O)O MCULE-1576819013 [0,0,1,0,1,0|1,0,1]=4 1781 B12R1.75 COC1=C(C=CC=C1)CC(=O)N MCULE-6898916619 [0,0,1,0,1,0|1,0,1]=4 1782 B12R1.124 NC1=C(C=CC=C1)C(=O)C(=O)O MCULE-2520363952 [0,0,1,0,1,0|2,0,0]=4 1783 B12R1.124 NC1=C(C=CC=C1)C(=O)C(=O)[O-] MCULE-5103126572 [0,0,1,0,1,0|2,0,0]=4 1784 B12R1.252 CC(=O)/C=C/NC1=CC=CC=C1 MCULE-3845007734 [0,0,1,0,1,0|1,0,0]=3 1785 B12R1.252 CC(=O)/C=N/NC1=CC=CC=C1 MCULE-5921354185 [0,0,1,0,1,0|2,0,0]=4 1786 B12R1.252 CC(=O)C=CNC1=CC=CC=C1 MCULE-8741762191 [0,0,1,0,1,0|1,0,0]=3 1787 B12R1.252 CC(=O)C=CSC1=CC=CC=C1 MCULE-3075772886 [0,0,1,0,1,0|2,0,0]=4 1788 B12R1.252 CC(=O)C=NNC1=CC=CC=C1 MCULE-7716405419 [0,0,1,0,1,0|2,0,0]=4 1789 B12R1.252 NC(=O)CCCC1=CC=CC=C1 MCULE-1491500210 [0,0,1,0,1,0|0,0,2]=4 1790 B12R1.252 NC(=O)CCNC1=CC=CC=C1 MCULE-4122162754 [0,0,1,0,1,0|0,0,1]=3 1791 B12R1.252 NC(=O)CCOC1=CC=CC=C1 MCULE-9532260813 [0,0,1,0,1,0|1,0,1]=4 1792 B12R1.252 NC(=O)CNCC1=CC=CC=C1 MCULE-6930976713 [0,0,1,0,1,0|1,0,1]=4 1793 B12R1.252 NC(=O)COCC1=CC=CC=C1 MCULE-2043276412 [0,0,1,0,1,0|1,0,1]=4 1794 B12R1.252 NC(=O)CSCC1=CC=CC=C1 MCULE-6240151575 [0,0,1,0,1,0|1,0,1]=4 1795 B12R1.252 NC(=O)N/N=C/C1=CC=CC=C1 MCULE-5380651128 [0,0,1,0,1,0|2,0,0]=4 1796 B12R1.252 NC(=O)NN=CC1=CC=CC=C1 MCULE-9554768962 [0,0,1,0,1,0|2,0,0]=4 1797 B12R1.252 O=C(O)C/C=C/C1=CC=CC=C1 MCULE-5944027373 [0,0,1,0,1,0|1,0,0]=3 1798 B12R1.252 O=C(O)C=CCC1=CC=CC=C1 MCULE-5534408884 [0,0,1,0,1,0|2,0,0]=4 1799 B12R1.252 O=C(O)C=CSC1=CC=CC=C1 MCULE-6409148074 [0,0,1,0,1,0|2,0,0]=4 1800 B12R1.252 O=C(O)CC=CC1=CC=CC=C1 MCULE-4504838602 [0,0,1,0,1,0|1,0,0]=3 1801 B12R1.252 O=C(O)CCNC1=CC=CC=C1 MCULE-3569266068 [0,0,1,0,1,0|1,0,1]=4 1802 B12R1.252 O=C([O-])C=CSC1=CC=CC=C1 MCULE-6287638624 [0,0,1,0,1,0|2,0,0]=4 1803 B12R1.478 CC=C(C(=O)O)C1=CC=CC=C1 MCULE-1962975075 [0,0,1,0,1,0|2,0,0]=4 1804 B12R1.478 NC(=O)C(=NO)C1=CC=CC=C1 MCULE-7326838361 [0,0,1,0,1,0|2,0,0]=4 1805 B12R2.3190 O=C(O)C1=CC2=CC=CC=C12 MCULE-4865410555 [0,0,0,0,2,0|1,0,0]=3 1806 B14R1.160 CC(=NNC(=O)N)C1=C(C=CC=C1)N MCULE-4958722554 [0,0,1,0,0,1|1,0,1]=4 1807 B14R1.160 CC(=O)COC(=O)C1=CC=CC=C1N MCULE-1132914706 [0,0,1,0,0,1|2,0,0]=4 1808 B14R1.160 NC1=C(C=CC=C1)C(=O)NCC(=O)O MCULE-6337040358 [0,0,1,0,0,1|2,0,0]=4 1809 B14R1.160 NC1=C(C=CC=C1)C(=O)NCC(=O)O MCULE-7892803957 [0,0,1,0,0,1|2,0,0]=4 1810 B14R1.160 NC1=C(C=CC=C1)C(=O)NCC(=O)[O-] MCULE-1208767346 [0,0,1,0,0,1|2,0,0]=4 1811 B14R1.422 NC(=O)NN=CC=CC1=CC=CC=C1 MCULE-8111238032 [0,0,1,0,0,1|2,0,0]=4 1812 B14R1.540 NN=C(CCC(=O)O)C1=CC=CC=C1 MCULE-6558474133 [0,0,1,0,0,1|2,0,0]=4 1813 B14R2.112 C=CCC1=CC2=C(C=CC=C2)C=C1 MCULE-5963318455 [1,0,0,0,0,1|2,0,0]=4 1814 B14R2.112 C=CCC1=NC2=C(C=CC=C2)C=C1 MCULE-5584366442 [1,0,0,0,0,1|2,0,0]=4 1815 B14R2.112 NCCC1=CC2=C(C=CC=C2)N=C1 MCULE-5305422283 [1,0,0,0,0,1|0,0,2]=4 1816 B14R2.112 NCCC1=CC2=CC=CC=C2C=C1 MCULE-3378750006 [1,0,0,0,0,1|1,0,1]=4 1817 B14R2.112 NCCC1=CC2=CC=CC=C2C=C1 MCULE-5409569236 [1,0,0,0,0,1|1,0,1]=4 1818 B14R2.112 NCCC1=CC=C2C=CC=CC2=C1 MCULE-4900551077 [1,0,0,0,0,1|1,0,1]=4 1819 B14R2.112 NCCC1=CC=C2C=CC=CC2=C1 MCULE-6212278905 [1,0,0,0,0,1|1,0,1]=4 1820 B14R2.112 NCCC1=CN=C2C=CC=CC2=C1 MCULE-3315245214 [1,0,0,0,0,1|0,0,2]=4 1821 B14R2.112 NCCC1=NC2=C(C=CC=C2)C=C1 MCULE-4011839049 [1,0,0,0,0,1|1,0,1]=4 1822 B14R2.112 NCCC1=NC2=CC=CC=C2C=C1 MCULE-1523795787 [1,0,0,0,0,1|1,0,1]=4 1823 B14R2.112 NNCC1=CC2=CC=CC=C2C=C1 MCULE-2813930960 [1,0,0,0,0,1|2,0,0]=4 1824 B14R2.112 NNCC1=CC2=CC=CC=C2C=C1 MCULE-8655074368 [1,0,0,0,0,1|2,0,0]=4 1825 B14R2.112 NNCC1=NC2=C(C=CC=C2)C=C1 MCULE-5470819888 [1,0,0,0,0,1|2,0,0]=4 1826 B14R2.112 NNCC1=NC2=C(C=CC=C2)C=C1 MCULE-5636943843 [1,0,0,0,0,1|2,0,0]=4 1827 B14R2.112 NOCC1=CC2=C(C=CC=C2)C=C1 MCULE-5513146028 [1,0,0,0,0,1|2,0,0]=4 1828 B14R2.112 NOCC1=CC=C2C=CC=CC2=C1 MCULE-8313809264 [1,0,0,0,0,1|2,0,0]=4 1829 B14R2.112 O=CCC1=CC2=CC=CC=C2C=C1 MCULE-5357752177 [1,0,0,0,0,1|1,0,0]=3 1830 B14R2.112 O=CCC1=CC2=CC=CC=C2N=C1 MCULE-2401682082 [1,0,0,0,0,1|0,0,1]=3 1831 B14R2.112 O=CCC1=CC2=CC=CN=C2C=C1 MCULE-1345486440 [1,0,0,0,0,1|2,0,0]=4 1832 B14R2.112 O=CCC1=CC=C2C=CC=CC2=N1 MCULE-1559394180 [1,0,0,0,0,1|1,0,0]=3 1833 B14R2.112 O=CNC1=CC2=CC=CC=C2C=C1 MCULE-9463576276 [1,0,0,0,0,1|2,0,0]=4 1834 B14R2.7150 C=CCC1=C2C=CC=CC2=CN=C1 MCULE-4794385904 [1,0,0,0,0,1|1,0,1]=4 1835 B14R2.7150 C=CCC1=CC=CC2=C1C=CC=C2 MCULE-3947882115 [1,0,0,0,0,1|2,0,0]=4 1836 B14R2.7150 NCCC1=C2C=CC=CC2=CC=C1 MCULE-2417695210 [1,0,0,0,0,1|1,0,1]=4 1837 B14R2.7150 NCCC1=C2C=CC=CC2=NC=C1 MCULE-7771610172 [1,0,0,0,0,1|0,0,2]=4 1838 B14R2.7150 NCCC1=CC=CC2=CC=CC=C12 MCULE-1820362379 [1,0,0,0,0,1|1,0,1]=4 1839 B14R2.7150 NNCC1=C2C=CC=CC2=CC=C1 MCULE-1673802481 [1,0,0,0,0,1|2,0,0]=4 1840 B14R2.7150 NNCC1=C2C=CC=CC2=CC=C1 MCULE-2103344839 [1,0,0,0,0,1|2,0,0]=4 1841 B14R2.7150 NNCC1=CC=CC2=CC=CC=C12 MCULE-8655251485 [1,0,0,0,0,1|2,0,0]=4 1842 B14R2.7150 NOCC1=C2C=CC=CC2=CC=C1 MCULE-5765178678 [1,0,0,0,0,1|2,0,0]=4 1843 B14R2.7150 NOCC1=C2C=CC=CC2=CC=C1 MCULE-8005682023 [1,0,0,0,0,1|2,0,0]=4 1844 B14R2.7150 NOCC1=C2C=CC=CC2=NC=C1 MCULE-7697177336 [1,0,0,0,0,1|1,0,1]=4 1845 B14R2.7150 NOCC1=CC=NC2=CC=CC=C12 MCULE-1533146115 [1,0,0,0,0,1|1,0,1]=4 1846 B14R2.7150 O=CCC1=C2N=CC=CC2=CC=C1 MCULE-5552361374 [1,0,0,0,0,1|2,0,0]=4 1847 B14R2.7150 O=CCC1=CC=CC2=C1C=CC=N2 MCULE-9861310921 [1,0,0,0,0,1|2,0,0]=4 1848 B14R2.7150 O=CCC1=CC=CC2=CC=CC=C12 MCULE-1619468673 [1,0,0,0,0,1|1,0,0]=3 1849 B14R2.7150 O=CCC1=CC=NC2=CC=CC=C12 MCULE-3265411857 [1,0,0,0,0,1|0,0,1]=3 1850 B14R2.7150 O=CNC1=CC=CC2=CC=CC=C12 MCULE-1084960829 [1,0,0,0,0,1|2,0,0]=4 1851 B14R2.7150 O=NC=C1C=CNC2=C1C=CC=C2 MCULE-1384425860 [1,0,0,0,0,1|1,0,1]=4 1852 B16R2.36 CC(=O)NCCC1=CNC2=C1C=CC=C2 MCULE-3484861085 [0,0,0,0,0,2|1,0,0]=3 1853 B16R2.36 CC(=O)NN=CC1=CNC2=C1C=CC=C2 MCULE-5420752814 [0,0,0,0,0,2|1,0,1]=4 1854 B16R2.36 CC(=O)OCCC1=CNC2=C1C=CC=C2 MCULE-8819515006 [0,0,0,0,0,2|1,0,0]=3 1855 B16R2.36 N=C(N)NN=CC1=CNC2=CC=CC=C12 MCULE-2913368451 [0,0,0,0,0,2|1,0,1]=4 1856 B16R2.36 NC(=O)CCCC1=CNC2=C1C=CC=C2 MCULE-7880098416 [0,0,0,0,0,2|0,0,0]=2 1857 B16R2.36 NC(=O)CSCC1=CNC2=CC=CC=C12 MCULE-2182477897 [0,0,0,0,0,2|0,0,0]=2 1858 B16R2.36 NC(=O)NCCC1=CNC2=CC=CC=C12 MCULE-5405095437 [0,0,0,0,0,2|0,0,0]=2 1859 B16R2.36 NC(=O)NN=CC1=CNC2=C1C=CC=C2 MCULE-3098683675 [0,0,0,0,0,2|0,0,1]=3 1860 B16R2.36 NC(=S)CCCC1=CNC2=C1C=CC=C2 MCULE-9048575666 [0,0,0,0,0,2|0,1,0]=3 1861 B16R2.36 NC(=S)N/N=C/C1=CNC2=C1C=CC=C2 MCULE-7722492449 [0,0,0,0,0,2|0,1,1]=4 1862 B16R2.36 NC(=S)NCCC1=CNC2=CC=CC=C12 MCULE-5137799018 [0,0,0,0,0,2|0,1,0]=3 1863 B16R2.36 NC(=S)NN=CC1=CNC2=C1C=CC=C2 MCULE-5795275015 [0,0,0,0,0,2|0,1,1]=4 1864 B16R2.36 O=C(Cl)CCCC1=CNC2=CC=CC=C12 MCULE-5202346383 [0,0,0,0,0,2|1,0,0]=3 1865 B16R2.36 O=C(O)CCCC1=CNC2=CC=CC=C12 MCULE-1997278353 [0,0,0,0,0,2|1,0,0]=3 1866 B16R2.36 O=C(O)CCCC1=CSC2=C1C=CC=C2 MCULE-5867337649 [0,0,0,0,0,2|2,0,0]=4 1867 B16R2.36 O=C(O)CCSC1=CNC2=C1C=CC=C2 MCULE-1489776866 [0,0,0,0,0,2|1,0,0]=3 1868 B16R2.36 O=C(O)CSCC1=CNC2=CC=CC=C12 MCULE-1572443329 [0,0,0,0,0,2|1,0,0]=3 1869 B16R2.36 O=C([O-])CCCC1=CNC2=C1C=CC=C2 MCULE-4353856647 [0,0,0,0,0,2|1,0,0]=3 1870 B16R2.477 CC(=O)CSC1=NC2=C(C=CC=C2)C=C1 MCULE-7247358587 [0,0,0,0,0,2|2,0,0]=4 1871 B16R2.477 CC(=O)CSC1=[NH+]C2=CC=CC=C2C=C1 MCULE-2133006188 [0,0,0,0,0,2|2,0,0]=4 1872 B16R2.477 CC(=O)OCC1=CC=C2C=CC=CC2=C1 MCULE-6765739129 [0,0,0,0,0,2|2,0,0]=4 1873 B16R2.477 N=C(N)SCC1=CC2=C(C=CC=C2)C=C1 MCULE-7738059334 [0,0,0,0,0,2|2,0,0]=4 1874 B16R2.477 N=C(N)SCC1=CC2=CC=CC=C2C=C1 MCULE-1711344135 [0,0,0,0,0,2|2,0,0]=4 1875 B16R2.477 NC(=O)COC1=CC2=C(C=CC=C2)C=C1 MCULE-7673773890 [0,0,0,0,0,2|1,0,0]=3 1876 B16R2.477 NC(=O)CSC1=CC2=CC=CC=C2C=C1 MCULE-4007125842 [0,0,0,0,0,2|1,0,0]=3 1877 B16R2.477 NC(=O)CSC1=NC2=CC=CC=C2C=C1 MCULE-2362556687 [0,0,0,0,0,2|1,0,0]=3 1878 B16R2.477 NC(=S)COC1=CC=C2C=CC=CC2=C1 MCULE-3067484776 [0,0,0,0,0,2|1,1,0]=4 1879 B16R2.477 O=C(Cl)COC1=CC2=C(C=CC=C2)C=C1 MCULE-2433654188 [0,0,0,0,0,2|2,0,0]=4 1880 B16R2.477 O=C(O)CCC1=CC2=C(C=CC=C2)C=C1 MCULE-2576748975 [0,0,0,0,0,2|2,0,0]=4 1881 B16R2.477 O=C(O)CCC1=CC2=C(C=CC=C2)N=C1 MCULE-1008565666 [0,0,0,0,0,2|1,0,1]=4 1882 B16R2.477 O=C(O)CCC1=NC2=C(C=CC=C2)C=C1 MCULE-7965912465 [0,0,0,0,0,2|2,0,0]=4 1883 B16R2.477 O=C(O)CCC1=NC2=CC=CC=C2N=C1 MCULE-2777540649 [0,0,0,0,0,2|1,0,1]=4 1884 B16R2.477 O=C(O)CNC1=CC=C2C=CC=CC2=C1 MCULE-1725837215 [0,0,0,0,0,2|2,0,0]=4 1885 B16R2.477 O=C(O)COC1=CC2=CC=CC=C2C=C1 MCULE-2200583599 [0,0,0,0,0,2|2,0,0]=4 1886 B16R2.477 O=C(O)COC1=CN=C2C=CC=CC2=N1 MCULE-1294704493 [0,0,0,0,0,2|1,0,1]=4 1887 B16R2.477 O=C(O)CSC1=CC=C2C=CC=CC2=C1 MCULE-6862066159 [0,0,0,0,0,2|2,0,0]=4 1888 B16R2.477 O=C(O)CSC1=CN=C2C=CC=CC2=N1 MCULE-7021051755 [0,0,0,0,0,2|1,0,1]=4 1889 B16R2.477 O=C(O)CSC1=NC2=CC=CC=C2C=C1 MCULE-2054471536 [0,0,0,0,0,2|2,0,0]=4 1890 B16R2.477 O=C([O-])COC1=CC=C2C=CC=CC2=C1 MCULE-1163859335 [0,0,0,0,0,2|2,0,0]=4 1891 B16R2.477 O=C([O-])CSC1=NC2=C(C=CC=C2)C=C1 MCULE-5755579547 [0,0,0,0,0,2|2,0,0]=4 1892 B16R2.179941 CC(=O)CCC1=C2C=CC=CC2=CC=C1 MCULE-8933922318 [0,0,0,0,0,2|2,0,0]=4 1893 B16R2.179941 CC(=O)CCC1=C2C=CC=CC2=CN=C1 MCULE-6509347005 [0,0,0,0,0,2|1,0,1]=4 1894 B16R2.179941 CC(=O)CSC1=C2C=CC=CC2=NC=N1 MCULE-8648282379 [0,0,0,0,0,2|1,0,1]=4 1895 B16R2.179941 N=C(N)NCC1=C2C=CC=CC2=CC=C1 MCULE-9268146293 [0,0,0,0,0,2|2,0,0]=4 1896 B16R2.179941 N=C(N)NCC1=CC=NC2=CC=CC=C12 MCULE-4344653138 [0,0,0,0,0,2|1,0,1]=4 1897 B16R2.179941 N=C(N)SCC1=C2C=CC=CC2=CC=C1 MCULE-5790648587 [0,0,0,0,0,2|2,0,0]=4 1898 B16R2.179941 N=C(N)SCC1=C2C=CC=CC2=CC=C1 MCULE-8310176878 [0,0,0,0,0,2|2,0,0]=4 1899 B16R2.179941 NC(=NCC1=C2C=CC=CC2=NC=C1)N MCULE-1913439392 [0,0,0,0,0,2|1,0,1]=4 1900 B16R2.179941 NC(=O)CCC1=CC=CC2=CC=CC=C12 MCULE-1931911212 [0,0,0,0,0,2|1,0,0]=3 1901 B16R2.179941 NC(=O)CNC1=C2C=CC=CC2=NC=N1 MCULE-6210658307 [0,0,0,0,0,2|0,0,1]=3 1902 B16R2.179941 NC(=O)COC1=C2C=CC=CC2=CC=C1 MCULE-6531841643 [0,0,0,0,0,2|1,0,0]=3 1903 B16R2.179941 NC(=O)COC1=C2N=CC=CC2=CC=C1 MCULE-5162892552 [0,0,0,0,0,2|2,0,0]=4 1904 B16R2.179941 NC(=O)CSC1=C2C=CC=CC2=CN=N1 MCULE-8353741340 [0,0,0,0,0,2|1,0,1]=4 1905 B16R2.179941 NC(=O)CSC1=C2N=CC=CC2=CC=C1 MCULE-4406727033 [0,0,0,0,0,2|2,0,0]=4 1906 B16R2.179941 NC(=O)CSC1=NC=CC2=CC=CC=C12 MCULE-6768111493 [0,0,0,0,0,2|1,0,0]=3 1907 B16R2.179941 NC(=O)CSC1=NC=NC2=CC=CC=C12 MCULE-3133821098 [0,0,0,0,0,2|0,0,1]=3 1908 B16R2.179941 O=C(Cl)CCC1=CC=CC2=CC=CC=C12 MCULE-3633070188 [0,0,0,0,0,2|2,0,0]=4 1909 B16R2.179941 O=C(Cl)COC1=C2C=CC=CC2=CC=C1 MCULE-2455673531 [0,0,0,0,0,2|2,0,0]=4 1910 B16R2.179941 O=C(O)CCC1=C2C=CC=CC2=CC=C1 MCULE-6755596415 [0,0,0,0,0,2|2,0,0]=4 1911 B16R2.179941 O=C(O)CCC1=C2C=CC=CC2=CN=C1 MCULE-4075360632 [0,0,0,0,0,2|1,0,1]=4 1912 B16R2.179941 O=C(O)CCC1=C2C=CC=CC2=NC=C1 MCULE-1182257474 [0,0,0,0,0,2|1,0,1]=4 1913 B16R2.179941 O=C(O)CCC1=CCCC2=C1C=CC=C2 MCULE-3365793903 [0,0,0,0,0,2|2,0,0]=4 1914 B16R2.179941 O=C(O)CCC1=NC=NC2=CC=CC=C12 MCULE-8762925874 [0,0,0,0,0,2|1,0,1]=4 1915 B16R2.179941 O=C(O)CNC1=CC=CC2=C1C=CC=C2 MCULE-3493254762 [0,0,0,0,0,2|2,0,0]=4 1916 B16R2.179941 O=C(O)CNC1=NC=NC2=CC=CC=C12 MCULE-3120766562 [0,0,0,0,0,2|1,0,1]=4 1917 B16R2.179941 O=C(O)CNC1=[NH+]C=NC2=CC=CC=C12 MCULE-6414093657 [0,0,0,0,0,2|1,0,1]=4 1918 B16R2.179941 O=C(O)COC1=C2C=CC=CC2=CC=C1 MCULE-2007375815 [0,0,0,0,0,2|2,0,0]=4 1919 B16R2.179941 O=C(O)COC1=CC=NC2=C1C=CC=C2 MCULE-7950847031 [0,0,0,0,0,2|1,0,1]=4 1920 B16R2.179941 O=C(O)COC1=NC=NC2=C1C=CC=C2 MCULE-8759024337 [0,0,0,0,0,2|1,0,1]=4 1921 B16R2.179941 O=C(O)COC1=NC=NC2=CC=CC=C12 MCULE-1455020973 [0,0,0,0,0,2|1,0,1]=4 1922 B16R2.179941 O=C(O)CSC1=C2C=CC=CC2=CC=C1 MCULE-4972551873 [0,0,0,0,0,2|2,0,0]=4 1923 B16R2.179941 O=C(O)CSC1=NC=CC2=CC=CC=C12 MCULE-9011967010 [0,0,0,0,0,2|2,0,0]=4 1924 B16R2.179941 O=C(O)CSC1=NC=NC2=CC=CC=C12 MCULE-7493201034 [0,0,0,0,0,2|1,0,1]=4 1925 B16R2.179941 O=C([O-])CSC1=NC=CC2=CC=CC=C12 MCULE-2302071531 [0,0,0,0,0,2|2,0,0]=4