0 B12R1.283 C=CCC1=CC=CC=C1C(=O)N MCULE-9817782356 [0,0,0,0,0,0|1,0,2]=3 1 B12R1.283 C=CCC1=CC=CC=C1C(=O)O MCULE-1091378974 [0,0,0,0,0,0|2,0,2]=4 2 B12R1.283 CC(=O)C1=C(C=CC=C1)N=N#N MCULE-4846440270 [0,0,0,0,0,0|4,0,0]=4 3 B12R1.283 CC(=O)C1=CC=CC=C1CC#N MCULE-4707255814 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.283 CC(=O)C1=CC=CC=C1NC=O MCULE-7637587581 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.283 CCCC1=C(C=CC=C1)B(O)O MCULE-8508228210 [0,0,0,0,0,0|3,0,1]=4 6 B12R1.283 CCCC1=C(C=CC=C1)C(=O)O MCULE-8469879199 [0,0,0,0,0,0|2,0,0]=2 7 B12R1.283 CCCC1=C(C=NC=N1)C(=O)O MCULE-5950783587 [0,0,0,0,0,0|4,0,0]=4 8 B12R1.283 CCCC1=CC=CN=C1C(=O)O MCULE-7682254205 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.283 CCNC1=C(C=CC=C1)C(=O)O MCULE-5226367609 [0,0,0,0,0,0|2,0,0]=2 10 B12R1.283 CCNC1=C(C=CC=C1)N(=O)=O MCULE-7178422589 [0,0,0,0,0,0|3,0,0]=3 11 B12R1.283 CCNC1=C(C=NC=C1)N(=O)=O MCULE-3982328000 [0,0,0,0,0,0|4,0,0]=4 12 B12R1.283 CCNC1=CC=CN=C1C(=O)O MCULE-2828865660 [0,0,0,0,0,0|3,0,0]=3 13 B12R1.283 CCNC1=CC=CN=C1C(=O)O MCULE-5929167420 [0,0,0,0,0,0|3,0,0]=3 14 B12R1.283 CCNC1=CC=CN=C1N(=O)=O MCULE-3493713512 [0,0,0,0,0,0|4,0,0]=4 15 B12R1.283 CCNC1=NC=CC=C1C(=O)O MCULE-2120786961 [0,0,0,0,0,0|3,0,0]=3 16 B12R1.283 CCNC1=NC=CC=C1N(=O)=O MCULE-2038677159 [0,0,0,0,0,0|4,0,0]=4 17 B12R1.283 CCNC1=NC=CN=C1C(=O)N MCULE-4926942797 [0,0,0,0,0,0|3,0,0]=3 18 B12R1.283 CCOC1=C(C=CC=C1)C(=N)N MCULE-5922998663 [0,0,0,0,0,0|1,0,0]=1 19 B12R1.283 CCOC1=C(C=CC=C1)C(=N)N MCULE-7041745200 [0,0,0,0,0,0|1,0,0]=1 20 B12R1.283 CCOC1=C(C=CC=C1)C(=O)C MCULE-1751068861 [0,0,0,0,0,0|1,0,0]=1 21 B12R1.283 CCOC1=C(C=CC=C1)C(=S)N MCULE-9679793141 [0,0,0,0,0,0|0,1,0]=1 22 B12R1.283 CCOC1=C(C=CC=C1)C(C)N MCULE-9896792680 [0,0,0,0,0,0|1,0,1]=2 23 B12R1.283 CCOC1=C(C=CC=C1)C(C)N MCULE-9951227407 [0,0,0,0,0,0|1,0,1]=2 24 B12R1.283 CCOC1=C(C=CC=C1)C(C)O MCULE-5334441472 [0,0,0,0,0,0|1,0,2]=3 25 B12R1.283 CCOC1=C(C=CC=C1)[C@@H](C)N MCULE-2472560014 [0,0,0,0,0,0|1,0,1]=2 26 B12R1.283 CCOC1=C(C=CC=C1)[C@@H](C)N MCULE-9449005348 [0,0,0,0,0,0|1,0,1]=2 27 B12R1.283 CCOC1=C(C=CC=C1)[C@H](C)N MCULE-4584166426 [0,0,0,0,0,0|1,0,1]=2 28 B12R1.283 CCOC1=C(C=CC=C1)[C@H](C)N MCULE-6200483820 [0,0,0,0,0,0|1,0,1]=2 29 B12R1.283 CCOC1=C(C=CC=C1)[C@H](C)N MCULE-9342004886 [0,0,0,0,0,0|1,0,1]=2 30 B12R1.283 CCOC1=C(C=CC=C1)[C@H](C)O MCULE-1875599425 [0,0,0,0,0,0|1,0,2]=3 31 B12R1.283 CCOC1=C(C=CC=N1)C(=O)N MCULE-8595017314 [0,0,0,0,0,0|1,0,0]=1 32 B12R1.283 CCOC1=C(C=CC=N1)N(=O)=O MCULE-8467967206 [0,0,0,0,0,0|3,0,0]=3 33 B12R1.283 CCOC1=C(C=CN=C1)C(=O)O MCULE-7349876413 [0,0,0,0,0,0|2,0,0]=2 34 B12R1.283 CCOC1=C(C=NC=C1)B(O)O MCULE-7965540086 [0,0,0,0,0,0|3,0,1]=4 35 B12R1.283 CCOC1=C(N=CC=C1)C(=O)O MCULE-5509609544 [0,0,0,0,0,0|2,0,0]=2 36 B12R1.283 CCOC1=CC=CC=C1B(O)O MCULE-8547658682 [0,0,0,0,0,0|2,0,1]=3 37 B12R1.283 CCOC1=CC=CC=C1C(=O)Cl MCULE-9111125316 [0,0,0,0,0,0|1,0,0]=1 38 B12R1.283 CCOC1=CC=CC=C1C(=O)N MCULE-4151494884 [0,0,0,0,0,0|0,0,0]=0 39 B12R1.283 CCOC1=CC=CC=C1C(=O)O MCULE-8428889014 [0,0,0,0,0,0|1,0,0]=1 40 B12R1.283 CCOC1=CC=CC=C1C(F)F MCULE-5432186945 [0,0,0,0,0,0|2,0,1]=3 41 B12R1.283 CCOC1=CC=CC=C1N(=O)=O MCULE-5995501561 [0,0,0,0,0,0|2,0,0]=2 42 B12R1.283 CCOC1=CC=CC=C1[C@H](C)N MCULE-7622138495 [0,0,0,0,0,0|1,0,1]=2 43 B12R1.283 CCOC1=CC=CN=C1C(=O)C MCULE-3280380919 [0,0,0,0,0,0|2,0,0]=2 44 B12R1.283 CCOC1=CC=CN=C1N(=O)=O MCULE-8216362028 [0,0,0,0,0,0|3,0,0]=3 45 B12R1.283 CCOC1=CC=NC=C1C(=O)O MCULE-6292642166 [0,0,0,0,0,0|2,0,0]=2 46 B12R1.283 CCOC1=CC=NC=C1N(=O)=O MCULE-4718629000 [0,0,0,0,0,0|3,0,0]=3 47 B12R1.283 CCOC1=CC=[NH+]C=C1N(=O)=O MCULE-7366895984 [0,0,0,0,0,0|3,0,0]=3 48 B12R1.283 CCOC1=NC=CC=C1B(O)O MCULE-9675014240 [0,0,0,0,0,0|3,0,1]=4 49 B12R1.283 CCOC1=NC=CC=C1C(=O)C MCULE-1586843009 [0,0,0,0,0,0|2,0,0]=2 50 B12R1.283 CCOC1=NC=CC=C1C(=O)Cl MCULE-8353243811 [0,0,0,0,0,0|2,0,0]=2 51 B12R1.283 CCOC1=NC=CC=C1C(=O)O MCULE-7005430233 [0,0,0,0,0,0|2,0,0]=2 52 B12R1.283 CCOC1=NC=CN=C1C(=O)O MCULE-8012529476 [0,0,0,0,0,0|3,0,0]=3 53 B12R1.283 CCSC1=C(C=CC=C1)C(=O)C MCULE-4484259642 [0,0,0,0,0,0|1,1,0]=2 54 B12R1.283 CCSC1=C(C=CC=C1)C(=O)O MCULE-8967903143 [0,0,0,0,0,0|1,1,0]=2 55 B12R1.283 CCSC1=C(C=CC=C1)C(C)C MCULE-8792690055 [0,0,0,0,0,0|2,1,1]=4 56 B12R1.283 CCSC1=C(C=CC=N1)N(=O)=O MCULE-7520930951 [0,0,0,0,0,0|3,1,0]=4 57 B12R1.283 CCSC1=C(C=CN=C1)C(=O)O MCULE-6106365678 [0,0,0,0,0,0|2,1,0]=3 58 B12R1.283 CCSC1=C(N=CC=C1)C(=O)O MCULE-2281159092 [0,0,0,0,0,0|2,1,0]=3 59 B12R1.283 CCSC1=C(N=CC=N1)C(=O)O MCULE-7922212684 [0,0,0,0,0,0|3,1,0]=4 60 B12R1.283 CCSC1=CC=CC=C1B(O)O MCULE-5868914147 [0,0,0,0,0,0|2,1,1]=4 61 B12R1.283 CCSC1=CC=CN=C1C(=O)C MCULE-9261558140 [0,0,0,0,0,0|2,1,0]=3 62 B12R1.283 CCSC1=CC=NC=C1N(=O)=O MCULE-2414891552 [0,0,0,0,0,0|3,1,0]=4 63 B12R1.283 CCSC1=NC=CC=C1C(=O)Cl MCULE-5664836937 [0,0,0,0,0,0|2,1,0]=3 64 B12R1.283 CCSC1=NC=CC=C1C(=O)N MCULE-6494574451 [0,0,0,0,0,0|1,1,0]=2 65 B12R1.283 CCSC1=NC=CC=C1C(=O)O MCULE-1303756734 [0,0,0,0,0,0|2,1,0]=3 66 B12R1.283 CNCC1=C(C=CC=C1)C(=O)O MCULE-8342449642 [0,0,0,0,0,0|3,0,0]=3 67 B12R1.283 CNCC1=C(C=CC=C1)N(=O)=O MCULE-7246558793 [0,0,0,0,0,0|4,0,0]=4 68 B12R1.283 CNCC1=C(C=CC=C1)N(=O)=O MCULE-8284493012 [0,0,0,0,0,0|4,0,0]=4 69 B12R1.283 COCC1=C(C=CC=C1)C(=O)O MCULE-6800520007 [0,0,0,0,0,0|3,0,0]=3 70 B12R1.283 COCC1=CC=CC=C1C(=O)C MCULE-2485252541 [0,0,0,0,0,0|3,0,0]=3 71 B12R1.283 CSCC1=C(N=CC=C1)C(=O)O MCULE-1965156711 [0,0,0,0,0,0|4,0,0]=4 72 B12R1.283 CSSC1=C(C=CC=C1)C(=O)O MCULE-8098427569 [0,0,0,0,0,0|2,1,0]=3 73 B12R1.283 N#CCC1=CC=CC=C1C(=O)Cl MCULE-6087126645 [0,0,0,0,0,0|3,0,1]=4 74 B12R1.283 N#CCC1=CC=CC=C1C(=O)O MCULE-1971288593 [0,0,0,0,0,0|3,0,1]=4 75 B12R1.283 N#N=NC1=CC=CC=C1C(=O)O MCULE-7645929034 [0,0,0,0,0,0|4,0,0]=4 76 B12R1.283 NCCC1=C(C=CC=C1)C(=O)O MCULE-5271162895 [0,0,0,0,0,0|3,0,0]=3 77 B12R1.283 NCCC1=C(C=CC=C1)C(=O)O MCULE-5470409795 [0,0,0,0,0,0|3,0,0]=3 78 B12R1.283 NCCC1=C(C=CC=C1)N(=O)=O MCULE-3696203837 [0,0,0,0,0,0|4,0,0]=4 79 B12R1.283 NCCC1=CC=CC=C1N(=O)=O MCULE-5625377169 [0,0,0,0,0,0|4,0,0]=4 80 B12R1.283 O=C=NC1=C(C=CC=C1)C(=O)Cl MCULE-4868410155 [0,0,0,0,0,0|3,0,1]=4 81 B12R1.283 O=CNC1=C(C=CC=C1)C(=O)O MCULE-3344929418 [0,0,0,0,0,0|3,0,1]=4 82 B12R1.283 O=N(=O)C1=C(C=CC=C1)CCBr MCULE-5403664360 [0,0,0,0,0,0|4,0,0]=4 83 B12R1.283 O=N(=O)C1=C(C=CC=C1)CCCl MCULE-8576182979 [0,0,0,0,0,0|4,0,0]=4 84 B12R1.283 O=N(=O)C1=C(C=CC=C1)CCO MCULE-9915328676 [0,0,0,0,0,0|4,0,0]=4 85 B11R1.41 C#CC1=CC=CC=C1OCC MCULE-8323737924 [1,0,0,0,0,0|1,0,1]=3 86 B11R1.41 C#CCC1=CC=CC=C1C=O MCULE-8748510242 [1,0,0,0,0,0|1,0,2]=4 87 B11R1.41 C=CC1=C(C=CC=C1)CCO MCULE-8453228146 [1,0,0,0,0,0|3,0,0]=4 88 B11R1.41 C=CCC1=C(C=CC=C1)C=O MCULE-8327113071 [1,0,0,0,0,0|1,0,2]=4 89 B11R1.41 CCCC1=C(C=CC=C1)CBr MCULE-7257076337 [1,0,0,0,0,0|2,0,1]=4 90 B11R1.41 CCCC1=C(C=CC=C1)CO MCULE-1383263398 [1,0,0,0,0,0|1,0,2]=4 91 B11R1.41 CCCC1=CC=CC=C1CN MCULE-6302565014 [1,0,0,0,0,0|1,0,1]=3 92 B11R1.41 CCCC1=CC=CC=C1CN MCULE-7100900228 [1,0,0,0,0,0|1,0,1]=3 93 B11R1.41 CCCC1=CC=CC=C1OC MCULE-7465740751 [1,0,0,0,0,0|3,0,0]=4 94 B11R1.41 CCNC1=C(C=CC=C1)C=O MCULE-8648734006 [1,0,0,0,0,0|1,0,0]=2 95 B11R1.41 CCNC1=C(C=CC=C1)OC MCULE-1502335415 [1,0,0,0,0,0|3,0,0]=4 96 B11R1.41 CCNC1=C(C=CC=C1)OC MCULE-9041969487 [1,0,0,0,0,0|3,0,0]=4 97 B11R1.41 CCNC1=CC=CC=C1C#N MCULE-1929775354 [1,0,0,0,0,0|1,0,2]=4 98 B11R1.41 CCNC1=CC=CC=C1CC MCULE-9649046170 [1,0,0,0,0,0|2,0,1]=4 99 B11R1.41 CCNC1=NC=CC=C1CN MCULE-6065300382 [1,0,0,0,0,0|2,0,1]=4 100 B11R1.41 CCOC1=C(C=CC=C1)C#N MCULE-2835846545 [1,0,0,0,0,0|0,0,2]=3 101 B11R1.41 CCOC1=C(C=CC=C1)CCl MCULE-9787382781 [1,0,0,0,0,0|1,0,1]=3 102 B11R1.41 CCOC1=C(C=CC=C1)CN MCULE-1845898833 [1,0,0,0,0,0|0,0,1]=2 103 B11R1.41 CCOC1=C(C=CC=C1)NC MCULE-6320817308 [1,0,0,0,0,0|2,0,0]=3 104 B11R1.41 CCOC1=C(C=CC=C1)SC MCULE-2849383298 [1,0,0,0,0,0|2,0,0]=3 105 B11R1.41 CCOC1=C(C=CC=N1)C#N MCULE-8823738953 [1,0,0,0,0,0|1,0,2]=4 106 B11R1.41 CCOC1=C(C=CC=N1)C=O MCULE-5269915909 [1,0,0,0,0,0|1,0,0]=2 107 B11R1.41 CCOC1=C(C=CN=C1)CN MCULE-4028195623 [1,0,0,0,0,0|1,0,1]=3 108 B11R1.41 CCOC1=CC=CC=C1C=O MCULE-2364462479 [1,0,0,0,0,0|0,0,0]=1 109 B11R1.41 CCOC1=CC=CC=C1CN MCULE-4748065538 [1,0,0,0,0,0|0,0,1]=2 110 B11R1.41 CCOC1=CC=CC=C1CO MCULE-8083516503 [1,0,0,0,0,0|0,0,2]=3 111 B11R1.41 CCOC1=CC=CC=C1NN MCULE-1483408604 [1,0,0,0,0,0|1,0,0]=2 112 B11R1.41 CCOC1=CC=CC=C1NN MCULE-8996307365 [1,0,0,0,0,0|1,0,0]=2 113 B11R1.41 CCOC1=CC=CC=C1OC MCULE-5914437221 [1,0,0,0,0,0|2,0,0]=3 114 B11R1.41 CCOC1=CC=CN=C1C=O MCULE-7217501109 [1,0,0,0,0,0|1,0,0]=2 115 B11R1.41 CCOC1=CC=CN=C1CCl MCULE-4768116619 [1,0,0,0,0,0|2,0,1]=4 116 B11R1.41 CCOC1=CC=CN=C1CCl MCULE-8328960153 [1,0,0,0,0,0|2,0,1]=4 117 B11R1.41 CCOC1=CC=CN=C1CN MCULE-1130894986 [1,0,0,0,0,0|1,0,1]=3 118 B11R1.41 CCOC1=CC=CN=C1CO MCULE-9080282474 [1,0,0,0,0,0|1,0,2]=4 119 B11R1.41 CCOC1=CC=CN=C1NC MCULE-3382781802 [1,0,0,0,0,0|3,0,0]=4 120 B11R1.41 CCOC1=CC=NC=C1C=O MCULE-1872540499 [1,0,0,0,0,0|1,0,0]=2 121 B11R1.41 CCOC1=CN=CC=C1C#N MCULE-2490088213 [1,0,0,0,0,0|1,0,2]=4 122 B11R1.41 CCOC1=NC=CC=C1CN MCULE-2760097045 [1,0,0,0,0,0|1,0,1]=3 123 B11R1.41 CCOC1=NC=CC=C1CN MCULE-3564017273 [1,0,0,0,0,0|1,0,1]=3 124 B11R1.41 CCOC1=NC=CC=C1CN MCULE-5832713813 [1,0,0,0,0,0|1,0,1]=3 125 B11R1.41 CCOC1=NC=CC=C1CO MCULE-6842641467 [1,0,0,0,0,0|1,0,2]=4 126 B11R1.41 CCOC1=NC=CC=C1OC MCULE-3315851905 [1,0,0,0,0,0|3,0,0]=4 127 B11R1.41 CCOC1=NC=CN=C1NN MCULE-9528843684 [1,0,0,0,0,0|3,0,0]=4 128 B11R1.41 CCSC1=C(C=CC=C1)C#N MCULE-5657681825 [1,0,0,0,0,0|0,1,2]=4 129 B11R1.41 CCSC1=C(C=CC=C1)CC MCULE-8989190690 [1,0,0,0,0,0|1,1,1]=4 130 B11R1.41 CCSC1=C(C=CC=C1)CCl MCULE-3025869199 [1,0,0,0,0,0|1,1,1]=4 131 B11R1.41 CCSC1=C(C=CC=C1)OC MCULE-3608057446 [1,0,0,0,0,0|2,1,0]=4 132 B11R1.41 CCSC1=CC=CC=C1C=O MCULE-4191120123 [1,0,0,0,0,0|0,1,0]=2 133 B11R1.41 COCC1=C(C=CC=C1)CN MCULE-5034293986 [1,0,0,0,0,0|2,0,1]=4 134 B11R1.41 COCC1=CC=CC=C1C=O MCULE-3692457492 [1,0,0,0,0,0|2,0,0]=3 135 B11R1.41 N#CCC1=CC=CC=C1C=O MCULE-9946507236 [1,0,0,0,0,0|2,0,1]=4 136 B11R1.41 N#CSC1=C(C=CC=C1)C=O MCULE-3259559561 [1,0,0,0,0,0|1,1,1]=4 137 B11R1.41 N#N=NC1=C(C=CC=C1)C=O MCULE-3532338331 [1,0,0,0,0,0|3,0,0]=4 138 B11R1.41 NCC1=CC=CC=C1CCO MCULE-3912743081 [1,0,0,0,0,0|2,0,1]=4 139 B11R1.41 O=CC1=CC=CC=C1CCBr MCULE-5684229179 [1,0,0,0,0,0|2,0,0]=3 140 B11R1.41 O=CNC1=C(C=CC=C1)C=O MCULE-9434293537 [1,0,0,0,0,0|2,0,1]=4 141 B11R1.53 C#CC1=C(C=CC=C1)C(=O)C MCULE-3005940647 [1,0,0,0,0,0|1,0,2]=4 142 B11R1.53 C#CC1=CC=CC=C1C(=O)N MCULE-2153620506 [1,0,0,0,0,0|0,0,2]=3 143 B11R1.53 C#CC1=CC=CC=C1C(=O)O MCULE-2225406631 [1,0,0,0,0,0|1,0,2]=4 144 B11R1.53 C=C(C)C1=CC=CC=C1CO MCULE-9261859834 [1,0,0,0,0,0|3,0,0]=4 145 B11R1.53 C=C(C)C1=CC=CC=C1OC MCULE-1743293462 [1,0,0,0,0,0|2,0,0]=3 146 B11R1.53 C=CC1=CC=CC=C1C(=O)C MCULE-2023411900 [1,0,0,0,0,0|1,0,2]=4 147 B11R1.53 C=CC1=CC=CC=C1C(=O)O MCULE-7536191019 [1,0,0,0,0,0|1,0,2]=4 148 B11R1.53 CC(=O)C1=C(C=CC=C1)C#N MCULE-4004183023 [1,0,0,0,0,0|2,0,1]=4 149 B11R1.53 CC(=O)C1=CC=CC=C1C=O MCULE-5332635055 [1,0,0,0,0,0|2,0,1]=4 150 B11R1.53 CC(N)C1=CC=CC=C1CO MCULE-1270447497 [1,0,0,0,0,0|2,0,1]=4 151 B11R1.53 CCC1=C(C=CC=C1)B(O)O MCULE-4962553262 [1,0,0,0,0,0|2,0,1]=4 152 B11R1.53 CCC1=C(C=CC=C1)C(=O)C MCULE-2609725301 [1,0,0,0,0,0|1,0,0]=2 153 B11R1.53 CCC1=C(C=CC=C1)C(=O)N MCULE-2003552914 [1,0,0,0,0,0|0,0,0]=1 154 B11R1.53 CCC1=C(C=CC=C1)C(C)N MCULE-4027487617 [1,0,0,0,0,0|1,0,1]=3 155 B11R1.53 CCC1=C(C=CC=C1)N(=O)=O MCULE-7725356985 [1,0,0,0,0,0|2,0,0]=3 156 B11R1.53 CCC1=C(C=CC=C1)[C@H](C)N MCULE-4889462550 [1,0,0,0,0,0|1,0,1]=3 157 B11R1.53 CCC1=C(C=CC=C1)[C@H](C)N MCULE-7408621687 [1,0,0,0,0,0|1,0,1]=3 158 B11R1.53 CCC1=C(C=CC=N1)C(=O)O MCULE-1816858431 [1,0,0,0,0,0|2,0,0]=3 159 B11R1.53 CCC1=C(C=CN=C1)C(=O)C MCULE-6050468430 [1,0,0,0,0,0|2,0,0]=3 160 B11R1.53 CCC1=C(C=CN=C1)C(=O)O MCULE-2556387316 [1,0,0,0,0,0|2,0,0]=3 161 B11R1.53 CCC1=C(C=CN=C1)C(=O)O MCULE-8380645094 [1,0,0,0,0,0|2,0,0]=3 162 B11R1.53 CCC1=C(C=NC=N1)C(=O)O MCULE-6327334228 [1,0,0,0,0,0|3,0,0]=4 163 B11R1.53 CCC1=C(N=CC=N1)C(=O)C MCULE-9725278937 [1,0,0,0,0,0|3,0,0]=4 164 B11R1.53 CCC1=CC=CC=C1C(=O)Cl MCULE-7919259179 [1,0,0,0,0,0|1,0,0]=2 165 B11R1.53 CCC1=CC=CC=C1C(=O)O MCULE-5345503463 [1,0,0,0,0,0|1,0,0]=2 166 B11R1.53 CCC1=CC=CC=C1C(=S)N MCULE-7202693939 [1,0,0,0,0,0|0,1,0]=2 167 B11R1.53 CCC1=CC=CC=C1C(C)O MCULE-5140391983 [1,0,0,0,0,0|1,0,2]=4 168 B11R1.53 CCC1=CC=CC=C1S(=O)C MCULE-9408364147 [1,0,0,0,0,0|2,0,0]=3 169 B11R1.53 CCC1=CC=CC=C1[C@@H](C)N MCULE-6175444455 [1,0,0,0,0,0|1,0,1]=3 170 B11R1.53 CCC1=CC=CN=C1C(=O)C MCULE-4052051937 [1,0,0,0,0,0|2,0,0]=3 171 B11R1.53 CCC1=CC=NC=C1C(=O)O MCULE-5770920295 [1,0,0,0,0,0|2,0,0]=3 172 B11R1.53 CCC1=NC=CC=C1N(=O)=O MCULE-7969803559 [1,0,0,0,0,0|3,0,0]=4 173 B11R1.53 CNC1=C(C=CC=C1)C(=O)N MCULE-1088460584 [1,0,0,0,0,0|1,0,0]=2 174 B11R1.53 CNC1=C(C=CC=C1)N(=O)=O MCULE-1031810235 [1,0,0,0,0,0|3,0,0]=4 175 B11R1.53 CNC1=C(C=CN=C1)C(=O)O MCULE-9089889870 [1,0,0,0,0,0|3,0,0]=4 176 B11R1.53 CNC1=CC=CC=C1C(=O)C MCULE-8366543105 [1,0,0,0,0,0|2,0,0]=3 177 B11R1.53 CNC1=CC=CC=C1C(=O)O MCULE-5834002880 [1,0,0,0,0,0|2,0,0]=3 178 B11R1.53 CNC1=NC=CC=C1C(=O)N MCULE-8361270214 [1,0,0,0,0,0|2,0,0]=3 179 B11R1.53 CNC1=NC=CC=C1C(=O)O MCULE-6289599546 [1,0,0,0,0,0|3,0,0]=4 180 B11R1.53 COC1=C(C=CC=C1)C(=O)C MCULE-4229015136 [1,0,0,0,0,0|1,0,0]=2 181 B11R1.53 COC1=C(C=CC=C1)C(=O)O MCULE-8358316345 [1,0,0,0,0,0|1,0,0]=2 182 B11R1.53 COC1=C(C=CC=C1)C(=O)[O-] MCULE-2998755053 [1,0,0,0,0,0|1,0,0]=2 183 B11R1.53 COC1=C(C=CC=C1)C(=S)N MCULE-2949360858 [1,0,0,0,0,0|0,1,0]=2 184 B11R1.53 COC1=C(C=CC=C1)C(C)C MCULE-6375560608 [1,0,0,0,0,0|2,0,1]=4 185 B11R1.53 COC1=C(C=CC=C1)C(C)N MCULE-2682559409 [1,0,0,0,0,0|1,0,1]=3 186 B11R1.53 COC1=C(C=CC=C1)C(C)N MCULE-4458367407 [1,0,0,0,0,0|1,0,1]=3 187 B11R1.53 COC1=C(C=CC=C1)C(C)N MCULE-9328726185 [1,0,0,0,0,0|1,0,1]=3 188 B11R1.53 COC1=C(C=CC=C1)C(C)S MCULE-3036818876 [1,0,0,0,0,0|1,1,1]=4 189 B11R1.53 COC1=C(C=CC=C1)N(=O)=O MCULE-1590319114 [1,0,0,0,0,0|2,0,0]=3 190 B11R1.53 COC1=C(C=CC=C1)S(=O)O MCULE-9927511433 [1,0,0,0,0,0|2,0,0]=3 191 B11R1.53 COC1=C(C=CC=C1)[C@@H](C)O MCULE-9423288091 [1,0,0,0,0,0|1,0,2]=4 192 B11R1.53 COC1=C(C=CC=C1)[C@H](C)N MCULE-3665297151 [1,0,0,0,0,0|1,0,1]=3 193 B11R1.53 COC1=C(C=CC=C1)[C@H](C)O MCULE-8529910689 [1,0,0,0,0,0|1,0,2]=4 194 B11R1.53 COC1=C(C=CC=N1)C(=O)N MCULE-8383485590 [1,0,0,0,0,0|1,0,0]=2 195 B11R1.53 COC1=C(C=CC=N1)C(=S)N MCULE-4085311075 [1,0,0,0,0,0|1,1,0]=3 196 B11R1.53 COC1=C(C=CC=N1)C(C)N MCULE-3510992465 [1,0,0,0,0,0|2,0,1]=4 197 B11R1.53 COC1=C(C=CN=C1)C(=O)C MCULE-6037561962 [1,0,0,0,0,0|2,0,0]=3 198 B11R1.53 COC1=C(C=CN=C1)C(C)N MCULE-9655628305 [1,0,0,0,0,0|2,0,1]=4 199 B11R1.53 COC1=C(C=CN=C1)N(=O)=O MCULE-7292849750 [1,0,0,0,0,0|3,0,0]=4 200 B11R1.53 COC1=C(C=NC=C1)C(=O)C MCULE-9248043357 [1,0,0,0,0,0|2,0,0]=3 201 B11R1.53 COC1=C(C=NC=C1)C(=O)N MCULE-5304924465 [1,0,0,0,0,0|1,0,0]=2 202 B11R1.53 COC1=C(C=NC=C1)C(=S)N MCULE-3019017519 [1,0,0,0,0,0|1,1,0]=3 203 B11R1.53 COC1=C(C=NC=C1)N(=O)=O MCULE-9217456967 [1,0,0,0,0,0|3,0,0]=4 204 B11R1.53 COC1=C(N=CC=N1)C(=N)N MCULE-4558992637 [1,0,0,0,0,0|3,0,0]=4 205 B11R1.53 COC1=C(N=CN=C1)C(=O)O MCULE-7636183898 [1,0,0,0,0,0|3,0,0]=4 206 B11R1.53 COC1=CC=CC=C1B(O)O MCULE-7736949211 [1,0,0,0,0,0|2,0,1]=4 207 B11R1.53 COC1=CC=CC=C1C(=N)N MCULE-3854184221 [1,0,0,0,0,0|1,0,0]=2 208 B11R1.53 COC1=CC=CC=C1C(=N)N MCULE-4706512928 [1,0,0,0,0,0|1,0,0]=2 209 B11R1.53 COC1=CC=CC=C1C(=N)N MCULE-7438125183 [1,0,0,0,0,0|1,0,0]=2 210 B11R1.53 COC1=CC=CC=C1C(=O)Cl MCULE-5853878323 [1,0,0,0,0,0|1,0,0]=2 211 B11R1.53 COC1=CC=CC=C1C(=O)N MCULE-5017344990 [1,0,0,0,0,0|0,0,0]=1 212 B11R1.53 COC1=CC=CC=C1C(C)N MCULE-9275895205 [1,0,0,0,0,0|1,0,1]=3 213 B11R1.53 COC1=CC=CC=C1C(C)O MCULE-3713378302 [1,0,0,0,0,0|1,0,2]=4 214 B11R1.53 COC1=CC=CC=C1C(F)F MCULE-7708246141 [1,0,0,0,0,0|2,0,1]=4 215 B11R1.53 COC1=CC=CC=C1S(=O)[O-] MCULE-7039154071 [1,0,0,0,0,0|2,0,0]=3 216 B11R1.53 COC1=CC=CC=C1[C@@H](C)N MCULE-1823851020 [1,0,0,0,0,0|1,0,1]=3 217 B11R1.53 COC1=CC=CC=C1[C@@H](C)N MCULE-3251348648 [1,0,0,0,0,0|1,0,1]=3 218 B11R1.53 COC1=CC=CC=C1[C@@H](C)N MCULE-3701383525 [1,0,0,0,0,0|1,0,1]=3 219 B11R1.53 COC1=CC=CC=C1[C@@H](C)N MCULE-3809424764 [1,0,0,0,0,0|1,0,1]=3 220 B11R1.53 COC1=CC=CC=C1[C@H](C)N MCULE-6704463261 [1,0,0,0,0,0|1,0,1]=3 221 B11R1.53 COC1=CC=CC=C1[C@H](C)N MCULE-8754102408 [1,0,0,0,0,0|1,0,1]=3 222 B11R1.53 COC1=CC=CC=C1[C@H](C)N MCULE-9030781729 [1,0,0,0,0,0|1,0,1]=3 223 B11R1.53 COC1=CC=CN=C1C(=N)N MCULE-4140384062 [1,0,0,0,0,0|2,0,0]=3 224 B11R1.53 COC1=CC=CN=C1C(=N)N MCULE-8154984008 [1,0,0,0,0,0|2,0,0]=3 225 B11R1.53 COC1=CC=CN=C1C(=O)C MCULE-2218351239 [1,0,0,0,0,0|2,0,0]=3 226 B11R1.53 COC1=CC=CN=C1C(=O)N MCULE-9799144918 [1,0,0,0,0,0|1,0,0]=2 227 B11R1.53 COC1=CC=CN=C1C(=O)O MCULE-9430488708 [1,0,0,0,0,0|2,0,0]=3 228 B11R1.53 COC1=CC=CN=C1N(=O)=O MCULE-6990701540 [1,0,0,0,0,0|3,0,0]=4 229 B11R1.53 COC1=CC=CN=C1[C@@H](C)N MCULE-3950589918 [1,0,0,0,0,0|2,0,1]=4 230 B11R1.53 COC1=CC=NC=C1C(=O)O MCULE-3496808749 [1,0,0,0,0,0|2,0,0]=3 231 B11R1.53 COC1=CC=NC=C1N(=O)=O MCULE-9279397849 [1,0,0,0,0,0|3,0,0]=4 232 B11R1.53 COC1=CN=CC=C1C(=O)O MCULE-4176544219 [1,0,0,0,0,0|2,0,0]=3 233 B11R1.53 COC1=NC=CC=C1C(=O)C MCULE-9886056329 [1,0,0,0,0,0|2,0,0]=3 234 B11R1.53 COC1=NC=CC=C1C(=O)Cl MCULE-6530682787 [1,0,0,0,0,0|2,0,0]=3 235 B11R1.53 COC1=NC=CC=C1C(=O)O MCULE-5244916926 [1,0,0,0,0,0|2,0,0]=3 236 B11R1.53 COC1=NC=CC=C1N(=O)=O MCULE-7124677332 [1,0,0,0,0,0|3,0,0]=4 237 B11R1.53 COC1=NC=CN=C1C(=O)C MCULE-2548845520 [1,0,0,0,0,0|3,0,0]=4 238 B11R1.53 COC1=NC=CN=C1C(=O)O MCULE-1977337866 [1,0,0,0,0,0|3,0,0]=4 239 B11R1.53 COC1=NC=NC=C1C(=O)O MCULE-3719522518 [1,0,0,0,0,0|3,0,0]=4 240 B11R1.53 COC1=NN=CC=C1C(=O)O MCULE-1739742173 [1,0,0,0,0,0|3,0,0]=4 241 B11R1.53 CSC1=C(C=CC=C1)C(=O)C MCULE-3015343743 [1,0,0,0,0,0|1,1,0]=3 242 B11R1.53 CSC1=C(C=CC=C1)C(=O)N MCULE-8440684791 [1,0,0,0,0,0|0,1,0]=2 243 B11R1.53 CSC1=C(C=CC=C1)C(=O)O MCULE-9467769240 [1,0,0,0,0,0|1,1,0]=3 244 B11R1.53 CSC1=C(C=CC=C1)N(=O)=O MCULE-3654731519 [1,0,0,0,0,0|2,1,0]=4 245 B11R1.53 CSC1=C(C=CC=C1)[C@@H](C)N MCULE-6071626961 [1,0,0,0,0,0|1,1,1]=4 246 B11R1.53 CSC1=C(C=CC=C1)[C@@H](C)N MCULE-6180096553 [1,0,0,0,0,0|1,1,1]=4 247 B11R1.53 CSC1=C(C=CC=N1)C(=O)Cl MCULE-3334120611 [1,0,0,0,0,0|2,1,0]=4 248 B11R1.53 CSC1=C(N=CC=C1)C(=O)O MCULE-7916550623 [1,0,0,0,0,0|2,1,0]=4 249 B11R1.53 CSC1=CC=CC=C1C(=O)Cl MCULE-1833321818 [1,0,0,0,0,0|1,1,0]=3 250 B11R1.53 CSC1=CC=CC=C1[C@H](C)N MCULE-7267090774 [1,0,0,0,0,0|1,1,1]=4 251 B11R1.53 CSC1=CC=CC=C1[C@H](C)N MCULE-9892005577 [1,0,0,0,0,0|1,1,1]=4 252 B11R1.53 CSC1=NC=CC=C1C(=O)N MCULE-1123850413 [1,0,0,0,0,0|1,1,0]=3 253 B11R1.53 CSC1=NC=CC=C1C(=O)O MCULE-6789292284 [1,0,0,0,0,0|2,1,0]=4 254 B11R1.53 C[C@H](N)C1=CC=CC=C1CO MCULE-5281742875 [1,0,0,0,0,0|2,0,1]=4 255 B11R1.53 N#CC1=C(C=CC=C1)C(=O)Cl MCULE-8891016561 [1,0,0,0,0,0|2,0,1]=4 256 B11R1.53 N#CC1=C(C=CC=C1)C(=O)N MCULE-8710009642 [1,0,0,0,0,0|1,0,1]=3 257 B11R1.53 N#CC1=C(C=CC=C1)C(=O)O MCULE-8028564477 [1,0,0,0,0,0|2,0,1]=4 258 B11R1.53 N#CC1=CC=CC=C1C(=N)N MCULE-1703726205 [1,0,0,0,0,0|2,0,1]=4 259 B11R1.53 N#CC1=CC=CC=C1C(=N)N MCULE-3661572550 [1,0,0,0,0,0|2,0,1]=4 260 B11R1.53 NC(=O)C1=C(C=CC=C1)C=O MCULE-1125511731 [1,0,0,0,0,0|1,0,1]=3 261 B11R1.53 NC(=O)C1=C(C=CC=C1)CBr MCULE-2953769743 [1,0,0,0,0,0|1,0,0]=2 262 B11R1.53 NC(=O)C1=C(C=CC=C1)CO MCULE-6667845071 [1,0,0,0,0,0|1,0,0]=2 263 B11R1.53 NC(=O)C1=C(C=CC=N1)C=O MCULE-2464669711 [1,0,0,0,0,0|2,0,1]=4 264 B11R1.53 NC(=O)C1=C(N=CC=C1)CO MCULE-4149391731 [1,0,0,0,0,0|2,0,0]=3 265 B11R1.53 NC(=O)C1=CC=CN=C1CBr MCULE-9723491420 [1,0,0,0,0,0|2,0,0]=3 266 B11R1.53 NC(=O)C1=NC=CN=C1CO MCULE-3289781899 [1,0,0,0,0,0|3,0,0]=4 267 B11R1.53 NCC1=C(C=CC=C1)N(=O)=O MCULE-2461684599 [1,0,0,0,0,0|3,0,0]=4 268 B11R1.53 NCC1=C(C=CC=C1)N(=O)=O MCULE-9062222448 [1,0,0,0,0,0|3,0,0]=4 269 B11R1.53 NCC1=C(C=CC=N1)C(=O)O MCULE-6336117316 [1,0,0,0,0,0|3,0,0]=4 270 B11R1.53 NCC1=C(C=CC=N1)C(=O)O MCULE-8956287762 [1,0,0,0,0,0|3,0,0]=4 271 B11R1.53 NCC1=CC=CC=C1C(=O)N MCULE-4740530376 [1,0,0,0,0,0|1,0,0]=2 272 B11R1.53 NCC1=CC=CC=C1C(=O)N MCULE-6077105754 [1,0,0,0,0,0|1,0,0]=2 273 B11R1.53 NCC1=CC=CC=C1C(=O)O MCULE-3951040853 [1,0,0,0,0,0|2,0,0]=3 274 B11R1.53 NCC1=CC=CC=C1C(=O)O MCULE-7214993753 [1,0,0,0,0,0|2,0,0]=3 275 B11R1.53 NNC1=C(C=CC=C1)C(=O)O MCULE-6710058167 [1,0,0,0,0,0|3,0,0]=4 276 B11R1.53 NNC1=C(C=NC=C1)C(=O)N MCULE-7832818547 [1,0,0,0,0,0|3,0,0]=4 277 B11R1.53 NNC1=CC=CC=C1C(=O)O MCULE-9681705772 [1,0,0,0,0,0|3,0,0]=4 278 B11R1.53 NOC1=CC=CC=C1N(=O)=O MCULE-5107793215 [1,0,0,0,0,0|3,0,0]=4 279 B11R1.53 NOC1=CC=CC=C1N(=O)=O MCULE-5525146800 [1,0,0,0,0,0|3,0,0]=4 280 B11R1.53 O=C(Br)C1=C(C=CC=C1)CBr MCULE-9152786716 [1,0,0,0,0,0|2,0,0]=3 281 B11R1.53 O=C(Cl)C1=CC=CC=C1CBr MCULE-4859473805 [1,0,0,0,0,0|2,0,0]=3 282 B11R1.53 O=C(Cl)C1=CC=CC=C1CCl MCULE-2103928099 [1,0,0,0,0,0|2,0,0]=3 283 B11R1.53 O=C(O)C1=C(C=CC=C1)CBr MCULE-3916838805 [1,0,0,0,0,0|2,0,0]=3 284 B11R1.53 O=C(O)C1=C(C=CC=C1)CCl MCULE-9961828053 [1,0,0,0,0,0|2,0,0]=3 285 B11R1.53 O=C(O)C1=C(C=CC=C1)CO MCULE-4795775601 [1,0,0,0,0,0|2,0,0]=3 286 B11R1.53 O=C(O)C1=C(C=CC=C1)NO MCULE-6356954782 [1,0,0,0,0,0|3,0,0]=4 287 B11R1.53 O=C(O)C1=C(C=CC=C1)OI MCULE-3097266245 [1,0,0,0,0,0|2,0,0]=3 288 B11R1.53 O=C(O)C1=C(N=CC=C1)CO MCULE-1065539051 [1,0,0,0,0,0|3,0,0]=4 289 B11R1.53 O=C(O)C1=CN=CC=C1CO MCULE-7496519749 [1,0,0,0,0,0|3,0,0]=4 290 B11R1.53 O=CC1=C(C=CC=C1)C(=O)Cl MCULE-3471711409 [1,0,0,0,0,0|2,0,1]=4 291 B11R1.53 O=CC1=CC=CC=C1C(=O)O MCULE-7642820980 [1,0,0,0,0,0|2,0,1]=4 292 B11R1.53 O=N(=O)C1=C(C=CC=C1)CBr MCULE-4270493092 [1,0,0,0,0,0|3,0,0]=4 293 B11R1.53 O=N(=O)C1=C(C=CC=C1)CF MCULE-4956645053 [1,0,0,0,0,0|3,0,0]=4 294 B11R1.53 O=N(=O)C1=CC=CC=C1CCl MCULE-8919235921 [1,0,0,0,0,0|3,0,0]=4 295 B11R1.53 O=N(=O)C1=CC=CC=C1CO MCULE-4220005125 [1,0,0,0,0,0|3,0,0]=4 296 B11R1.53 O=NC1=CC=CC=C1C(=O)O MCULE-4180896401 [1,0,0,0,0,0|3,0,0]=4 297 B11R1.53 O=[IH2]C1=C(C=CC=C1)C(=O)O MCULE-9514632532 [1,0,0,0,0,0|3,0,0]=4 298 B13R1.141 CCCC1=C(C=C(C=C1)N)N(=O)=O MCULE-4663751701 [0,1,0,0,0,0|3,0,0]=4 299 B13R1.141 CCNC1=C(C=C(C=C1)C)C(=O)O MCULE-2383425921 [0,1,0,0,0,0|2,0,0]=3 300 B13R1.141 CCNC1=C(C=C(C=C1)Cl)C(=O)N MCULE-1786127951 [0,1,0,0,0,0|1,0,0]=2 301 B13R1.141 CCNC1=C(C=C(C=C1)F)C(=O)O MCULE-5847642812 [0,1,0,0,0,0|2,0,0]=3 302 B13R1.141 CCNC1=CC=C(C=C1C(=O)N)F MCULE-7534426509 [0,1,0,0,0,0|1,0,0]=2 303 B13R1.141 CCNC1=CC=C(C=C1C(=O)O)Br MCULE-8700327725 [0,1,0,0,0,0|2,0,0]=3 304 B13R1.141 CCNC1=CC=C(C=C1C(=O)O)Cl MCULE-1524937815 [0,1,0,0,0,0|2,0,0]=3 305 B13R1.141 CCNC1=CC=C(C=C1N(=O)=O)Br MCULE-5739486205 [0,1,0,0,0,0|3,0,0]=4 306 B13R1.141 CCNC1=CC=C(C=C1N(=O)=O)Cl MCULE-8156022089 [0,1,0,0,0,0|3,0,0]=4 307 B13R1.141 CCNC1=CC=C(C=C1N(=O)=O)F MCULE-3563468447 [0,1,0,0,0,0|3,0,0]=4 308 B13R1.141 CCNC1=NC=C(C=C1C(=O)O)Br MCULE-1118393480 [0,1,0,0,0,0|3,0,0]=4 309 B13R1.141 CCOC1=C(C=C(C=C1)Br)C(C)O MCULE-4704588729 [0,1,0,0,0,0|1,0,2]=4 310 B13R1.141 CCOC1=C(C=C(C=C1)Br)C(F)F MCULE-9195797605 [0,1,0,0,0,0|2,0,1]=4 311 B13R1.141 CCOC1=C(C=C(C=C1)Br)N(=O)=O MCULE-3957671564 [0,1,0,0,0,0|2,0,0]=3 312 B13R1.141 CCOC1=C(C=C(C=C1)Br)[C@@H](C)N MCULE-6016747440 [0,1,0,0,0,0|1,0,1]=3 313 B13R1.141 CCOC1=C(C=C(C=C1)Br)[C@H](C)N MCULE-5935974854 [0,1,0,0,0,0|1,0,1]=3 314 B13R1.141 CCOC1=C(C=C(C=C1)Br)[C@H](C)N MCULE-6000316853 [0,1,0,0,0,0|1,0,1]=3 315 B13R1.141 CCOC1=C(C=C(C=C1)C)B(O)O MCULE-2101093164 [0,1,0,0,0,0|2,0,1]=4 316 B13R1.141 CCOC1=C(C=C(C=C1)F)B(O)O MCULE-8067831842 [0,1,0,0,0,0|2,0,1]=4 317 B13R1.141 CCOC1=C(C=C(C=C1)F)C(=O)C MCULE-7608819275 [0,1,0,0,0,0|1,0,0]=2 318 B13R1.141 CCOC1=C(C=C(C=C1)F)C(=O)Cl MCULE-1547059414 [0,1,0,0,0,0|1,0,0]=2 319 B13R1.141 CCOC1=C(C=C(C=C1)F)C(=O)O MCULE-5926893057 [0,1,0,0,0,0|1,0,0]=2 320 B13R1.141 CCOC1=C(C=C(C=C1)F)C(C)O MCULE-8943087754 [0,1,0,0,0,0|1,0,2]=4 321 B13R1.141 CCOC1=C(C=C(C=C1)F)N(=O)=O MCULE-3496279646 [0,1,0,0,0,0|2,0,0]=3 322 B13R1.141 CCOC1=C(C=C(C=C1)N)N(=O)=O MCULE-4966790026 [0,1,0,0,0,0|2,0,0]=3 323 B13R1.141 CCOC1=CC=C(C=C1B(O)O)Br MCULE-3927185054 [0,1,0,0,0,0|2,0,1]=4 324 B13R1.141 CCOC1=CC=C(C=C1B(O)O)Cl MCULE-5972374350 [0,1,0,0,0,0|2,0,1]=4 325 B13R1.141 CCOC1=CC=C(C=C1C(=O)C)Br MCULE-4925660858 [0,1,0,0,0,0|1,0,0]=2 326 B13R1.141 CCOC1=CC=C(C=C1C(=O)C)C MCULE-9887907753 [0,1,0,0,0,0|1,0,0]=2 327 B13R1.141 CCOC1=CC=C(C=C1C(=O)C)Cl MCULE-1767458317 [0,1,0,0,0,0|1,0,0]=2 328 B13R1.141 CCOC1=CC=C(C=C1C(=O)Cl)Br MCULE-3128388103 [0,1,0,0,0,0|1,0,0]=2 329 B13R1.141 CCOC1=CC=C(C=C1C(=O)Cl)C MCULE-7883153756 [0,1,0,0,0,0|1,0,0]=2 330 B13R1.141 CCOC1=CC=C(C=C1C(=O)Cl)Cl MCULE-1462264322 [0,1,0,0,0,0|1,0,0]=2 331 B13R1.141 CCOC1=CC=C(C=C1C(=O)N)Br MCULE-6901588416 [0,1,0,0,0,0|0,0,0]=1 332 B13R1.141 CCOC1=CC=C(C=C1C(=O)N)N MCULE-2960631444 [0,1,0,0,0,0|0,0,0]=1 333 B13R1.141 CCOC1=CC=C(C=C1C(=O)O)Br MCULE-8071302040 [0,1,0,0,0,0|1,0,0]=2 334 B13R1.141 CCOC1=CC=C(C=C1C(=O)O)C MCULE-5536565558 [0,1,0,0,0,0|1,0,0]=2 335 B13R1.141 CCOC1=CC=C(C=C1C(=O)O)Cl MCULE-4086792290 [0,1,0,0,0,0|1,0,0]=2 336 B13R1.141 CCOC1=CC=C(C=C1C(=O)O)N MCULE-1156472481 [0,1,0,0,0,0|1,0,0]=2 337 B13R1.141 CCOC1=CC=C(C=C1C(=O)O)N MCULE-2145350496 [0,1,0,0,0,0|1,0,0]=2 338 B13R1.141 CCOC1=CC=C(C=C1C(=O)O)O MCULE-4305194110 [0,1,0,0,0,0|1,0,0]=2 339 B13R1.141 CCOC1=CC=C(C=C1C(C)C)Br MCULE-3730289701 [0,1,0,0,0,0|2,0,1]=4 340 B13R1.141 CCOC1=CC=C(C=C1C(C)C)I MCULE-9053535850 [0,1,0,0,0,0|2,0,1]=4 341 B13R1.141 CCOC1=CC=C(C=C1C(C)N)C MCULE-2919351128 [0,1,0,0,0,0|1,0,1]=3 342 B13R1.141 CCOC1=CC=C(C=C1C(C)N)F MCULE-1324285345 [0,1,0,0,0,0|1,0,1]=3 343 B13R1.141 CCOC1=CC=C(C=C1C(C)O)C MCULE-3711489653 [0,1,0,0,0,0|1,0,2]=4 344 B13R1.141 CCOC1=CC=C(C=C1C(C)O)Cl MCULE-2059902974 [0,1,0,0,0,0|1,0,2]=4 345 B13R1.141 CCOC1=CC=C(C=C1N(=O)=O)C MCULE-5088232737 [0,1,0,0,0,0|2,0,0]=3 346 B13R1.141 CCOC1=CC=C(C=C1N(=O)=O)N MCULE-2269616317 [0,1,0,0,0,0|2,0,0]=3 347 B13R1.141 CCOC1=CC=C(C=C1N(=O)=O)O MCULE-2997783500 [0,1,0,0,0,0|2,0,0]=3 348 B13R1.141 CCOC1=CC=C(C=C1[C@@H](C)N)Br MCULE-7801590174 [0,1,0,0,0,0|1,0,1]=3 349 B13R1.141 CCOC1=CC=C(N=C1C(=O)O)Br MCULE-6578795778 [0,1,0,0,0,0|2,0,0]=3 350 B13R1.141 CCOC1=CC=C(N=C1N(=O)=O)Br MCULE-3612329883 [0,1,0,0,0,0|3,0,0]=4 351 B13R1.141 CCOC1=NC=C(C=C1C(=O)O)Br MCULE-6523686123 [0,1,0,0,0,0|2,0,0]=3 352 B13R1.141 CCOC1=NC=C(C=C1C(=O)O)Cl MCULE-3307315662 [0,1,0,0,0,0|2,0,0]=3 353 B13R1.141 CCOC1=NC=C(C=C1C(=O)O)I MCULE-8994737374 [0,1,0,0,0,0|2,0,0]=3 354 B13R1.141 CCOC1=NC=C(C=C1N(=O)=O)Br MCULE-1557293031 [0,1,0,0,0,0|3,0,0]=4 355 B13R1.141 CCOC1=NC=C(C=C1N(=O)=O)Cl MCULE-9784066696 [0,1,0,0,0,0|3,0,0]=4 356 B13R1.141 CCSC1=C(C=C(C=C1)Cl)C(=O)O MCULE-7828619472 [0,1,0,0,0,0|1,1,0]=3 357 B13R1.141 CCSC1=C(C=C(C=C1)Cl)N(=O)=O MCULE-9838976852 [0,1,0,0,0,0|2,1,0]=4 358 B13R1.141 CCSC1=CC=C(C=C1C(=O)C)Cl MCULE-5830902164 [0,1,0,0,0,0|1,1,0]=3 359 B13R1.141 CCSC1=CC=C(N=C1C(=O)O)F MCULE-8411266603 [0,1,0,0,0,0|2,1,0]=4 360 B13R1.356 CCCC1=CC(=CC=C1C(=O)[O-])O MCULE-2896611650 [0,1,0,0,0,0|2,0,0]=3 361 B13R1.356 CCCC1=CC(=CC=C1C(=O)[O-])O MCULE-3662535461 [0,1,0,0,0,0|2,0,0]=3 362 B13R1.356 CCNC1=C(C=CC(=C1)C)N(=O)=O MCULE-2702296575 [0,1,0,0,0,0|3,0,0]=4 363 B13R1.356 CCNC1=C(C=CC(=C1)Cl)C(=O)O MCULE-9482346050 [0,1,0,0,0,0|2,0,0]=3 364 B13R1.356 CCNC1=C(C=CC(=C1)F)C(=O)N MCULE-2446870304 [0,1,0,0,0,0|1,0,0]=2 365 B13R1.356 CCNC1=C(C=CC(=N1)Cl)C(=O)O MCULE-7122952542 [0,1,0,0,0,0|3,0,0]=4 366 B13R1.356 CCNC1=CC(=CC=C1C(=O)O)Br MCULE-8895539111 [0,1,0,0,0,0|2,0,0]=3 367 B13R1.356 CCNC1=CC(=CC=C1C(=O)O)C MCULE-1203422405 [0,1,0,0,0,0|2,0,0]=3 368 B13R1.356 CCNC1=CC(=CC=C1C(=O)O)F MCULE-3778959420 [0,1,0,0,0,0|2,0,0]=3 369 B13R1.356 CCNC1=CC(=CC=C1N(=O)=O)Br MCULE-6900871452 [0,1,0,0,0,0|3,0,0]=4 370 B13R1.356 CCNC1=CC(=CC=C1N(=O)=O)Cl MCULE-6717365555 [0,1,0,0,0,0|3,0,0]=4 371 B13R1.356 CCNC1=CC(=CC=C1N(=O)=O)F MCULE-9387808331 [0,1,0,0,0,0|3,0,0]=4 372 B13R1.356 CCNC1=CC(=CC=C1N(=O)=O)O MCULE-7892873992 [0,1,0,0,0,0|3,0,0]=4 373 B13R1.356 CCOC1=C(C=CC(=C1)Br)C(=N)N MCULE-7618146679 [0,1,0,0,0,0|1,0,0]=2 374 B13R1.356 CCOC1=C(C=CC(=C1)Br)C(=O)C MCULE-3039354973 [0,1,0,0,0,0|1,0,0]=2 375 B13R1.356 CCOC1=C(C=CC(=C1)Br)N(=O)=O MCULE-7081935527 [0,1,0,0,0,0|2,0,0]=3 376 B13R1.356 CCOC1=C(C=CC(=C1)C)B(O)O MCULE-5209695951 [0,1,0,0,0,0|2,0,1]=4 377 B13R1.356 CCOC1=C(C=CC(=C1)Cl)C(=O)O MCULE-2338871901 [0,1,0,0,0,0|1,0,0]=2 378 B13R1.356 CCOC1=C(C=CC(=C1)Cl)N(=O)=O MCULE-9413286007 [0,1,0,0,0,0|2,0,0]=3 379 B13R1.356 CCOC1=C(C=CC(=C1)F)C(=O)Cl MCULE-8884757388 [0,1,0,0,0,0|1,0,0]=2 380 B13R1.356 CCOC1=C(C=CC(=C1)F)C(C)N MCULE-9495346133 [0,1,0,0,0,0|1,0,1]=3 381 B13R1.356 CCOC1=C(C=CC(=C1)F)C(C)O MCULE-9299934388 [0,1,0,0,0,0|1,0,2]=4 382 B13R1.356 CCOC1=C(C=CC(=C1)N)C(=O)N MCULE-1678899586 [0,1,0,0,0,0|0,0,0]=1 383 B13R1.356 CCOC1=C(C=CC(=C1)N)N(=O)=O MCULE-5079902138 [0,1,0,0,0,0|2,0,0]=3 384 B13R1.356 CCOC1=C(C=CC(=C1)O)N(=O)=O MCULE-8884653822 [0,1,0,0,0,0|2,0,0]=3 385 B13R1.356 CCOC1=C(C=CC(=N1)C)C(=O)O MCULE-9395780971 [0,1,0,0,0,0|2,0,0]=3 386 B13R1.356 CCOC1=C(C=CC(=N1)Cl)C(=O)O MCULE-9380775053 [0,1,0,0,0,0|2,0,0]=3 387 B13R1.356 CCOC1=C(C=NC(=C1)Cl)C(=O)O MCULE-9582523427 [0,1,0,0,0,0|2,0,0]=3 388 B13R1.356 CCOC1=CC(=CC=C1B(O)O)Br MCULE-4228642449 [0,1,0,0,0,0|2,0,1]=4 389 B13R1.356 CCOC1=CC(=CC=C1B(O)O)Cl MCULE-3365833970 [0,1,0,0,0,0|2,0,1]=4 390 B13R1.356 CCOC1=CC(=CC=C1B(O)O)F MCULE-2786372230 [0,1,0,0,0,0|2,0,1]=4 391 B13R1.356 CCOC1=CC(=CC=C1C(=N)N)Br MCULE-9822644262 [0,1,0,0,0,0|1,0,0]=2 392 B13R1.356 CCOC1=CC(=CC=C1C(=O)C)Cl MCULE-1041227445 [0,1,0,0,0,0|1,0,0]=2 393 B13R1.356 CCOC1=CC(=CC=C1C(=O)C)F MCULE-1536452635 [0,1,0,0,0,0|1,0,0]=2 394 B13R1.356 CCOC1=CC(=CC=C1C(=O)N)Br MCULE-1119494555 [0,1,0,0,0,0|0,0,0]=1 395 B13R1.356 CCOC1=CC(=CC=C1C(=O)O)Br MCULE-3576989226 [0,1,0,0,0,0|1,0,0]=2 396 B13R1.356 CCOC1=CC(=CC=C1C(=O)O)F MCULE-4670163209 [0,1,0,0,0,0|1,0,0]=2 397 B13R1.356 CCOC1=CC(=CC=C1C(C)N)Br MCULE-2525677126 [0,1,0,0,0,0|1,0,1]=3 398 B13R1.356 CCOC1=CC(=CC=C1C(C)N)C MCULE-2172564447 [0,1,0,0,0,0|1,0,1]=3 399 B13R1.356 CCOC1=CC(=CC=C1C(C)N)C MCULE-9089153302 [0,1,0,0,0,0|1,0,1]=3 400 B13R1.356 CCOC1=CC(=CC=C1C(C)N)Cl MCULE-6510563301 [0,1,0,0,0,0|1,0,1]=3 401 B13R1.356 CCOC1=CC(=CC=C1C(C)N)Cl MCULE-8547854406 [0,1,0,0,0,0|1,0,1]=3 402 B13R1.356 CCOC1=CC(=CC=C1C(F)F)Br MCULE-7500189750 [0,1,0,0,0,0|2,0,1]=4 403 B13R1.356 CCOC1=CC(=CC=C1N(=O)=O)F MCULE-5925873114 [0,1,0,0,0,0|2,0,0]=3 404 B13R1.356 CCOC1=NC(=CC=C1N(=O)=O)Cl MCULE-6771641922 [0,1,0,0,0,0|3,0,0]=4 405 B13R1.356 CCSC1=C(C=CC(=C1)Cl)C(=O)O MCULE-3440241654 [0,1,0,0,0,0|1,1,0]=3 406 B13R1.356 CCSC1=C(N=CC(=C1)Cl)C(=O)O MCULE-7059890652 [0,1,0,0,0,0|2,1,0]=4 407 B13R1.356 CCSC1=CC(=CC=C1C(=O)N)N MCULE-6827871916 [0,1,0,0,0,0|0,1,0]=2 408 B13R1.381 CCCC1=C(C=CC=C1)S(=O)(=O)Cl MCULE-1357913161 [0,1,0,0,0,0|3,0,0]=4 409 B13R1.381 CCCC1=C(C=CC=C1)S(=O)(=O)N MCULE-1187392528 [0,1,0,0,0,0|2,0,0]=3 410 B13R1.381 CCNC1=C(C=CC=C1)S(=O)(=O)C MCULE-9264957636 [0,1,0,0,0,0|3,0,0]=4 411 B13R1.381 CCNC1=C(C=CC=C1)S(=O)(=O)N MCULE-9956602369 [0,1,0,0,0,0|2,0,0]=3 412 B13R1.381 CCOC1=C(C=CC=C1)S(=O)(=O)Cl MCULE-3963383093 [0,1,0,0,0,0|2,0,0]=3 413 B13R1.381 CCOC1=C(C=CC=C1)S(=O)(=O)N MCULE-4073974852 [0,1,0,0,0,0|1,0,0]=2 414 B13R1.381 CCOC1=C(C=CC=N1)S(=O)(=O)N MCULE-4205843855 [0,1,0,0,0,0|2,0,0]=3 415 B13R1.381 CCOC1=C(C=NC=C1)S(=O)(=O)Cl MCULE-7959585266 [0,1,0,0,0,0|3,0,0]=4 416 B13R1.381 CCOC1=C(C=NC=C1)S(=O)(=O)N MCULE-5626011212 [0,1,0,0,0,0|2,0,0]=3 417 B13R1.381 CCOC1=CC=CC=C1P(=O)(O)O MCULE-5905874313 [0,1,0,0,0,0|2,0,0]=3 418 B13R1.381 CCOC1=NC=CC=C1S(=O)(=O)Cl MCULE-6181346843 [0,1,0,0,0,0|3,0,0]=4 419 B13R1.381 CCSC1=C(C=CC=N1)S(=O)(=O)N MCULE-5449852461 [0,1,0,0,0,0|2,1,0]=4 420 B13R1.381 CNCC1=C(C=CC=C1)S(=O)(=O)N MCULE-1971695698 [0,1,0,0,0,0|3,0,0]=4 421 B13R1.381 CNCC1=C(C=CC=C1)S(=O)(=O)N MCULE-7954449690 [0,1,0,0,0,0|3,0,0]=4 422 B13R1.381 COCC1=C(C=CC=C1)S(=O)(=O)N MCULE-9418637053 [0,1,0,0,0,0|3,0,0]=4 423 B13R1.381 O=S(=O)(O)C1=CC=CC=C1OCO MCULE-8491809472 [0,1,0,0,0,0|3,0,0]=4 424 B13R1.381 O=S(=O)([O-])C1=CC=CC=C1OCO MCULE-5268734192 [0,1,0,0,0,0|3,0,0]=4 425 B13R1.382 C=CCC1=CC=CC=C1C(=O)NC MCULE-1497855447 [0,1,0,0,0,0|1,0,2]=4 426 B13R1.382 C=C[C@@H](N)C1=C(C=CC=C1)OCC MCULE-6945182880 [0,1,0,0,0,0|1,0,1]=3 427 B13R1.382 C=C[C@@H](N)C1=C(C=CC=C1)OCC MCULE-8406930517 [0,1,0,0,0,0|1,0,1]=3 428 B13R1.382 C=C[C@H](N)C1=C(C=CC=C1)OCC MCULE-6682760167 [0,1,0,0,0,0|1,0,1]=3 429 B13R1.382 C=C[C@H](N)C1=C(C=CC=C1)OCC MCULE-6719054527 [0,1,0,0,0,0|1,0,1]=3 430 B13R1.382 CCNC1=C(C=CC=C1)C(=O)OC MCULE-5583994939 [0,1,0,0,0,0|2,0,0]=3 431 B13R1.382 CCOC1=C(C=CC=C1)/C(=N/O)/N MCULE-3667329545 [0,1,0,0,0,0|0,0,1]=2 432 B13R1.382 CCOC1=C(C=CC=C1)/C(=N\O)/C MCULE-8714902440 [0,1,0,0,0,0|1,0,1]=3 433 B13R1.382 CCOC1=C(C=CC=C1)C(=NO)C MCULE-4293341793 [0,1,0,0,0,0|1,0,1]=3 434 B13R1.382 CCOC1=C(C=CC=C1)C(=O)NN MCULE-9463279013 [0,1,0,0,0,0|0,0,0]=1 435 B13R1.382 CCOC1=C(C=CC=C1)C(N)CC MCULE-8750705217 [0,1,0,0,0,0|1,0,1]=3 436 B13R1.382 CCOC1=C(C=CC=C1)[C@@H](N)CC MCULE-5517482852 [0,1,0,0,0,0|1,0,1]=3 437 B13R1.382 CCOC1=C(C=CC=C1)[C@@H](N)CF MCULE-7872977204 [0,1,0,0,0,0|1,0,1]=3 438 B13R1.382 CCOC1=C(C=CC=C1)[C@@H](N)CF MCULE-8627181967 [0,1,0,0,0,0|1,0,1]=3 439 B13R1.382 CCOC1=C(C=CC=C1)[C@@H](N)CN MCULE-4183469403 [0,1,0,0,0,0|1,0,1]=3 440 B13R1.382 CCOC1=C(C=CC=C1)[C@@H](N)CN MCULE-5686941670 [0,1,0,0,0,0|1,0,1]=3 441 B13R1.382 CCOC1=C(C=CC=C1)[C@@H](N)CO MCULE-4697038831 [0,1,0,0,0,0|0,0,2]=3 442 B13R1.382 CCOC1=C(C=CC=C1)[C@@H](N)CO MCULE-5493920468 [0,1,0,0,0,0|0,0,2]=3 443 B13R1.382 CCOC1=C(C=CC=C1)[C@H](N)CC MCULE-7618688000 [0,1,0,0,0,0|1,0,1]=3 444 B13R1.382 CCOC1=C(C=CC=C1)[C@H](N)CF MCULE-4337344892 [0,1,0,0,0,0|1,0,1]=3 445 B13R1.382 CCOC1=C(C=CC=C1)[C@H](N)CF MCULE-6469573544 [0,1,0,0,0,0|1,0,1]=3 446 B13R1.382 CCOC1=C(C=CC=C1)[C@H](N)CN MCULE-6036726813 [0,1,0,0,0,0|1,0,1]=3 447 B13R1.382 CCOC1=C(C=CC=C1)[C@H](N)CN MCULE-7672055603 [0,1,0,0,0,0|1,0,1]=3 448 B13R1.382 CCOC1=C(C=CC=C1)[C@H](N)CO MCULE-1354289300 [0,1,0,0,0,0|0,0,2]=3 449 B13R1.382 CCOC1=C(C=CC=C1)[C@H](N)CO MCULE-8330551392 [0,1,0,0,0,0|0,0,2]=3 450 B13R1.382 CCOC1=CC=CC=C1C(=N)NN MCULE-3235127967 [0,1,0,0,0,0|1,0,0]=2 451 B13R1.382 CCOC1=CC=CC=C1C(=O)CBr MCULE-1610911785 [0,1,0,0,0,0|1,0,0]=2 452 B13R1.382 CCOC1=CC=CC=C1C(=O)CC MCULE-4353037826 [0,1,0,0,0,0|1,0,0]=2 453 B13R1.382 CCOC1=CC=CC=C1C(=O)NC MCULE-6123733784 [0,1,0,0,0,0|0,0,0]=1 454 B13R1.382 CCOC1=CC=CC=C1C(=O)OC MCULE-8620529786 [0,1,0,0,0,0|1,0,0]=2 455 B13R1.382 CCOC1=CC=CC=C1[C@@H](N)CC MCULE-3352351334 [0,1,0,0,0,0|1,0,1]=3 456 B13R1.382 CCOC1=CC=CC=C1[C@H](N)CC MCULE-6068773790 [0,1,0,0,0,0|1,0,1]=3 457 B13R1.382 CCOC1=NC=CC=C1C(=O)OC MCULE-6879220346 [0,1,0,0,0,0|2,0,0]=3 458 B13R1.382 CCSC1=C(C=CC=C1)C(=O)NC MCULE-6616045218 [0,1,0,0,0,0|0,1,0]=2 459 B13R1.382 CNCC1=C(C=CC=C1)C(=O)OC MCULE-5895939490 [0,1,0,0,0,0|3,0,0]=4 460 B13R1.382 CNCC1=C(C=CC=C1)C(=O)OC MCULE-6680663632 [0,1,0,0,0,0|3,0,0]=4 461 B13R1.382 COC(=O)C1=C(C=CC=C1)CCCl MCULE-7847917583 [0,1,0,0,0,0|3,0,0]=4 462 B13R1.382 COC(=O)C1=C(C=CC=C1)CCN MCULE-2819590391 [0,1,0,0,0,0|3,0,0]=4 463 B13R1.382 COC(=O)C1=C(C=CC=C1)CCN MCULE-8591467686 [0,1,0,0,0,0|3,0,0]=4 464 B13R1.382 COC(=O)C1=CC=CC=C1CCBr MCULE-1421319291 [0,1,0,0,0,0|3,0,0]=4 465 B13R1.382 COC(=O)C1=CC=CC=C1CCO MCULE-8292693627 [0,1,0,0,0,0|3,0,0]=4 466 B13R1.382 COCC1=CC=CC=C1C(=O)OC MCULE-6895368420 [0,1,0,0,0,0|3,0,0]=4 467 B13R1.547 CCC(=O)C1=C(C=CC=C1)N(=O)=O MCULE-8996782177 [0,1,0,0,0,0|3,0,0]=4 468 B13R1.547 CCC(=O)C1=CC=CC=C1C(=O)O MCULE-8857715556 [0,1,0,0,0,0|2,0,0]=3 469 B13R1.547 CCC(C)C1=CC=CC=C1N(=O)=O MCULE-1130354122 [0,1,0,0,0,0|3,0,0]=4 470 B13R1.547 CCS(=O)C1=C(C=CC=C1)C(=O)O MCULE-9408058966 [0,1,0,0,0,0|1,1,0]=3 471 B13R1.547 CC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-9008393501 [0,1,0,0,0,0|2,0,0]=3 472 B13R1.547 CC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-9574810428 [0,1,0,0,0,0|2,0,0]=3 473 B13R1.547 CC[C@@H](N)C1=CC=CC=C1[N+](=O)[O-] MCULE-4742334957 [0,1,0,0,0,0|3,0,0]=4 474 B13R1.547 CC[C@@H](N)C1=CC=CC=C1[N+](=O)[O-] MCULE-7854586930 [0,1,0,0,0,0|3,0,0]=4 475 B13R1.547 CC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-5100687880 [0,1,0,0,0,0|2,0,0]=3 476 B13R1.547 CC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-8276676399 [0,1,0,0,0,0|2,0,0]=3 477 B13R1.547 CC[C@H](N)C1=CC=CC=C1[N+](=O)[O-] MCULE-5301255273 [0,1,0,0,0,0|3,0,0]=4 478 B13R1.547 CC[C@H](N)C1=CC=CC=C1[N+](=O)[O-] MCULE-8752003590 [0,1,0,0,0,0|3,0,0]=4 479 B13R1.547 COC(=O)C1=CC=CC=C1C(=O)C MCULE-6297416373 [0,1,0,0,0,0|3,0,0]=4 480 B13R1.547 COC(=O)C1=CC=CC=C1C(=O)Cl MCULE-9936711468 [0,1,0,0,0,0|3,0,0]=4 481 B13R1.547 COC(=O)C1=CC=CC=C1C(=O)N MCULE-9145284532 [0,1,0,0,0,0|2,0,0]=3 482 B13R1.547 COC(=O)C1=CC=CC=C1C(=O)O MCULE-2559625268 [0,1,0,0,0,0|3,0,0]=4 483 B13R1.547 COC(=O)C1=NC=CC=C1C(=O)N MCULE-3333569633 [0,1,0,0,0,0|3,0,0]=4 484 B13R1.547 NC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-1352554914 [0,1,0,0,0,0|3,0,0]=4 485 B13R1.547 NC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-4669578884 [0,1,0,0,0,0|3,0,0]=4 486 B13R1.547 NC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-7466303887 [0,1,0,0,0,0|3,0,0]=4 487 B13R1.547 NC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-9918620005 [0,1,0,0,0,0|3,0,0]=4 488 B13R1.547 N[C@@H](CF)C1=CC=CC=C1C(=O)O MCULE-1542893430 [0,1,0,0,0,0|3,0,0]=4 489 B13R1.547 N[C@@H](CF)C1=CC=CC=C1C(=O)O MCULE-6848929765 [0,1,0,0,0,0|3,0,0]=4 490 B13R1.547 N[C@@H](CO)C1=C(C=CC=C1)C(=O)O MCULE-1955749189 [0,1,0,0,0,0|3,0,0]=4 491 B13R1.547 N[C@@H](CO)C1=CC=CC=C1C(=O)O MCULE-5022798616 [0,1,0,0,0,0|3,0,0]=4 492 B13R1.547 N[C@H](CF)C1=CC=CC=C1C(=O)O MCULE-3814281072 [0,1,0,0,0,0|3,0,0]=4 493 B13R1.547 N[C@H](CF)C1=CC=CC=C1C(=O)O MCULE-3832753154 [0,1,0,0,0,0|3,0,0]=4 494 B13R1.547 N[C@H](CO)C1=C(C=CC=C1)C(=O)O MCULE-8482127173 [0,1,0,0,0,0|3,0,0]=4 495 B13R1.547 N[C@H](CO)C1=CC=CC=C1C(=O)O MCULE-6982607666 [0,1,0,0,0,0|3,0,0]=4 496 B13R1.547 O=C(O)C1=CC=CC=C1C(=O)CBr MCULE-4728185281 [0,1,0,0,0,0|3,0,0]=4 497 B13R1.572 C#CCOC1=C(C=CC=C1)C(=O)O MCULE-7741074874 [0,1,0,0,0,0|1,0,1]=3 498 B13R1.572 C#CCOC1=C(C=CC=C1)N(=O)=O MCULE-6478929269 [0,1,0,0,0,0|2,0,1]=4 499 B13R1.572 C#CCOC1=C(C=CC=N1)C(=O)O MCULE-5309930788 [0,1,0,0,0,0|2,0,1]=4 500 B13R1.572 C#CCOC1=CC=CC=C1C(=O)N MCULE-3799980458 [0,1,0,0,0,0|0,0,1]=2 501 B13R1.572 C#CCSC1=C(C=CC=C1)C(=O)O MCULE-5839235873 [0,1,0,0,0,0|1,1,1]=4 502 B13R1.572 C=CCCC1=CC=CC=C1C(=O)O MCULE-5632595640 [0,1,0,0,0,0|2,0,1]=4 503 B13R1.572 C=CCNC1=C(C=CC=C1)C(=O)O MCULE-9702416960 [0,1,0,0,0,0|2,0,1]=4 504 B13R1.572 C=CCOC1=C(C=CC=C1)C(=O)O MCULE-1089670819 [0,1,0,0,0,0|1,0,1]=3 505 B13R1.572 C=CCOC1=C(N=CC=C1)C(=O)O MCULE-4255266743 [0,1,0,0,0,0|2,0,1]=4 506 B13R1.572 C=CCOC1=CC=CC=C1C(=O)C MCULE-6800168848 [0,1,0,0,0,0|1,0,1]=3 507 B13R1.572 C=CCOC1=CC=CC=C1C(C)N MCULE-1166335459 [0,1,0,0,0,0|1,0,2]=4 508 B13R1.572 C=CCOC1=CC=CC=C1N(=O)=O MCULE-9533221214 [0,1,0,0,0,0|2,0,1]=4 509 B13R1.572 C=CCSC1=C(C=CC=C1)C(=O)O MCULE-1695833130 [0,1,0,0,0,0|1,1,1]=4 510 B13R1.572 CC(=O)C1=C(C=CC=C1)OCCBr MCULE-1480010588 [0,1,0,0,0,0|1,0,0]=2 511 B13R1.572 CC(=O)C1=CC=CC=C1NCC#N MCULE-2197107891 [0,1,0,0,0,0|2,0,1]=4 512 B13R1.572 CC(=O)C1=CC=CC=C1OCC#N MCULE-1783113678 [0,1,0,0,0,0|1,0,1]=3 513 B13R1.572 CC(C)C1=C(C=CC=C1)OCCBr MCULE-8604314553 [0,1,0,0,0,0|2,0,1]=4 514 B13R1.572 CC(C)C1=C(C=CC=C1)OCCN MCULE-1512265748 [0,1,0,0,0,0|2,0,1]=4 515 B13R1.572 CC(C)C1=C(C=CC=C1)OCCN MCULE-2640726131 [0,1,0,0,0,0|2,0,1]=4 516 B13R1.572 CC(C)C1=CC=CC=C1OCCO MCULE-8914507998 [0,1,0,0,0,0|2,0,1]=4 517 B13R1.572 CCCCC1=C(C=CC=C1)S(=O)[O-] MCULE-1377248898 [0,1,0,0,0,0|3,0,0]=4 518 B13R1.572 CCCCC1=C(C=CC=C1)S(=O)[O-] MCULE-5584840118 [0,1,0,0,0,0|3,0,0]=4 519 B13R1.572 CCCCC1=CC=CC=C1N(=O)=O MCULE-5486377007 [0,1,0,0,0,0|3,0,0]=4 520 B13R1.572 CCCNC1=C(C=CC=C1)C(=O)O MCULE-2686863166 [0,1,0,0,0,0|2,0,0]=3 521 B13R1.572 CCCNC1=C(C=CC=N1)C(=O)N MCULE-4755931477 [0,1,0,0,0,0|2,0,0]=3 522 B13R1.572 CCCNC1=C(C=CC=N1)C(=O)O MCULE-8200252997 [0,1,0,0,0,0|3,0,0]=4 523 B13R1.572 CCCOC1=C(C=CC=C1)C(=O)Cl MCULE-8210790334 [0,1,0,0,0,0|1,0,0]=2 524 B13R1.572 CCCOC1=C(C=CC=C1)C(=O)O MCULE-4040231132 [0,1,0,0,0,0|1,0,0]=2 525 B13R1.572 CCCOC1=C(C=CC=C1)C(=S)N MCULE-7349568312 [0,1,0,0,0,0|0,1,0]=2 526 B13R1.572 CCCOC1=C(C=CC=C1)C(C)N MCULE-6758269445 [0,1,0,0,0,0|1,0,1]=3 527 B13R1.572 CCCOC1=C(C=CC=C1)C(C)N MCULE-8054744170 [0,1,0,0,0,0|1,0,1]=3 528 B13R1.572 CCCOC1=C(C=CC=N1)C(=O)N MCULE-2575608500 [0,1,0,0,0,0|1,0,0]=2 529 B13R1.572 CCCOC1=C(C=CC=N1)C(=O)O MCULE-2016017979 [0,1,0,0,0,0|2,0,0]=3 530 B13R1.572 CCCOC1=C(N=CC=C1)C(=O)O MCULE-3598840448 [0,1,0,0,0,0|2,0,0]=3 531 B13R1.572 CCCOC1=CC=CC=C1B(O)O MCULE-8328492055 [0,1,0,0,0,0|2,0,1]=4 532 B13R1.572 CCCOC1=CC=CC=C1C(=N)N MCULE-6467101067 [0,1,0,0,0,0|1,0,0]=2 533 B13R1.572 CCCOC1=CC=CC=C1C(=O)C MCULE-3884621389 [0,1,0,0,0,0|1,0,0]=2 534 B13R1.572 CCCOC1=CC=CC=C1C(=O)N MCULE-3029543543 [0,1,0,0,0,0|0,0,0]=1 535 B13R1.572 CCCOC1=CC=CC=C1C(C)O MCULE-2342045926 [0,1,0,0,0,0|1,0,2]=4 536 B13R1.572 CCCOC1=CC=CC=C1N(=O)=O MCULE-8355957094 [0,1,0,0,0,0|2,0,0]=3 537 B13R1.572 CCCOC1=CC=CN=C1C(=N)N MCULE-5015008725 [0,1,0,0,0,0|2,0,0]=3 538 B13R1.572 CCCOC1=CC=CN=C1C(=N)N MCULE-7554619292 [0,1,0,0,0,0|2,0,0]=3 539 B13R1.572 CCCSC1=C(C=CC=C1)C(=O)C MCULE-3953451992 [0,1,0,0,0,0|1,1,0]=3 540 B13R1.572 CCCSC1=C(C=CC=C1)C(=O)Cl MCULE-5010866395 [0,1,0,0,0,0|1,1,0]=3 541 B13R1.572 CCCSC1=C(C=CC=C1)C(=O)N MCULE-6795941589 [0,1,0,0,0,0|0,1,0]=2 542 B13R1.572 CCCSC1=C(C=CC=C1)C(=O)O MCULE-6053101485 [0,1,0,0,0,0|1,1,0]=3 543 B13R1.572 CCCSC1=C(C=CC=N1)C(=O)N MCULE-7750921543 [0,1,0,0,0,0|1,1,0]=3 544 B13R1.572 CCCSC1=C(C=CC=N1)C(=O)O MCULE-9640193622 [0,1,0,0,0,0|2,1,0]=4 545 B13R1.572 CCCSC1=NC=CC=C1C(=O)Cl MCULE-2694537248 [0,1,0,0,0,0|2,1,0]=4 546 B13R1.572 CCNCC1=C(C=CC=C1)C(=O)O MCULE-4361791787 [0,1,0,0,0,0|2,0,0]=3 547 B13R1.572 CCNCC1=C(C=CC=C1)C(=O)O MCULE-6028265223 [0,1,0,0,0,0|2,0,0]=3 548 B13R1.572 CCNCC1=C(C=CC=C1)N(=O)=O MCULE-6063380604 [0,1,0,0,0,0|3,0,0]=4 549 B13R1.572 CCNCC1=C(C=CC=C1)N(=O)=O MCULE-7027231264 [0,1,0,0,0,0|3,0,0]=4 550 B13R1.572 CCOCC1=CC=CC=C1B(O)O MCULE-8721913937 [0,1,0,0,0,0|2,0,1]=4 551 B13R1.572 CCOCC1=CC=CC=C1C(=O)O MCULE-7012384334 [0,1,0,0,0,0|1,0,0]=2 552 B13R1.572 CCSCC1=C(C=CC=C1)C(=O)O MCULE-1032867479 [0,1,0,0,0,0|1,1,0]=3 553 B13R1.572 CNCCC1=C(C=CC=C1)N(=O)=O MCULE-4076858499 [0,1,0,0,0,0|3,0,0]=4 554 B13R1.572 CNCCC1=C(C=CC=C1)N(=O)=O MCULE-9413477376 [0,1,0,0,0,0|3,0,0]=4 555 B13R1.572 COCCC1=C(C=CC=C1)C(=O)O MCULE-4800031009 [0,1,0,0,0,0|2,0,0]=3 556 B13R1.572 COCCC1=CC=CC=C1N(=O)=O MCULE-4726127410 [0,1,0,0,0,0|3,0,0]=4 557 B13R1.572 COCOC1=CC=CC=C1B(O)O MCULE-4061323324 [0,1,0,0,0,0|2,0,1]=4 558 B13R1.572 COCOC1=CC=CC=C1C(=O)C MCULE-7840841654 [0,1,0,0,0,0|1,0,0]=2 559 B13R1.572 COCOC1=CC=CC=C1C(C)C MCULE-1548760475 [0,1,0,0,0,0|2,0,1]=4 560 B13R1.572 N#CCOC1=CC=CC=C1C(=O)O MCULE-4069343397 [0,1,0,0,0,0|1,0,1]=3 561 B13R1.572 N#CCSC1=CC=CC=C1C(=O)O MCULE-6190273389 [0,1,0,0,0,0|1,1,1]=4 562 B13R1.572 NC(=O)C1=C(C=CC=C1)OCCCl MCULE-1036908877 [0,1,0,0,0,0|0,0,0]=1 563 B13R1.572 NC(=O)C1=C(C=CC=C1)OCCO MCULE-9109793930 [0,1,0,0,0,0|0,0,0]=1 564 B13R1.572 NC(=O)C1=CC=CC=C1NCCCl MCULE-1849239600 [0,1,0,0,0,0|1,0,0]=2 565 B13R1.572 NC(=O)C1=CC=CC=C1OCCBr MCULE-7751341846 [0,1,0,0,0,0|0,0,0]=1 566 B13R1.572 NCCNC1=CC=CC=C1C(=O)O MCULE-1486888569 [0,1,0,0,0,0|2,0,0]=3 567 B13R1.572 NCCNC1=CC=CC=C1C(=O)O MCULE-5947576201 [0,1,0,0,0,0|2,0,0]=3 568 B13R1.572 NCCNC1=CC=CC=C1N(=O)=O MCULE-4997110378 [0,1,0,0,0,0|3,0,0]=4 569 B13R1.572 NCCNC1=CC=CC=C1N(=O)=O MCULE-6272817235 [0,1,0,0,0,0|3,0,0]=4 570 B13R1.572 NCCNC1=NC=CC=C1C(=O)O MCULE-8241332120 [0,1,0,0,0,0|3,0,0]=4 571 B13R1.572 NCCOC1=CC=CC=C1C(=O)N MCULE-9991178429 [0,1,0,0,0,0|0,0,0]=1 572 B13R1.572 NCCOC1=CC=CC=C1N(=O)=O MCULE-1554855900 [0,1,0,0,0,0|2,0,0]=3 573 B13R1.572 NCCOC1=CC=CC=C1N(=O)=O MCULE-4131973841 [0,1,0,0,0,0|2,0,0]=3 574 B13R1.572 NCCSC1=CC=CC=C1C(=O)O MCULE-4576165477 [0,1,0,0,0,0|1,1,0]=3 575 B13R1.572 NCCSC1=CC=CC=C1C(=O)O MCULE-7455628895 [0,1,0,0,0,0|1,1,0]=3 576 B13R1.572 O=C(O)C1=C(C=CC=C1)NCCO MCULE-8120654197 [0,1,0,0,0,0|2,0,0]=3 577 B13R1.572 O=C(O)C1=C(C=CC=C1)OCCO MCULE-7898157705 [0,1,0,0,0,0|1,0,0]=2 578 B13R1.572 O=C(O)C1=C(C=CC=C1)SCCO MCULE-5541181003 [0,1,0,0,0,0|1,1,0]=3 579 B13R1.572 O=C(O)C1=C(N=CC=C1)NCCO MCULE-3858468150 [0,1,0,0,0,0|3,0,0]=4 580 B13R1.572 O=C(O)C1=C(N=CC=C1)OCCO MCULE-3685380826 [0,1,0,0,0,0|2,0,0]=3 581 B13R1.572 O=C(O)C1=CC=CC=C1OCCF MCULE-6186730357 [0,1,0,0,0,0|1,0,0]=2 582 B13R1.572 O=C(O)C1=NC=CC=C1OCCO MCULE-4308585496 [0,1,0,0,0,0|2,0,0]=3 583 B13R1.572 O=C(O)C1=NC=CC=C1OCCO MCULE-6759099665 [0,1,0,0,0,0|2,0,0]=3 584 B13R1.572 O=N(=O)C1=C(C=CC=C1)CCCO MCULE-5990167925 [0,1,0,0,0,0|3,0,0]=4 585 B13R1.572 O=N(=O)C1=C(C=CC=C1)NCCO MCULE-4121150707 [0,1,0,0,0,0|3,0,0]=4 586 B13R1.572 O=N(=O)C1=C(C=CC=C1)OCCBr MCULE-3445768487 [0,1,0,0,0,0|2,0,0]=3 587 B13R1.572 O=N(=O)C1=C(C=CC=C1)OCCCl MCULE-2034458545 [0,1,0,0,0,0|2,0,0]=3 588 B13R1.572 O=N(=O)C1=C(C=CN=C1)OCCO MCULE-5109290190 [0,1,0,0,0,0|3,0,0]=4 589 B13R1.572 O=N(=O)C1=CC=CC=C1OCCF MCULE-6652018812 [0,1,0,0,0,0|2,0,0]=3 590 B13R1.572 O=N(=O)C1=CC=CC=C1OCCO MCULE-4282371980 [0,1,0,0,0,0|2,0,0]=3 591 B13R1.572 OB(O)C1=CC=CC=C1OCCCl MCULE-6684937728 [0,1,0,0,0,0|2,0,1]=4 592 B13R1.589 C=C(C)CC1=C(C=CC=C1)C(=O)O MCULE-9204819801 [0,1,0,0,0,0|2,0,1]=4 593 B13R1.589 CC(=O)C1=C(C=CC=C1)OC(F)F MCULE-9777354658 [0,1,0,0,0,0|2,0,0]=3 594 B13R1.589 CC(=O)C1=CC=CC=C1CN(C)C MCULE-1627011883 [0,1,0,0,0,0|3,0,0]=4 595 B13R1.589 CC(=O)C1=CC=CC=C1NC(C)C MCULE-7029410641 [0,1,0,0,0,0|2,0,0]=3 596 B13R1.589 CC(=O)C1=CC=CC=C1NC(C)C MCULE-9670103462 [0,1,0,0,0,0|2,0,0]=3 597 B13R1.589 CC(=O)C1=CC=CC=C1OC(C)C MCULE-2596469981 [0,1,0,0,0,0|1,0,0]=2 598 B13R1.589 CC(=O)C1=CC=CN=C1OC(C)C MCULE-4361464366 [0,1,0,0,0,0|2,0,0]=3 599 B13R1.589 CC(=O)CC1=CC=CC=C1C(=O)O MCULE-9138117669 [0,1,0,0,0,0|2,0,1]=4 600 B13R1.589 CC(=O)NC1=C(C=CC=C1)C(=O)C MCULE-7612602253 [0,1,0,0,0,0|2,0,1]=4 601 B13R1.589 CC(=O)NC1=C(C=CC=C1)C(=O)N MCULE-5393805902 [0,1,0,0,0,0|1,0,1]=3 602 B13R1.589 CC(=O)NC1=C(C=NC=C1)C(=O)N MCULE-8367142153 [0,1,0,0,0,0|2,0,1]=4 603 B13R1.589 CC(=O)NC1=CC=CC=C1C(=O)O MCULE-5493843354 [0,1,0,0,0,0|2,0,1]=4 604 B13R1.589 CC(=O)OC1=C(C=CC=C1)C(=O)C MCULE-4610880324 [0,1,0,0,0,0|1,0,1]=3 605 B13R1.589 CC(=O)OC1=C(C=CC=C1)C(=O)Cl MCULE-4612770101 [0,1,0,0,0,0|1,0,1]=3 606 B13R1.589 CC(=O)OC1=C(C=CC=C1)C(=O)O MCULE-3199019536 [0,1,0,0,0,0|1,0,1]=3 607 B13R1.589 CC(=O)OC1=C(C=CC=C1)N(=O)=O MCULE-7872839877 [0,1,0,0,0,0|2,0,1]=4 608 B13R1.589 CC(=O)OC1=CC=CC=C1C(=O)N MCULE-7791245774 [0,1,0,0,0,0|0,0,1]=2 609 B13R1.589 CC(=O)OC1=CC=CC=C1C(=O)[O-] MCULE-1298755950 [0,1,0,0,0,0|1,0,1]=3 610 B13R1.589 CC(=O)SC1=CC=CC=C1C(=O)O MCULE-5814875567 [0,1,0,0,0,0|1,1,1]=4 611 B13R1.589 CC(C)CC1=C(C=CC=C1)C(=O)O MCULE-4167889243 [0,1,0,0,0,0|2,0,0]=3 612 B13R1.589 CC(C)CC1=CC=CC=C1N(=O)=O MCULE-1694406565 [0,1,0,0,0,0|3,0,0]=4 613 B13R1.589 CC(C)NC1=C(C=CC=C1)N(=O)=O MCULE-1980934489 [0,1,0,0,0,0|3,0,0]=4 614 B13R1.589 CC(C)NC1=C(C=CC=N1)C(=O)O MCULE-3244169290 [0,1,0,0,0,0|3,0,0]=4 615 B13R1.589 CC(C)NC1=C(C=NC=C1)C(=O)O MCULE-9200943649 [0,1,0,0,0,0|3,0,0]=4 616 B13R1.589 CC(C)NC1=CC=CC=C1C(=O)O MCULE-9316373608 [0,1,0,0,0,0|2,0,0]=3 617 B13R1.589 CC(C)OC1=C(C=CC=C1)C(=S)N MCULE-2752359685 [0,1,0,0,0,0|0,1,0]=2 618 B13R1.589 CC(C)OC1=C(C=CC=C1)C(C)N MCULE-9230545872 [0,1,0,0,0,0|1,0,1]=3 619 B13R1.589 CC(C)OC1=C(C=CN=C1)C(=O)O MCULE-9749293188 [0,1,0,0,0,0|2,0,0]=3 620 B13R1.589 CC(C)OC1=C(C=NC=C1)C(=O)O MCULE-3897169366 [0,1,0,0,0,0|2,0,0]=3 621 B13R1.589 CC(C)OC1=C(N=CC=C1)C(=O)O MCULE-7672788869 [0,1,0,0,0,0|2,0,0]=3 622 B13R1.589 CC(C)OC1=CC=CC=C1B(O)O MCULE-4624456904 [0,1,0,0,0,0|2,0,1]=4 623 B13R1.589 CC(C)OC1=CC=CC=C1C(=O)Cl MCULE-6680571747 [0,1,0,0,0,0|1,0,0]=2 624 B13R1.589 CC(C)OC1=CC=CC=C1C(=O)N MCULE-2735240047 [0,1,0,0,0,0|0,0,0]=1 625 B13R1.589 CC(C)OC1=CC=CC=C1C(=O)O MCULE-3438290382 [0,1,0,0,0,0|1,0,0]=2 626 B13R1.589 CC(C)OC1=CC=CC=C1C(C)C MCULE-5682509713 [0,1,0,0,0,0|2,0,1]=4 627 B13R1.589 CC(C)OC1=CC=CC=C1C(C)O MCULE-3156675633 [0,1,0,0,0,0|1,0,2]=4 628 B13R1.589 CC(C)OC1=CC=CC=C1N(=O)=O MCULE-3589835289 [0,1,0,0,0,0|2,0,0]=3 629 B13R1.589 CC(C)OC1=CC=CC=C1[C@@H](C)N MCULE-4869269126 [0,1,0,0,0,0|1,0,1]=3 630 B13R1.589 CC(C)OC1=CC=CC=C1[C@@H](C)N MCULE-6769406400 [0,1,0,0,0,0|1,0,1]=3 631 B13R1.589 CC(C)OC1=CC=CC=C1[C@H](C)N MCULE-7478256359 [0,1,0,0,0,0|1,0,1]=3 632 B13R1.589 CC(C)OC1=CC=CC=C1[C@H](C)N MCULE-9449181359 [0,1,0,0,0,0|1,0,1]=3 633 B13R1.589 CC(C)OC1=NC=CC=C1C(=O)O MCULE-9770301427 [0,1,0,0,0,0|2,0,0]=3 634 B13R1.589 CC(C)OC1=NC=CN=C1C(=O)O MCULE-8522775919 [0,1,0,0,0,0|3,0,0]=4 635 B13R1.589 CC(C)SC1=C(C=CC=C1)C(=O)O MCULE-5467128629 [0,1,0,0,0,0|1,1,0]=3 636 B13R1.589 CC(C)SC1=CC=CC=C1C(=O)N MCULE-3558797624 [0,1,0,0,0,0|0,1,0]=2 637 B13R1.589 CC(C)SC1=CC=CC=C1N(=O)=O MCULE-8208287485 [0,1,0,0,0,0|2,1,0]=4 638 B13R1.589 CC(N)C1=CC=CC=C1OC(F)F MCULE-5192264743 [0,1,0,0,0,0|2,0,1]=4 639 B13R1.589 CC(N)C1=CC=CC=C1OC(F)F MCULE-5543790953 [0,1,0,0,0,0|2,0,1]=4 640 B13R1.589 CN(C)CC1=C(C=CC=C1)C(=O)O MCULE-8960151808 [0,1,0,0,0,0|3,0,0]=4 641 B13R1.589 CN(C)CC1=C(C=CC=C1)C(=O)O MCULE-9158550136 [0,1,0,0,0,0|3,0,0]=4 642 B13R1.589 C[C@@H](N)C1=C(C=CC=C1)OC(F)F MCULE-3072127596 [0,1,0,0,0,0|2,0,1]=4 643 B13R1.589 C[C@@H](N)C1=C(C=CC=C1)OC(F)F MCULE-5216418106 [0,1,0,0,0,0|2,0,1]=4 644 B13R1.589 C[C@@H](N)CC1=CC=CC=C1C(=O)O MCULE-2756717856 [0,1,0,0,0,0|2,0,0]=3 645 B13R1.589 C[C@H](N)C1=C(C=CC=C1)OC(F)F MCULE-5162785114 [0,1,0,0,0,0|2,0,1]=4 646 B13R1.589 C[C@H](N)C1=C(C=CC=C1)OC(F)F MCULE-9092505615 [0,1,0,0,0,0|2,0,1]=4 647 B13R1.589 NC(=O)C1=C(C=CC=C1)CC(=O)O MCULE-9735756944 [0,1,0,0,0,0|2,0,1]=4 648 B13R1.589 NC(=O)C1=C(C=CC=C1)SC(F)F MCULE-4826402479 [0,1,0,0,0,0|1,1,0]=3 649 B13R1.589 O=C(Cl)C1=C(C=CC=C1)OC(F)F MCULE-2312880696 [0,1,0,0,0,0|2,0,0]=3 650 B13R1.589 O=C(Cl)C1=CC=CC=C1SC(F)F MCULE-9773070283 [0,1,0,0,0,0|2,1,0]=4 651 B13R1.589 O=C(O)C1=C(C=CC=C1)OC(F)F MCULE-3732956431 [0,1,0,0,0,0|2,0,0]=3 652 B13R1.589 O=C(O)C1=C(C=CC=C1)SC(F)F MCULE-3000258347 [0,1,0,0,0,0|2,1,0]=4 653 B13R1.589 O=C(O)C1=C(C=CC=N1)OC(F)F MCULE-7353523700 [0,1,0,0,0,0|3,0,0]=4 654 B13R1.589 O=C(O)C1=CC=CN=C1OC(F)F MCULE-8281497188 [0,1,0,0,0,0|3,0,0]=4 655 B13R1.589 O=C(O)C1=CC=NC=C1OC(F)F MCULE-8645943693 [0,1,0,0,0,0|3,0,0]=4 656 B13R1.589 O=C(O)C1=CN=CC=C1OC(F)F MCULE-2480374370 [0,1,0,0,0,0|3,0,0]=4 657 B13R1.589 O=N(=O)C1=CC=CC=C1OC(F)F MCULE-6408907029 [0,1,0,0,0,0|3,0,0]=4 658 B13R1.2897 CCNC1=C(C(=CC=C1)Br)C(=O)O MCULE-4915103590 [0,1,0,0,0,0|2,0,0]=3 659 B13R1.2897 CCNC1=C(C(=CC=C1)Cl)C(=O)O MCULE-9169336430 [0,1,0,0,0,0|2,0,0]=3 660 B13R1.2897 CCNC1=CC=CC(=C1C(=O)O)C MCULE-8599246721 [0,1,0,0,0,0|2,0,0]=3 661 B13R1.2897 CCNC1=CC=CC(=C1C(=O)O)F MCULE-3067552911 [0,1,0,0,0,0|2,0,0]=3 662 B13R1.2897 CCNC1=CC=CC(=C1N(=O)=O)C MCULE-9054940696 [0,1,0,0,0,0|3,0,0]=4 663 B13R1.2897 CCOC1=C(C(=CC=C1)Br)B(O)O MCULE-9138011165 [0,1,0,0,0,0|2,0,1]=4 664 B13R1.2897 CCOC1=C(C(=CC=C1)Br)N(=O)=O MCULE-3180264658 [0,1,0,0,0,0|2,0,0]=3 665 B13R1.2897 CCOC1=C(C(=CC=C1)C)N(=O)=O MCULE-7167820219 [0,1,0,0,0,0|2,0,0]=3 666 B13R1.2897 CCOC1=C(C(=CC=C1)Cl)C(=O)O MCULE-4900397693 [0,1,0,0,0,0|1,0,0]=2 667 B13R1.2897 CCOC1=C(C(=CC=C1)Cl)C(C)N MCULE-9471480540 [0,1,0,0,0,0|1,0,1]=3 668 B13R1.2897 CCOC1=C(C(=CC=C1)F)C(=O)O MCULE-2681082799 [0,1,0,0,0,0|1,0,0]=2 669 B13R1.2897 CCOC1=C(C(=CC=C1)F)N(=O)=O MCULE-8020094955 [0,1,0,0,0,0|2,0,0]=3 670 B13R1.2897 CCOC1=C(C(=CC=C1)N)N(=O)=O MCULE-9022233267 [0,1,0,0,0,0|2,0,0]=3 671 B13R1.2897 CCOC1=C(C(=CC=N1)C)C(=O)O MCULE-9422100797 [0,1,0,0,0,0|2,0,0]=3 672 B13R1.2897 CCOC1=CC=CC(=C1B(O)O)F MCULE-4789656515 [0,1,0,0,0,0|2,0,1]=4 673 B13R1.2897 CCOC1=CC=CC(=C1C(=O)C)O MCULE-5047679961 [0,1,0,0,0,0|1,0,0]=2 674 B13R1.2897 CCOC1=CC=CC(=C1C(=O)O)C MCULE-4323660831 [0,1,0,0,0,0|1,0,0]=2 675 B13R1.2897 CCOC1=CC=CC(=C1C(C)N)Cl MCULE-2719117958 [0,1,0,0,0,0|1,0,1]=3 676 B13R1.2897 COCC1=CC=CC(=C1C(=O)O)N MCULE-6355333323 [0,1,0,0,0,0|3,0,0]=4 677 B13R1.2897 COCC1=CC=CC(=C1C(=O)O)N MCULE-8477971033 [0,1,0,0,0,0|3,0,0]=4 678 B13R1.4012 CCCC1=C(C=CC=C1C(=O)O)Br MCULE-5761831931 [0,1,0,0,0,0|2,0,0]=3 679 B13R1.4012 CCNC1=C(C=CC=C1C(=O)O)Br MCULE-4104918553 [0,1,0,0,0,0|2,0,0]=3 680 B13R1.4012 CCNC1=C(C=CC=C1C(=O)O)F MCULE-3964078977 [0,1,0,0,0,0|2,0,0]=3 681 B13R1.4012 CCNC1=C(C=CC=C1C)C(=O)O MCULE-5475779470 [0,1,0,0,0,0|2,0,0]=3 682 B13R1.4012 CCNC1=C(C=CC=C1Cl)C(=O)O MCULE-9523026469 [0,1,0,0,0,0|2,0,0]=3 683 B13R1.4012 CCOC1=C(C=CC=C1B(O)O)Br MCULE-5325558585 [0,1,0,0,0,0|2,0,1]=4 684 B13R1.4012 CCOC1=C(C=CC=C1B(O)O)C MCULE-3393526212 [0,1,0,0,0,0|2,0,1]=4 685 B13R1.4012 CCOC1=C(C=CC=C1B(O)O)F MCULE-9963562425 [0,1,0,0,0,0|2,0,1]=4 686 B13R1.4012 CCOC1=C(C=CC=C1Br)C(C)C MCULE-4817537184 [0,1,0,0,0,0|2,0,1]=4 687 B13R1.4012 CCOC1=C(C=CC=C1C(=O)C)Br MCULE-4195027460 [0,1,0,0,0,0|1,0,0]=2 688 B13R1.4012 CCOC1=C(C=CC=C1C(=O)C)C MCULE-7372161266 [0,1,0,0,0,0|1,0,0]=2 689 B13R1.4012 CCOC1=C(C=CC=C1C(=O)C)Cl MCULE-2182999929 [0,1,0,0,0,0|1,0,0]=2 690 B13R1.4012 CCOC1=C(C=CC=C1C(=O)O)N MCULE-1306410500 [0,1,0,0,0,0|1,0,0]=2 691 B13R1.4012 CCOC1=C(C=CC=C1C(C)N)Br MCULE-5543459091 [0,1,0,0,0,0|1,0,1]=3 692 B13R1.4012 CCOC1=C(C=CC=C1C(C)N)Br MCULE-9325192732 [0,1,0,0,0,0|1,0,1]=3 693 B13R1.4012 CCOC1=C(C=CC=C1C(C)N)C MCULE-3910421330 [0,1,0,0,0,0|1,0,1]=3 694 B13R1.4012 CCOC1=C(C=CC=C1C(C)N)C MCULE-9915258947 [0,1,0,0,0,0|1,0,1]=3 695 B13R1.4012 CCOC1=C(C=CC=C1C(C)N)Cl MCULE-2262808107 [0,1,0,0,0,0|1,0,1]=3 696 B13R1.4012 CCOC1=C(C=CC=C1C(C)N)Cl MCULE-7970905488 [0,1,0,0,0,0|1,0,1]=3 697 B13R1.4012 CCOC1=C(C=CC=C1C(C)N)F MCULE-1094137310 [0,1,0,0,0,0|1,0,1]=3 698 B13R1.4012 CCOC1=C(C=CC=C1C(C)N)F MCULE-9230212511 [0,1,0,0,0,0|1,0,1]=3 699 B13R1.4012 CCOC1=C(C=CC=C1F)C(=O)O MCULE-4619065805 [0,1,0,0,0,0|1,0,0]=2 700 B13R1.4012 CCOC1=C(C=CC=C1F)N(=O)=O MCULE-7766914940 [0,1,0,0,0,0|2,0,0]=3 701 B13R1.4012 CCOC1=C(C=CC=C1N(=O)=O)C MCULE-5512918579 [0,1,0,0,0,0|2,0,0]=3 702 B13R1.4012 CCOC1=C(C=CC=C1N)N(=O)=O MCULE-2450939531 [0,1,0,0,0,0|2,0,0]=3 703 B13R1.4012 CCOC1=C(C=CC=C1N)N(=O)=O MCULE-4572394511 [0,1,0,0,0,0|2,0,0]=3 704 B13R1.4012 CCSC1=C(C=CC=C1Br)N(=O)=O MCULE-5972812591 [0,1,0,0,0,0|2,1,0]=4 705 B13R2.268 CCOC1=CC=CC=C1C2CC2 MCULE-1072257953 [0,0,0,1,0,0|2,0,1]=4 706 B13R2.328 CC1=CC(=C2C=CC=CC2=N1)N MCULE-6699642491 [0,0,0,1,0,0|2,0,1]=4 707 B13R2.328 CC1=CC(=O)C2=C(S1)C=CC=C2 MCULE-8712710754 [0,0,0,1,0,0|1,1,1]=4 708 B13R2.328 CC1=CC(=O)C2=CC=CC=C2O1 MCULE-4695999179 [0,0,0,1,0,0|1,0,1]=3 709 B13R2.328 CC1=CC2=C(C=CC=C2)C(=C1)N MCULE-3318422308 [0,0,0,1,0,0|2,0,1]=4 710 B13R2.328 CC1=CC2=C(N=CC=C2)C(=O)N1 MCULE-2382206971 [0,0,0,1,0,0|2,0,1]=4 711 B13R2.328 CC1=CC2=CC=CC=C2C(=N1)N MCULE-6719148380 [0,0,0,1,0,0|2,0,1]=4 712 B13R2.328 CC1=CC2=CC=CC=C2C(=O)N1 MCULE-2561349456 [0,0,0,1,0,0|1,0,1]=3 713 B13R2.328 CC1=NC(=C2C=CC=CC2=N1)N MCULE-2736820611 [0,0,0,1,0,0|2,0,1]=4 714 B13R2.328 CC1=NC(CC2=C1C=CC=C2)C MCULE-4951099403 [0,0,0,1,0,0|2,0,1]=4 715 B13R2.328 CC1=NC(CC2=C1C=CC=C2)C MCULE-7956821332 [0,0,0,1,0,0|2,0,1]=4 716 B13R2.328 CC1=NC2=C(C=CC=C2)C(=O)N1 MCULE-3856508092 [0,0,0,1,0,0|1,0,1]=3 717 B13R2.328 CC1=NC2=C(C=CN=C2)C(=O)N1 MCULE-3544248574 [0,0,0,1,0,0|2,0,1]=4 718 B13R2.328 CC1=NC2=C(C=NC=C2)C(=O)N1 MCULE-7759473944 [0,0,0,1,0,0|2,0,1]=4 719 B13R2.328 CC1=NC2=CC=CC=C2C(=O)C1 MCULE-2993908567 [0,0,0,1,0,0|2,0,1]=4 720 B13R2.328 CC1=NC2=CC=CC=C2C(=O)N1 MCULE-7702884689 [0,0,0,1,0,0|1,0,1]=3 721 B13R2.328 CC1=NC2=CC=CC=C2C(=O)O1 MCULE-4681569877 [0,0,0,1,0,0|2,0,1]=4 722 B13R2.328 CC1=NC2=CC=CC=C2C(=S)N1 MCULE-7199057445 [0,0,0,1,0,0|1,1,1]=4 723 B13R2.328 CC1=NC2=CC=CN=C2C(=O)N1 MCULE-7419940045 [0,0,0,1,0,0|2,0,1]=4 724 B13R2.328 CC1=NC2=NC=CC=C2C(=O)N1 MCULE-9213162321 [0,0,0,1,0,0|2,0,1]=4 725 B13R2.328 CC1CC(=O)C2=C(N1)C=CC=C2 MCULE-6378661616 [0,0,0,1,0,0|2,0,0]=3 726 B13R2.328 CC1CC(=O)C2=C(S1)C=CC=C2 MCULE-9509635384 [0,0,0,1,0,0|1,1,0]=3 727 B13R2.328 CC1CC(=O)C2=CC=CC=C2C1 MCULE-4123227699 [0,0,0,1,0,0|2,0,0]=3 728 B13R2.328 CC1CC2=C(C=CC=C2)C(=O)N1 MCULE-4477259052 [0,0,0,1,0,0|1,0,0]=2 729 B13R2.328 CC1CC2=C(C=CC=C2)C(=S)N1 MCULE-7711393840 [0,0,0,1,0,0|1,1,0]=3 730 B13R2.328 CN1CC(=O)C2=C(C1)C=CC=C2 MCULE-4116625996 [0,0,0,1,0,0|3,0,0]=4 731 B13R2.328 C[C@@H]1C[C@H](C2=CC=CC=C2O1)N MCULE-3363961304 [0,0,0,1,0,0|1,0,1]=3 732 B13R2.328 C[C@@H]1C[C@H](C2=CC=CC=C2O1)N MCULE-6910472136 [0,0,0,1,0,0|1,0,1]=3 733 B13R2.328 N=C1NC(=O)C2=C(S1)C=CC=C2 MCULE-1913366902 [0,0,0,1,0,0|1,1,1]=4 734 B13R2.328 NC1=CC(=O)C2=C(O1)C=CC=C2 MCULE-5335883101 [0,0,0,1,0,0|2,0,1]=4 735 B13R2.328 NC1=CC(=O)OC2=CC=CC=C12 MCULE-3726196442 [0,0,0,1,0,0|2,0,1]=4 736 B13R2.328 NC1=CC2=C(C=CC=C2)C(=O)N1 MCULE-6167282939 [0,0,0,1,0,0|2,0,1]=4 737 B13R2.328 NC1=NC2=C(C=CC=C2)C(=O)N1 MCULE-8431522974 [0,0,0,1,0,0|2,0,1]=4 738 B13R2.328 O=C1CC(=O)C2=CC=CC=C2O1 MCULE-7503708238 [0,0,0,1,0,0|2,0,1]=4 739 B13R2.328 O=C1CC2=CC=CC=C2C(=O)N1 MCULE-1752890442 [0,0,0,1,0,0|2,0,1]=4 740 B13R2.328 O=C1NC(=CC2=C1C=CC=C2)Cl MCULE-1187033218 [0,0,0,1,0,0|2,0,1]=4 741 B13R2.328 O=C1NC(=O)C2=C(N1)C=CC=C2 MCULE-2568324638 [0,0,0,1,0,0|2,0,1]=4 742 B13R2.328 O=C1NC(=O)C2=C(S1)C=CC=C2 MCULE-2844300828 [0,0,0,1,0,0|1,1,1]=4 743 B13R2.328 O=C1NC(=O)C2=CC=CC=C2O1 MCULE-4932826327 [0,0,0,1,0,0|1,0,1]=3 744 B13R2.328 O=C1NC(=S)NC2=C1C=CC=C2 MCULE-8899058869 [0,0,0,1,0,0|2,0,1]=4 745 B13R2.328 O=C1NC(=S)SC2=C1C=CC=C2 MCULE-6662815011 [0,0,0,1,0,0|1,1,1]=4 746 B13R2.328 O=C1OP(OC2=C1C=CC=C2)Cl MCULE-9455191655 [0,0,0,1,0,0|3,0,0]=4 747 B13R2.2931 CC=C1OC(=O)C2=C1C=CC=C2 MCULE-2357843157 [0,0,0,1,0,0|2,0,1]=4 748 B13R2.2931 CCC1OC(=O)C2=CC=CC=C12 MCULE-1312406335 [0,0,0,1,0,0|2,0,0]=3 749 B13R2.2931 CCN1N=C(C2=C1C=CC=C2)Br MCULE-8532914381 [0,0,0,1,0,0|2,0,1]=4 750 B13R2.2931 CCN1N=C(C2=C1C=CC=C2)N MCULE-2580904970 [0,0,0,1,0,0|2,0,0]=3 751 B13R2.2931 CC[N+]1=C2C=CC=CC2=C(O1)C MCULE-8858196930 [0,0,0,1,0,0|2,0,1]=4 752 B13R2.2931 CC[N+]1=C2C=CC=CC2=C(O1)C MCULE-8872399397 [0,0,0,1,0,0|2,0,1]=4 753 B13R2.2931 CNC1NC(=O)C2=C1C=CC=C2 MCULE-3688881108 [0,0,0,1,0,0|2,0,0]=3 754 B13R2.2931 COC1OC(=O)C2=CC=CC=C12 MCULE-9023770050 [0,0,0,1,0,0|3,0,0]=4 755 B13R2.2931 CO[IH2]1OC(=O)C2=CC=CC=C12 MCULE-2735362379 [0,0,0,1,0,0|3,0,0]=4 756 B13R2.2931 N/N=C/1\NC(=O)C2=CC=CC=C12 MCULE-4821687308 [0,0,0,1,0,0|3,0,0]=4 757 B13R2.2931 NCC1CC(=O)C2=CC=CC=C12 MCULE-3122546782 [0,0,0,1,0,0|3,0,0]=4 758 B13R2.2931 NCC1CC(=O)C2=CC=CC=C12 MCULE-7273907382 [0,0,0,1,0,0|3,0,0]=4 759 B13R2.2931 NCC1OC(=O)C2=CC=CC=C12 MCULE-2945986135 [0,0,0,1,0,0|3,0,0]=4 760 B13R2.2931 NCC1OC(=O)C2=CC=CC=C12 MCULE-5686972056 [0,0,0,1,0,0|3,0,0]=4 761 B13R2.2931 O=C1NN(C2=CC=CC=C12)CCl MCULE-9426908881 [0,0,0,1,0,0|2,0,0]=3 762 B13R2.3122 CC1(CCCC2=C1C=CC=C2)N MCULE-4473106572 [0,0,0,1,0,0|2,0,1]=4 763 B13R2.3122 CC1(CCOC2=C1C=CC=C2)N MCULE-1463032896 [0,0,0,1,0,0|1,0,1]=3 764 B13R2.3122 CC1(CCOC2=C1C=CC=C2)N MCULE-4515734009 [0,0,0,1,0,0|1,0,1]=3 765 B13R2.3122 N=S1(=O)CCNC2=C1C=CC=C2 MCULE-4254116571 [0,0,0,1,0,0|2,0,1]=4 766 B13R2.3122 O=S1(=O)CCNC2=C1C=CC=C2 MCULE-7714481852 [0,0,0,1,0,0|3,0,0]=4 767 B13R2.5252 C=C1CCCOC2=C1C=CC=C2 MCULE-5342369882 [0,0,0,1,0,0|2,0,0]=3 768 B13R2.5252 CC1NCCOC2=C1C=CC=C2 MCULE-8454513550 [0,0,0,1,0,0|1,0,1]=3 769 B13R2.5252 NC1CCCCC2=C1C=CC=C2 MCULE-7500645224 [0,0,0,1,0,0|2,0,1]=4 770 B13R2.5252 NC1CCCCC2=CC=CC=C12 MCULE-9222918091 [0,0,0,1,0,0|2,0,1]=4 771 B13R2.5252 NC1CCCNC2=CC=CC=C12 MCULE-6456851945 [0,0,0,1,0,0|2,0,1]=4 772 B13R2.5252 NC1CCCNC2=CC=CC=C12 MCULE-7437214728 [0,0,0,1,0,0|2,0,1]=4 773 B13R2.5252 NC1CCCOC2=CC=CC=C12 MCULE-6613575572 [0,0,0,1,0,0|1,0,1]=3 774 B13R2.5252 NC1CCCOC2=CC=CC=C12 MCULE-8251470110 [0,0,0,1,0,0|1,0,1]=3 775 B13R2.5252 N[C@@H]1CCCCC2=CC=CC=C12 MCULE-6958853663 [0,0,0,1,0,0|2,0,1]=4 776 B13R2.5252 N[C@@H]1CCCNC2=C1C=CC=C2 MCULE-8391323934 [0,0,0,1,0,0|2,0,1]=4 777 B13R2.5252 N[C@@H]1CCCOC2=CC=CC=C12 MCULE-1878943167 [0,0,0,1,0,0|1,0,1]=3 778 B13R2.5252 N[C@@H]1CCCOC2=CC=CC=C12 MCULE-4346963897 [0,0,0,1,0,0|1,0,1]=3 779 B13R2.5252 N[C@H]1CCCCC2=CC=CC=C12 MCULE-9049634341 [0,0,0,1,0,0|2,0,1]=4 780 B13R2.5252 N[C@H]1CCCNC2=CC=CC=C12 MCULE-9056716728 [0,0,0,1,0,0|2,0,1]=4 781 B13R2.5252 N[C@H]1CCCOC2=CC=CC=C12 MCULE-3632414327 [0,0,0,1,0,0|1,0,1]=3 782 B13R2.5252 N[C@H]1CCCOC2=CC=CC=C12 MCULE-6858629356 [0,0,0,1,0,0|1,0,1]=3 783 B13R2.5252 O=C1CCCCC2=C1C=CC=C2 MCULE-8354770318 [0,0,0,1,0,0|2,0,0]=3 784 B13R2.5252 O=C1CCCNC2=C1C=CC=C2 MCULE-3995060336 [0,0,0,1,0,0|2,0,0]=3 785 B13R2.5252 O=C1CCCNC2=CC=CC=C12 MCULE-9607357138 [0,0,0,1,0,0|2,0,0]=3 786 B13R2.5252 O=C1CCCOC2=C1C=CC=C2 MCULE-7113486032 [0,0,0,1,0,0|1,0,0]=2 787 B13R2.5252 O=C1CCCSC2=C1C=CC=C2 MCULE-7559368965 [0,0,0,1,0,0|1,1,0]=3 788 B13R2.5252 O=C1CCNCC2=CC=CC=C12 MCULE-6972709177 [0,0,0,1,0,0|3,0,0]=4 789 B13R2.5252 O=C1CCNCC2=CC=CC=C12 MCULE-7759702701 [0,0,0,1,0,0|3,0,0]=4 790 B13R2.5252 O=C1CSCCC2=C1C=CC=C2 MCULE-9936382399 [0,0,0,1,0,0|3,0,0]=4 791 B13R2.5252 O=C1NCCCC2=CC=CC=C12 MCULE-1287190699 [0,0,0,1,0,0|1,0,0]=2 792 B13R2.5252 O=C1NCCNC2=C1C=CC=C2 MCULE-4259604660 [0,0,0,1,0,0|1,0,0]=2 793 B13R2.5252 O=C1NCCOC2=C1C=CC=C2 MCULE-4817311393 [0,0,0,1,0,0|0,0,0]=1 794 B13R2.5252 O=C1NCCSC2=C1C=CC=C2 MCULE-5378037418 [0,0,0,1,0,0|0,1,0]=2 795 B13R2.5252 O=C1NN=COC2=CC=CC=C12 MCULE-2924633484 [0,0,0,1,0,0|1,0,1]=3 796 B13R2.5252 O=C1OCCOC2=C1C=CC=C2 MCULE-3805503086 [0,0,0,1,0,0|1,0,0]=2 797 B13R2.5252 O=S1CCCNC2=C1C=CC=C2 MCULE-6224334665 [0,0,0,1,0,0|3,0,0]=4 798 B13R2.5252 OB1OCCOC2=CC=CC=C12 MCULE-9182840840 [0,0,0,1,0,0|2,0,1]=4 799 B13R2.5252 OC1CCCOC2=CC=CC=C12 MCULE-3377050282 [0,0,0,1,0,0|1,0,2]=4 800 B13R2.5514 CC(=O)C1=C(C=CC=C1)C2CC2 MCULE-4665553948 [0,0,0,1,0,0|2,0,0]=3 801 B13R2.5514 CC(=O)C1=NC=CC=C1C2CC2 MCULE-3728829824 [0,0,0,1,0,0|3,0,0]=4 802 B13R2.5514 NC(=O)C1=C(C=CC=C1)C2CC2 MCULE-3706183757 [0,0,0,1,0,0|1,0,0]=2 803 B13R2.5514 O=C(O)C1=C(C=CC=C1)C2CC2 MCULE-9832471398 [0,0,0,1,0,0|2,0,0]=3 804 B13R2.5514 O=C(O)C1=C(C=CN=C1)C2CC2 MCULE-6058613179 [0,0,0,1,0,0|3,0,0]=4 805 B13R2.5514 O=C(O)C1=C(N=CC=C1)C2CC2 MCULE-9693069433 [0,0,0,1,0,0|3,0,0]=4 806 B13R2.5514 O=C(O)C1=CC=NC=C1C2CC2 MCULE-8604492411 [0,0,0,1,0,0|3,0,0]=4 807 B13R2.5514 O=C(O)C1=NC=CC=C1C2CC2 MCULE-6914517117 [0,0,0,1,0,0|3,0,0]=4 808 B13R2.5514 O=N(=O)C1=C(C=CC=C1)C2CC2 MCULE-4543696063 [0,0,0,1,0,0|3,0,0]=4 809 B13R2.5569 CC(=O)C1=C2OC=NC2=CC=C1 MCULE-4601594885 [0,0,0,1,0,0|2,0,1]=4 810 B13R2.5569 CC(=O)C1=C2OCCC2=CC=C1 MCULE-2462770649 [0,0,0,1,0,0|1,0,0]=2 811 B13R2.5569 CC(=O)C1=C2OCOC2=CC=C1 MCULE-5620362120 [0,0,0,1,0,0|2,0,0]=3 812 B13R2.5569 CC(=O)C1=CC=CC2=C1C=CC2 MCULE-6705680188 [0,0,0,1,0,0|2,0,1]=4 813 B13R2.5569 CC(=O)C1=CC=CC2=C1CCC2 MCULE-1634437857 [0,0,0,1,0,0|2,0,0]=3 814 B13R2.5569 CC(=O)C1=CC=CC2=C1NCC2 MCULE-7948902171 [0,0,0,1,0,0|2,0,0]=3 815 B13R2.5569 CC(=O)C1=CC=CC2=C1NCC2 MCULE-9149488481 [0,0,0,1,0,0|2,0,0]=3 816 B13R2.5569 CC(N)C1=CC=CC2=C1CCC2 MCULE-9158713281 [0,0,0,1,0,0|2,0,1]=4 817 B13R2.5569 CC(N)C1=CC=CC2=C1CCC2 MCULE-9888732450 [0,0,0,1,0,0|2,0,1]=4 818 B13R2.5569 C[C@@H](N)C1=CC=CC2=C1CCC2 MCULE-9173702383 [0,0,0,1,0,0|2,0,1]=4 819 B13R2.5569 C[C@@H](N)C1=CC=CC2=C1OCO2 MCULE-1333169047 [0,0,0,1,0,0|2,0,1]=4 820 B13R2.5569 C[C@@H](N)C1=CC=CC2=C1OCO2 MCULE-3550520359 [0,0,0,1,0,0|2,0,1]=4 821 B13R2.5569 C[C@H](N)C1=CC=CC2=C1CCC2 MCULE-5289013100 [0,0,0,1,0,0|2,0,1]=4 822 B13R2.5569 C[C@H](N)C1=CC=CC2=C1CCC2 MCULE-6018366047 [0,0,0,1,0,0|2,0,1]=4 823 B13R2.5569 C[C@H](N)C1=CC=CC2=C1OCO2 MCULE-2454306673 [0,0,0,1,0,0|2,0,1]=4 824 B13R2.5569 C[C@H](N)C1=CC=CC2=C1OCO2 MCULE-4419770993 [0,0,0,1,0,0|2,0,1]=4 825 B13R2.5569 NC(=O)C1=C2C=CNC2=CC=C1 MCULE-2008287966 [0,0,0,1,0,0|2,0,1]=4 826 B13R2.5569 NC(=O)C1=C2C=NNC2=CC=C1 MCULE-3726432553 [0,0,0,1,0,0|3,0,0]=4 827 B13R2.5569 NC(=O)C1=C2N=CNC2=CC=C1 MCULE-5561690012 [0,0,0,1,0,0|2,0,1]=4 828 B13R2.5569 NC(=O)C1=C2NC=CC2=CC=C1 MCULE-2844305882 [0,0,0,1,0,0|1,0,2]=4 829 B13R2.5569 NC(=O)C1=C2NN=CC2=CC=C1 MCULE-3193820815 [0,0,0,1,0,0|2,0,1]=4 830 B13R2.5569 NC(=O)C1=C2OCOC2=CC=C1 MCULE-1443461629 [0,0,0,1,0,0|1,0,0]=2 831 B13R2.5569 NC(=O)C1=CC=CC2=C1C=CS2 MCULE-1746448708 [0,0,0,1,0,0|2,0,1]=4 832 B13R2.5569 NC(=O)C1=CC=CC2=C1N=CO2 MCULE-6227707472 [0,0,0,1,0,0|2,0,1]=4 833 B13R2.5569 O=C(Cl)C1=C2OCOC2=CC=C1 MCULE-9601907665 [0,0,0,1,0,0|2,0,0]=3 834 B13R2.5569 O=C(Cl)C1=CC=CC2=C1OCC2 MCULE-9989864098 [0,0,0,1,0,0|1,0,0]=2 835 B13R2.5569 O=C(O)C1=C2CCCC2=CC=C1 MCULE-3087339991 [0,0,0,1,0,0|2,0,0]=3 836 B13R2.5569 O=C(O)C1=C2CCCC2=NC=C1 MCULE-8480725375 [0,0,0,1,0,0|3,0,0]=4 837 B13R2.5569 O=C(O)C1=C2CCNC2=CC=C1 MCULE-4698173821 [0,0,0,1,0,0|3,0,0]=4 838 B13R2.5569 O=C(O)C1=C2CCNC2=CC=C1 MCULE-7392078101 [0,0,0,1,0,0|3,0,0]=4 839 B13R2.5569 O=C(O)C1=C2CCOC2=CC=C1 MCULE-6654146115 [0,0,0,1,0,0|3,0,0]=4 840 B13R2.5569 O=C(O)C1=C2NCCC2=CC=C1 MCULE-7860180700 [0,0,0,1,0,0|2,0,0]=3 841 B13R2.5569 O=C(O)C1=C2OC=NC2=CC=C1 MCULE-9628845161 [0,0,0,1,0,0|2,0,1]=4 842 B13R2.5569 O=C(O)C1=C2OCCC2=CC=C1 MCULE-7757472811 [0,0,0,1,0,0|1,0,0]=2 843 B13R2.5569 O=C(O)C1=C2OCOC2=CC=N1 MCULE-9127668724 [0,0,0,1,0,0|3,0,0]=4 844 B13R2.5569 O=C(O)C1=C2OCOC2=NC=C1 MCULE-7949951528 [0,0,0,1,0,0|3,0,0]=4 845 B13R2.5569 O=C(O)C1=C2ON=NC2=CC=C1 MCULE-4468439393 [0,0,0,1,0,0|3,0,0]=4 846 B13R2.5569 O=C(O)C1=CC=CC2=C1CNC2 MCULE-4644102100 [0,0,0,1,0,0|3,0,0]=4 847 B13R2.5569 O=C(O)C1=CC=CC2=C1CNC2 MCULE-7594340338 [0,0,0,1,0,0|3,0,0]=4 848 B13R2.5569 O=C(O)C1=CC=CC2=C1COC2 MCULE-3573850565 [0,0,0,1,0,0|3,0,0]=4 849 B13R2.5569 O=C(O)C1=CC=CC2=C1OC=C2 MCULE-7589586719 [0,0,0,1,0,0|1,0,2]=4 850 B13R2.5569 O=C(O)C1=CC=CC2=C1OCO2 MCULE-3744823889 [0,0,0,1,0,0|2,0,0]=3 851 B13R2.5569 O=C(O)C1=CN=CC2=C1CCC2 MCULE-2490189795 [0,0,0,1,0,0|3,0,0]=4 852 B13R2.5569 O=N(=O)C1=C2CCCC2=CC=C1 MCULE-1698663945 [0,0,0,1,0,0|3,0,0]=4 853 B13R2.5569 O=N(=O)C1=C2NCCC2=CC=C1 MCULE-2673241919 [0,0,0,1,0,0|3,0,0]=4 854 B13R2.5569 O=N(=O)C1=C2OCOC2=CC=C1 MCULE-3992984082 [0,0,0,1,0,0|3,0,0]=4 855 B13R2.5569 O=N(=O)C1=CC=CC2=C1NCC2 MCULE-7527238391 [0,0,0,1,0,0|3,0,0]=4 856 B13R2.5569 OB(O)C1=C2OCCC2=CC=C1 MCULE-6172389129 [0,0,0,1,0,0|2,0,1]=4 857 B11R1.193 CCCC1=C(C=CN1)C(=O)O MCULE-9782763884 [0,0,0,0,1,0|3,0,0]=4 858 B11R1.193 CCCC1=C(C=CO1)C(=O)O MCULE-2361345479 [0,0,0,0,1,0|3,0,0]=4 859 B11R1.193 CCCN1C=CC=C1C(=O)O MCULE-6023275179 [0,0,0,0,1,0|3,0,0]=4 860 B11R1.193 CCCN1N=CC=C1C(=O)N MCULE-2348288434 [0,0,0,0,1,0|3,0,0]=4 861 B11R1.193 CCOC1=C(C=CS1)N(=O)=O MCULE-9253472292 [0,0,0,0,1,0|3,0,0]=4 862 B11R1.193 CCOC1=C(SC=C1)C(=O)Cl MCULE-5577833864 [0,0,0,0,1,0|2,0,0]=3 863 B11R1.193 CCOC1=C(SC=C1)C(=O)O MCULE-7138231478 [0,0,0,0,1,0|2,0,0]=3 864 B11R1.193 CCOC1=NNC=C1C(=O)O MCULE-7835659357 [0,0,0,0,1,0|3,0,0]=4 865 B13R1.380 C=C(Br)CC1=C(C=CC=C1)OCC MCULE-4033091279 [0,0,0,0,0,1|2,0,0]=3 866 B13R1.380 C=C(C)CC1=C(C=CC=C1)OCC MCULE-2791622541 [0,0,0,0,0,1|2,0,0]=3 867 B13R1.380 C=C(Cl)CC1=C(C=CC=C1)OCC MCULE-5252337899 [0,0,0,0,0,1|2,0,0]=3 868 B13R1.380 CC(=O)NC1=CC=CC=C1CCO MCULE-6897739309 [0,0,0,0,0,1|3,0,0]=4 869 B13R1.380 CCCC1=C(C=CC=C1)NC(=S)N MCULE-6630670382 [0,0,0,0,0,1|1,1,0]=3 870 B13R1.380 CCOC1=C(C=CC=C1)CC(=O)Cl MCULE-3496836574 [0,0,0,0,0,1|1,0,0]=2 871 B13R1.380 CCOC1=C(C=CC=C1)CC(=O)O MCULE-1566906016 [0,0,0,0,0,1|1,0,0]=2 872 B13R1.380 CCOC1=C(C=CC=C1)CC(C)N MCULE-6961230743 [0,0,0,0,0,1|1,0,1]=3 873 B13R1.380 CCOC1=C(C=CC=C1)CC(C)N MCULE-9889598789 [0,0,0,0,0,1|1,0,1]=3 874 B13R1.380 CCOC1=C(C=CC=N1)NC(=O)C MCULE-1737921576 [0,0,0,0,0,1|2,0,0]=3 875 B13R1.380 CCOC1=CC=CC=C1CC(=O)C MCULE-6749832954 [0,0,0,0,0,1|1,0,0]=2 876 B13R1.380 CCOC1=CC=CC=C1NC(=O)C MCULE-2836344592 [0,0,0,0,0,1|1,0,0]=2 877 B13R1.380 CCOC1=CC=CC=C1NC(=O)N MCULE-5113276121 [0,0,0,0,0,1|0,0,0]=1 878 B13R1.380 CCOC1=CC=CC=C1NC(=S)N MCULE-7752769935 [0,0,0,0,0,1|0,1,0]=2 879 B13R1.380 CCOC1=CC=CC=C1SC(C)C MCULE-3780153820 [0,0,0,0,0,1|2,0,1]=4 880 B13R1.380 CCSC1=C(C=CC=C1)CC(=O)C MCULE-7296465057 [0,0,0,0,0,1|1,1,0]=3 881 B13R1.380 CCSC1=C(C=CC=C1)CC(=O)O MCULE-8205024057 [0,0,0,0,0,1|1,1,0]=3 882 B13R1.380 CCSC1=C(C=CC=C1)NC(=O)C MCULE-6250743681 [0,0,0,0,0,1|1,1,0]=3 883 B13R1.380 COCC1=C(C=CC=C1)CC(=O)O MCULE-9935672081 [0,0,0,0,0,1|3,0,0]=4 884 B13R1.380 COCC1=C(C=CC=C1)NC(=S)N MCULE-6013810340 [0,0,0,0,0,1|2,1,0]=4 885 B10R1.4 C=COC1=C(C=CC=C1)N MCULE-7326630727 [2,0,0,0,0,0|0,0,2]=4 886 B10R1.4 CCCC1=C(C=CC=C1)Br MCULE-7843945639 [2,0,0,0,0,0|2,0,0]=4 887 B10R1.4 CCCC1=C(C=CC=C1)I MCULE-1601139165 [2,0,0,0,0,0|2,0,0]=4 888 B10R1.4 CCCC1=C(C=CC=C1)N MCULE-7027317337 [2,0,0,0,0,0|1,0,0]=3 889 B10R1.4 CCCC1=C(C=CC=N1)N MCULE-8034740206 [2,0,0,0,0,0|2,0,0]=4 890 B10R1.4 CCCC1=CC=CC=C1C MCULE-4184463329 [2,0,0,0,0,0|1,0,1]=4 891 B10R1.4 CCCC1=CC=CC=C1O MCULE-6123909187 [2,0,0,0,0,0|1,0,1]=4 892 B10R1.4 CCCN1C=CC=CC1=O MCULE-7434351862 [2,0,0,0,0,0|2,0,0]=4 893 B10R1.4 CCNC1=C(C=CC=C1)Br MCULE-8065606861 [2,0,0,0,0,0|2,0,0]=4 894 B10R1.4 CCNC1=C(C=CC=C1)C MCULE-7803036964 [2,0,0,0,0,0|1,0,1]=4 895 B10R1.4 CCNC1=C(C=CC=C1)Cl MCULE-4087906555 [2,0,0,0,0,0|2,0,0]=4 896 B10R1.4 CCNC1=C(C=CC=C1)Cl MCULE-5255575483 [2,0,0,0,0,0|2,0,0]=4 897 B10R1.4 CCNC1=C(C=CC=C1)F MCULE-8024622894 [2,0,0,0,0,0|2,0,0]=4 898 B10R1.4 CCNC1=C(C=CC=C1)N MCULE-3587999268 [2,0,0,0,0,0|1,0,0]=3 899 B10R1.4 CCNC1=C(C=CC=C1)O MCULE-2607215761 [2,0,0,0,0,0|1,0,1]=4 900 B10R1.4 CCNC1=C(C=CC=N1)N MCULE-6504026537 [2,0,0,0,0,0|2,0,0]=4 901 B10R1.4 CCNC1=C(C=CN=C1)N MCULE-1732977196 [2,0,0,0,0,0|2,0,0]=4 902 B10R1.4 CCNC1=C(C=NC=C1)N MCULE-4687661779 [2,0,0,0,0,0|2,0,0]=4 903 B10R1.4 CCNC1=CC=CC=C1C MCULE-7620873736 [2,0,0,0,0,0|1,0,1]=4 904 B10R1.4 CCNC1=CC=CC=C1N MCULE-6264279827 [2,0,0,0,0,0|1,0,0]=3 905 B10R1.4 CCNC1=CC=CN=C1N MCULE-6453574372 [2,0,0,0,0,0|2,0,0]=4 906 B10R1.4 CCOC1=C(C=CC=C1)Br MCULE-3749257539 [2,0,0,0,0,0|1,0,0]=3 907 B10R1.4 CCOC1=C(C=CC=C1)N MCULE-9926424428 [2,0,0,0,0,0|0,0,0]=2 908 B10R1.4 CCOC1=C(C=CC=C1)O MCULE-9477700265 [2,0,0,0,0,0|0,0,1]=3 909 B10R1.4 CCOC1=C(C=CC=C1)S MCULE-8260175542 [2,0,0,0,0,0|0,1,0]=3 910 B10R1.4 CCOC1=C(C=CC=N1)Br MCULE-2277292415 [2,0,0,0,0,0|2,0,0]=4 911 B10R1.4 CCOC1=C(C=CC=N1)N MCULE-1259942697 [2,0,0,0,0,0|1,0,0]=3 912 B10R1.4 CCOC1=C(C=CN=C1)Br MCULE-1175110008 [2,0,0,0,0,0|2,0,0]=4 913 B10R1.4 CCOC1=C(C=CN=C1)Br MCULE-6569043234 [2,0,0,0,0,0|2,0,0]=4 914 B10R1.4 CCOC1=C(C=CN=C1)C MCULE-4638413041 [2,0,0,0,0,0|1,0,1]=4 915 B10R1.4 CCOC1=C(C=CN=C1)Cl MCULE-8933613105 [2,0,0,0,0,0|2,0,0]=4 916 B10R1.4 CCOC1=C(C=CN=C1)N MCULE-5966369043 [2,0,0,0,0,0|1,0,0]=3 917 B10R1.4 CCOC1=C(C=NC=C1)Br MCULE-1088647537 [2,0,0,0,0,0|2,0,0]=4 918 B10R1.4 CCOC1=C(C=NC=C1)N MCULE-3013722525 [2,0,0,0,0,0|1,0,0]=3 919 B10R1.4 CCOC1=C(C=NC=N1)N MCULE-3032335382 [2,0,0,0,0,0|2,0,0]=4 920 B10R1.4 CCOC1=C(N=CC=C1)N MCULE-6351714097 [2,0,0,0,0,0|1,0,0]=3 921 B10R1.4 CCOC1=CC=CC=C1C MCULE-3486669158 [2,0,0,0,0,0|0,0,1]=3 922 B10R1.4 CCOC1=CC=CC=C1Cl MCULE-4295766230 [2,0,0,0,0,0|1,0,0]=3 923 B10R1.4 CCOC1=CC=CC=C1F MCULE-3319128136 [2,0,0,0,0,0|1,0,0]=3 924 B10R1.4 CCOC1=CC=CC=C1N MCULE-8838234708 [2,0,0,0,0,0|0,0,0]=2 925 B10R1.4 CCOC1=CC=CN=C1Br MCULE-7155185967 [2,0,0,0,0,0|2,0,0]=4 926 B10R1.4 CCOC1=CC=CN=C1Cl MCULE-9242996968 [2,0,0,0,0,0|2,0,0]=4 927 B10R1.4 CCOC1=CC=CN=C1F MCULE-4401500184 [2,0,0,0,0,0|2,0,0]=4 928 B10R1.4 CCOC1=CC=CN=C1I MCULE-2066849210 [2,0,0,0,0,0|2,0,0]=4 929 B10R1.4 CCOC1=CC=CNC1=O MCULE-4739916316 [2,0,0,0,0,0|1,0,0]=3 930 B10R1.4 CCOC1=CN=CN=C1N MCULE-1838576289 [2,0,0,0,0,0|2,0,0]=4 931 B10R1.4 CCOC1=NC=CC=C1Cl MCULE-8553642014 [2,0,0,0,0,0|2,0,0]=4 932 B10R1.4 CCOC1=NC=CC=C1F MCULE-7320195601 [2,0,0,0,0,0|2,0,0]=4 933 B10R1.4 CCOC1=NC=CC=C1I MCULE-7764824020 [2,0,0,0,0,0|2,0,0]=4 934 B10R1.4 CCOC1=NC=CC=C1O MCULE-6780795407 [2,0,0,0,0,0|1,0,1]=4 935 B10R1.4 CCOC1=NC=CN=C1N MCULE-1624682776 [2,0,0,0,0,0|2,0,0]=4 936 B10R1.4 CCSC1=C(C=CC=C1)Br MCULE-1873596777 [2,0,0,0,0,0|1,1,0]=4 937 B10R1.4 CCSC1=C(C=CC=C1)N MCULE-4592380538 [2,0,0,0,0,0|0,1,0]=3 938 B10R1.4 CCSC1=C(C=CC=C1)O MCULE-4909974062 [2,0,0,0,0,0|0,1,1]=4 939 B10R1.4 CCSC1=CC=CC=C1C MCULE-6736673919 [2,0,0,0,0,0|0,1,1]=4 940 B10R1.4 CCSC1=CC=CC=C1Cl MCULE-6190232622 [2,0,0,0,0,0|1,1,0]=4 941 B10R1.4 CCSC1=CC=CC=C1N MCULE-1907352780 [2,0,0,0,0,0|0,1,0]=3 942 B10R1.4 CNCC1=C(C=CC=C1)N MCULE-3136227501 [2,0,0,0,0,0|2,0,0]=4 943 B10R1.4 CNCC1=CC=CC=C1N MCULE-6452459238 [2,0,0,0,0,0|2,0,0]=4 944 B10R1.4 COCC1=C(C=CC=C1)N MCULE-3182957105 [2,0,0,0,0,0|2,0,0]=4 945 B10R1.4 CSCC1=C(C=CC=C1)N MCULE-4570762150 [2,0,0,0,0,0|2,0,0]=4 946 B10R1.4 ClCOC1=CC=CC=C1Cl MCULE-4856680587 [2,0,0,0,0,0|2,0,0]=4 947 B10R1.4 FC1=C(C=CC=C1)OCCl MCULE-6819173987 [2,0,0,0,0,0|2,0,0]=4 948 B10R1.4 NC1=CC=CC=C1CCO MCULE-9703375050 [2,0,0,0,0,0|2,0,0]=4 949 B10R1.4 NCCC1=C(C=CC=C1)N MCULE-1486503677 [2,0,0,0,0,0|2,0,0]=4 950 B10R1.4 NCCC1=C(C=CC=C1)N MCULE-3828455582 [2,0,0,0,0,0|2,0,0]=4 951 B10R1.4 NCCC1=CC=CC=C1N MCULE-9736716006 [2,0,0,0,0,0|2,0,0]=4 952 B10R1.20 C#CC1=C(C=CC=C1)CC MCULE-8700433005 [2,0,0,0,0,0|1,0,1]=4 953 B10R1.20 C#CC1=CC=CC=C1C=O MCULE-9697350873 [2,0,0,0,0,0|0,0,2]=4 954 B10R1.20 C#CC1=CC=CC=C1OC MCULE-4959064922 [2,0,0,0,0,0|1,0,1]=4 955 B10R1.20 C=CC1=C(C=CC=C1)CO MCULE-8762356225 [2,0,0,0,0,0|2,0,0]=4 956 B10R1.20 C=CC1=CC=CC=C1C=O MCULE-7860754839 [2,0,0,0,0,0|0,0,2]=4 957 B10R1.20 C=CC1=CC=CC=C1CBr MCULE-6266022953 [2,0,0,0,0,0|2,0,0]=4 958 B10R1.20 C=CC1=CC=CC=C1CC MCULE-4000794534 [2,0,0,0,0,0|1,0,0]=3 959 B10R1.20 C=CC1=CC=CC=C1CCl MCULE-2655719045 [2,0,0,0,0,0|2,0,0]=4 960 B10R1.20 C=CC1=CC=CC=C1OC MCULE-9854409679 [2,0,0,0,0,0|1,0,0]=3 961 B10R1.20 CCC1=C(C=CC=C1)C#N MCULE-2578364558 [2,0,0,0,0,0|0,0,2]=4 962 B10R1.20 CCC1=C(C=CC=C1)CBr MCULE-9651387646 [2,0,0,0,0,0|1,0,1]=4 963 B10R1.20 CCC1=C(C=CC=C1)CN MCULE-8095415047 [2,0,0,0,0,0|0,0,1]=3 964 B10R1.20 CCC1=C(C=CC=C1)CO MCULE-4692084468 [2,0,0,0,0,0|0,0,2]=4 965 B10R1.20 CCC1=C(C=CC=C1)NC MCULE-1837908436 [2,0,0,0,0,0|2,0,0]=4 966 B10R1.20 CCC1=C(C=CC=C1)NN MCULE-4016469116 [2,0,0,0,0,0|1,0,0]=3 967 B10R1.20 CCC1=C(C=CC=C1)NN MCULE-8432833891 [2,0,0,0,0,0|1,0,0]=3 968 B10R1.20 CCC1=C(C=CC=C1)ON MCULE-5884209817 [2,0,0,0,0,0|1,0,0]=3 969 B10R1.20 CCC1=C(N=CC=C1)CN MCULE-7804223309 [2,0,0,0,0,0|1,0,1]=4 970 B10R1.20 CCC1=CC=CC=C1C=O MCULE-7976846390 [2,0,0,0,0,0|0,0,0]=2 971 B10R1.20 CCC1=CC=CC=C1CC MCULE-2736970809 [2,0,0,0,0,0|1,0,1]=4 972 B10R1.20 CCC1=CC=CC=C1OC MCULE-6300488103 [2,0,0,0,0,0|1,0,1]=4 973 B10R1.20 CCC1=CC=CC=C1ON MCULE-8294095530 [2,0,0,0,0,0|1,0,0]=3 974 B10R1.20 CCC1=CC=CC=C1SC MCULE-5773118982 [2,0,0,0,0,0|2,0,0]=4 975 B10R1.20 CNC1=C(C=CC=C1)OC MCULE-2529825726 [2,0,0,0,0,0|2,0,0]=4 976 B10R1.20 CNC1=C(C=CC=C1)OC MCULE-8468811834 [2,0,0,0,0,0|2,0,0]=4 977 B10R1.20 CNC1=C(C=CC=N1)C=O MCULE-5474788764 [2,0,0,0,0,0|2,0,0]=4 978 B10R1.20 CNC1=CC=CC=C1C=O MCULE-5184269116 [2,0,0,0,0,0|1,0,0]=3 979 B10R1.20 CNC1=NC=CC=C1C=O MCULE-6728805541 [2,0,0,0,0,0|2,0,0]=4 980 B10R1.20 COC1=C(C=CC=C1)C#N MCULE-1288292650 [2,0,0,0,0,0|0,0,2]=4 981 B10R1.20 COC1=C(C=CC=C1)CBr MCULE-3787181025 [2,0,0,0,0,0|1,0,1]=4 982 B10R1.20 COC1=C(C=CC=C1)CN MCULE-1012242765 [2,0,0,0,0,0|0,0,1]=3 983 B10R1.20 COC1=C(C=CC=C1)CO MCULE-7754935670 [2,0,0,0,0,0|0,0,2]=4 984 B10R1.20 COC1=C(C=CC=C1)CS MCULE-2304465302 [2,0,0,0,0,0|0,1,1]=4 985 B10R1.20 COC1=C(C=CC=C1)NN MCULE-5801933106 [2,0,0,0,0,0|1,0,0]=3 986 B10R1.20 COC1=C(C=CC=C1)OC MCULE-8606899989 [2,0,0,0,0,0|2,0,0]=4 987 B10R1.20 COC1=C(C=CC=C1)ON MCULE-4530312629 [2,0,0,0,0,0|1,0,0]=3 988 B10R1.20 COC1=C(C=CC=C1)SC MCULE-3105191372 [2,0,0,0,0,0|2,0,0]=4 989 B10R1.20 COC1=C(C=CC=N1)CN MCULE-6222919779 [2,0,0,0,0,0|1,0,1]=4 990 B10R1.20 COC1=C(C=CN=C1)C=O MCULE-3201655309 [2,0,0,0,0,0|1,0,0]=3 991 B10R1.20 COC1=C(C=CN=C1)CN MCULE-2843968285 [2,0,0,0,0,0|1,0,1]=4 992 B10R1.20 COC1=C(C=CN=C1)CN MCULE-6239188727 [2,0,0,0,0,0|1,0,1]=4 993 B10R1.20 COC1=C(C=CN=C1)CN MCULE-9295609584 [2,0,0,0,0,0|1,0,1]=4 994 B10R1.20 COC1=C(C=NC=C1)C=O MCULE-3028002267 [2,0,0,0,0,0|1,0,0]=3 995 B10R1.20 COC1=C(C=NC=C1)CN MCULE-6363463840 [2,0,0,0,0,0|1,0,1]=4 996 B10R1.20 COC1=C(C=NC=C1)NN MCULE-2559623957 [2,0,0,0,0,0|2,0,0]=4 997 B10R1.20 COC1=C(C=NC=C1)NN MCULE-8364039502 [2,0,0,0,0,0|2,0,0]=4 998 B10R1.20 COC1=C(C=NC=N1)C=O MCULE-6718121313 [2,0,0,0,0,0|2,0,0]=4 999 B10R1.20 COC1=C(N=CC=C1)C=O MCULE-1019662262 [2,0,0,0,0,0|1,0,0]=3 1000 B10R1.20 COC1=CC=CC=C1C=O MCULE-4690415185 [2,0,0,0,0,0|0,0,0]=2 1001 B10R1.20 COC1=CC=CC=C1CCl MCULE-4681947078 [2,0,0,0,0,0|1,0,1]=4 1002 B10R1.20 COC1=CC=CC=C1CN MCULE-1266521118 [2,0,0,0,0,0|0,0,1]=3 1003 B10R1.20 COC1=CC=CC=C1NN MCULE-3820975174 [2,0,0,0,0,0|1,0,0]=3 1004 B10R1.20 COC1=CC=CC=C1NN MCULE-6910804133 [2,0,0,0,0,0|1,0,0]=3 1005 B10R1.20 COC1=CC=CC=C1NN MCULE-9414267785 [2,0,0,0,0,0|1,0,0]=3 1006 B10R1.20 COC1=CC=CC=C1ON MCULE-3966135412 [2,0,0,0,0,0|1,0,0]=3 1007 B10R1.20 COC1=CC=CN=C1CN MCULE-5569640363 [2,0,0,0,0,0|1,0,1]=4 1008 B10R1.20 COC1=CC=CN=C1CN MCULE-5688940356 [2,0,0,0,0,0|1,0,1]=4 1009 B10R1.20 COC1=CC=CN=C1CN MCULE-8304642546 [2,0,0,0,0,0|1,0,1]=4 1010 B10R1.20 COC1=CC=NC=C1C=O MCULE-4901826089 [2,0,0,0,0,0|1,0,0]=3 1011 B10R1.20 COC1=NC=CC=C1C=O MCULE-2464593857 [2,0,0,0,0,0|1,0,0]=3 1012 B10R1.20 COC1=NC=CC=C1CN MCULE-4437899645 [2,0,0,0,0,0|1,0,1]=4 1013 B10R1.20 COC1=NC=CC=C1CN MCULE-6023962405 [2,0,0,0,0,0|1,0,1]=4 1014 B10R1.20 COC1=NC=CC=C1CN MCULE-6551091429 [2,0,0,0,0,0|1,0,1]=4 1015 B10R1.20 COC1=NC=CC=C1NN MCULE-5854146370 [2,0,0,0,0,0|2,0,0]=4 1016 B10R1.20 COC1=NC=CC=C1NN MCULE-6821828014 [2,0,0,0,0,0|2,0,0]=4 1017 B10R1.20 COC1=NC=CC=C1ON MCULE-2062034942 [2,0,0,0,0,0|2,0,0]=4 1018 B10R1.20 COC1=NC=CC=C1ON MCULE-8075502512 [2,0,0,0,0,0|2,0,0]=4 1019 B10R1.20 COC1=NC=CN=C1C=O MCULE-6400877795 [2,0,0,0,0,0|2,0,0]=4 1020 B10R1.20 COC\1=CC=CN/C1=N\N MCULE-4762211332 [2,0,0,0,0,0|2,0,0]=4 1021 B10R1.20 CSC1=C(C=CC=C1)CN MCULE-9399394371 [2,0,0,0,0,0|0,1,1]=4 1022 B10R1.20 CSC1=C(C=CC=C1)NN MCULE-7674255723 [2,0,0,0,0,0|1,1,0]=4 1023 B10R1.20 CSC1=CC=CC=C1C=O MCULE-6871098876 [2,0,0,0,0,0|0,1,0]=3 1024 B10R1.20 CSC1=CC=CC=C1NN MCULE-4257794724 [2,0,0,0,0,0|1,1,0]=4 1025 B10R1.20 CSC1=CC=CC=C1NN MCULE-4753386525 [2,0,0,0,0,0|1,1,0]=4 1026 B10R1.20 CSC1=CC=CC=C1ON MCULE-3512889806 [2,0,0,0,0,0|1,1,0]=4 1027 B10R1.20 CSC1=CC=CC=C1ON MCULE-4872800263 [2,0,0,0,0,0|1,1,0]=4 1028 B10R1.20 CSC1=CC=CN=C1C=O MCULE-6878491140 [2,0,0,0,0,0|1,1,0]=4 1029 B10R1.20 CSC1=NC=CC=C1C=O MCULE-5746525561 [2,0,0,0,0,0|1,1,0]=4 1030 B10R1.20 N#CC1=C(C=CC=C1)C=O MCULE-5787370913 [2,0,0,0,0,0|1,0,1]=4 1031 B10R1.20 NCC1=C(C=CC=C1)CO MCULE-7004055753 [2,0,0,0,0,0|1,0,1]=4 1032 B10R1.20 NCC1=CC=CC=C1CN MCULE-3159033426 [2,0,0,0,0,0|1,0,1]=4 1033 B10R1.20 NCC1=CC=CC=C1CN MCULE-8595170157 [2,0,0,0,0,0|1,0,1]=4 1034 B10R1.20 O=CC1=C(C=CC=C1)[Te]Br MCULE-8783419559 [2,0,0,0,0,0|1,1,0]=4 1035 B10R1.20 O=CC1=CC=CC=C1C=O MCULE-5731001647 [2,0,0,0,0,0|1,0,1]=4 1036 B10R1.20 O=CC1=CC=CC=C1CBr MCULE-4655938516 [2,0,0,0,0,0|1,0,0]=3 1037 B10R1.20 O=CC1=CC=CC=C1CCl MCULE-4150580877 [2,0,0,0,0,0|1,0,0]=3 1038 B10R1.20 O=CC1=CC=CC=C1CO MCULE-9613292492 [2,0,0,0,0,0|1,0,0]=3 1039 B10R1.61 C=C(C)C1=CC=CC=C1C MCULE-1262596014 [2,0,0,0,0,0|2,0,0]=4 1040 B10R1.61 CC(=O)C1=C(C=CC=C1)Br MCULE-1424693990 [2,0,0,0,0,0|2,0,0]=4 1041 B10R1.61 CC(=O)C1=C(C=CC=C1)C MCULE-1749200131 [2,0,0,0,0,0|1,0,0]=3 1042 B10R1.61 CC(=O)C1=C(C=CC=C1)Cl MCULE-2144222308 [2,0,0,0,0,0|2,0,0]=4 1043 B10R1.61 CC(=O)C1=C(C=CC=C1)F MCULE-8613480392 [2,0,0,0,0,0|2,0,0]=4 1044 B10R1.61 CC(=O)C1=C(C=CC=C1)I MCULE-3552316800 [2,0,0,0,0,0|2,0,0]=4 1045 B10R1.61 CC(=O)C1=C(C=CC=C1)O MCULE-6901537094 [2,0,0,0,0,0|1,0,0]=3 1046 B10R1.61 CC(=O)C1=C(C=CN=C1)C MCULE-1786007668 [2,0,0,0,0,0|2,0,0]=4 1047 B10R1.61 CC(=O)C1=C(C=CN=C1)C MCULE-1864551259 [2,0,0,0,0,0|2,0,0]=4 1048 B10R1.61 CC(=O)C1=C(C=CN=C1)O MCULE-2666165855 [2,0,0,0,0,0|2,0,0]=4 1049 B10R1.61 CC(=O)C1=C(C=NC=C1)C MCULE-5320077243 [2,0,0,0,0,0|2,0,0]=4 1050 B10R1.61 CC(=O)C1=C(C=NC=C1)O MCULE-9732792007 [2,0,0,0,0,0|2,0,0]=4 1051 B10R1.61 CC(=O)C1=CC=CC=C1N MCULE-2549166565 [2,0,0,0,0,0|2,0,0]=4 1052 B10R1.61 CC(=O)C1=CC=CC=C1N MCULE-8977994715 [2,0,0,0,0,0|2,0,0]=4 1053 B10R1.61 CC(=O)C1=CC=CC=C1S MCULE-3881664738 [2,0,0,0,0,0|1,1,0]=4 1054 B10R1.61 CC(=O)C1=CC=CN=C1C MCULE-6054213950 [2,0,0,0,0,0|2,0,0]=4 1055 B10R1.61 CC(=O)C1=NC=CC=C1C MCULE-7445442229 [2,0,0,0,0,0|2,0,0]=4 1056 B10R1.61 CC(=O)C1=NC=CC=C1O MCULE-2705814075 [2,0,0,0,0,0|2,0,0]=4 1057 B10R1.61 CC(N)C1=C(C=CC=C1)O MCULE-3525777586 [2,0,0,0,0,0|1,0,1]=4 1058 B10R1.61 CC(N)C1=C(C=CC=C1)O MCULE-5813206323 [2,0,0,0,0,0|1,0,1]=4 1059 B10R1.61 CC1=C(C=CC=C1)C(=N)N MCULE-3830416568 [2,0,0,0,0,0|1,0,0]=3 1060 B10R1.61 CC1=C(C=CC=C1)C(=N)N MCULE-6828587821 [2,0,0,0,0,0|1,0,0]=3 1061 B10R1.61 CC1=C(C=CC=C1)C(=O)N MCULE-4275866059 [2,0,0,0,0,0|0,0,0]=2 1062 B10R1.61 CC1=C(C=CC=C1)C(=O)O MCULE-8662697935 [2,0,0,0,0,0|1,0,0]=3 1063 B10R1.61 CC1=C(C=CC=C1)C(C)N MCULE-2361031001 [2,0,0,0,0,0|1,0,1]=4 1064 B10R1.61 CC1=C(C=CC=C1)C(C)N MCULE-7161199484 [2,0,0,0,0,0|1,0,1]=4 1065 B10R1.61 CC1=C(C=CC=C1)C(C)N MCULE-8089376949 [2,0,0,0,0,0|1,0,1]=4 1066 B10R1.61 CC1=C(C=CC=C1)C(C)N MCULE-8574215619 [2,0,0,0,0,0|1,0,1]=4 1067 B10R1.61 CC1=C(C=CC=C1)N(=O)=O MCULE-5319832795 [2,0,0,0,0,0|2,0,0]=4 1068 B10R1.61 CC1=C(C=CC=C1)[C@H](C)N MCULE-5156374686 [2,0,0,0,0,0|1,0,1]=4 1069 B10R1.61 CC1=C(C=CC=C1)[C@H](C)N MCULE-8164751476 [2,0,0,0,0,0|1,0,1]=4 1070 B10R1.61 CC1=C(C=CC=N1)C(=N)N MCULE-1448154396 [2,0,0,0,0,0|2,0,0]=4 1071 B10R1.61 CC1=C(C=CC=N1)C(=N)N MCULE-3389286379 [2,0,0,0,0,0|2,0,0]=4 1072 B10R1.61 CC1=C(C=CC=N1)C(=O)N MCULE-6050643158 [2,0,0,0,0,0|1,0,0]=3 1073 B10R1.61 CC1=C(C=CC=N1)C(=O)O MCULE-1358504120 [2,0,0,0,0,0|2,0,0]=4 1074 B10R1.61 CC1=C(C=CC=N1)C(=O)O MCULE-1760335656 [2,0,0,0,0,0|2,0,0]=4 1075 B10R1.61 CC1=C(C=CN=C1)C(=N)N MCULE-3107304146 [2,0,0,0,0,0|2,0,0]=4 1076 B10R1.61 CC1=C(C=CN=C1)C(=N)N MCULE-3972157058 [2,0,0,0,0,0|2,0,0]=4 1077 B10R1.61 CC1=C(C=CN=C1)C(=O)O MCULE-4068777983 [2,0,0,0,0,0|2,0,0]=4 1078 B10R1.61 CC1=C(C=CN=C1)C(=O)O MCULE-4098532555 [2,0,0,0,0,0|2,0,0]=4 1079 B10R1.61 CC1=C(C=NC=C1)C(=O)Cl MCULE-9862174877 [2,0,0,0,0,0|2,0,0]=4 1080 B10R1.61 CC1=C(C=NC=C1)C(=O)N MCULE-2817608526 [2,0,0,0,0,0|1,0,0]=3 1081 B10R1.61 CC1=C(C=NC=C1)C(=O)O MCULE-3830443009 [2,0,0,0,0,0|2,0,0]=4 1082 B10R1.61 CC1=C(N=CC=C1)C(=O)O MCULE-8081940811 [2,0,0,0,0,0|2,0,0]=4 1083 B10R1.61 CC1=C(N=CC=C1)C(=S)N MCULE-2200536604 [2,0,0,0,0,0|1,1,0]=4 1084 B10R1.61 CC1=CC=CC=C1C(=O)Cl MCULE-4338357930 [2,0,0,0,0,0|1,0,0]=3 1085 B10R1.61 CC1=CC=CC=C1C(=S)N MCULE-1845302494 [2,0,0,0,0,0|0,1,0]=3 1086 B10R1.61 CC1=CC=CC=C1[C@@H](C)N MCULE-2781089269 [2,0,0,0,0,0|1,0,1]=4 1087 B10R1.61 CC1=CC=CC=C1[C@@H](C)N MCULE-3440468020 [2,0,0,0,0,0|1,0,1]=4 1088 B10R1.61 CC1=CC=CC=C1[C@@H](C)N MCULE-5345092101 [2,0,0,0,0,0|1,0,1]=4 1089 B10R1.61 CC1=CC=CC=C1[C@@H](C)N MCULE-6974062752 [2,0,0,0,0,0|1,0,1]=4 1090 B10R1.61 CC1=CC=CC=C1[C@H](C)N MCULE-3034042622 [2,0,0,0,0,0|1,0,1]=4 1091 B10R1.61 CC1=CC=CC=C1[C@H](C)N MCULE-9993159840 [2,0,0,0,0,0|1,0,1]=4 1092 B10R1.61 CC1=CC=CN=C1C(=N)N MCULE-2131809236 [2,0,0,0,0,0|2,0,0]=4 1093 B10R1.61 CC1=CC=CN=C1C(=N)N MCULE-8430684761 [2,0,0,0,0,0|2,0,0]=4 1094 B10R1.61 CC1=CC=CN=C1C(=O)Cl MCULE-1705570381 [2,0,0,0,0,0|2,0,0]=4 1095 B10R1.61 CC1=CC=CN=C1C(=O)N MCULE-6395290096 [2,0,0,0,0,0|1,0,0]=3 1096 B10R1.61 CC1=CC=CN=C1C(=O)O MCULE-6679892229 [2,0,0,0,0,0|2,0,0]=4 1097 B10R1.61 CC1=CC=NC=C1C(=N)N MCULE-5742077619 [2,0,0,0,0,0|2,0,0]=4 1098 B10R1.61 CC1=CC=NC=C1C(=N)N MCULE-6407554392 [2,0,0,0,0,0|2,0,0]=4 1099 B10R1.61 CC1=CC=NC=C1C(=O)O MCULE-2967865061 [2,0,0,0,0,0|2,0,0]=4 1100 B10R1.61 CC1=CC=NC=C1C(=S)N MCULE-5029163739 [2,0,0,0,0,0|1,1,0]=4 1101 B10R1.61 CC1=CN=CC=C1C(=O)N MCULE-5659093153 [2,0,0,0,0,0|1,0,0]=3 1102 B10R1.61 CC1=NC=CC=C1C(=O)Cl MCULE-5422613457 [2,0,0,0,0,0|2,0,0]=4 1103 B10R1.61 CC1=NC=CN=C1C(=O)N MCULE-1199994902 [2,0,0,0,0,0|2,0,0]=4 1104 B10R1.61 CS(=O)C1=C(C=CC=C1)O MCULE-4255454592 [2,0,0,0,0,0|2,0,0]=4 1105 B10R1.61 C[C@@H](N)C1=C(C=CC=C1)O MCULE-7995139164 [2,0,0,0,0,0|1,0,1]=4 1106 B10R1.61 C[C@@H](N)C1=C(C=CC=C1)O MCULE-9576216324 [2,0,0,0,0,0|1,0,1]=4 1107 B10R1.61 C[C@@H](N)C1=CC=CC=C1O MCULE-9689056033 [2,0,0,0,0,0|1,0,1]=4 1108 B10R1.61 C[C@H](N)C1=C(C=CC=C1)O MCULE-9321514216 [2,0,0,0,0,0|1,0,1]=4 1109 B10R1.61 C[C@H](N)C1=CC=CC=C1O MCULE-4301361810 [2,0,0,0,0,0|1,0,1]=4 1110 B10R1.61 C[C@H](N)C1=CC=CC=C1O MCULE-9252601943 [2,0,0,0,0,0|1,0,1]=4 1111 B10R1.61 C[N+]1=C(C=CC=C1)C(=O)N MCULE-5169259935 [2,0,0,0,0,0|1,0,0]=3 1112 B10R1.61 C[N+]1=C(C=CC=C1)C(=O)N MCULE-7997821069 [2,0,0,0,0,0|1,0,0]=3 1113 B10R1.61 C[N+]1=C(C=CC=C1)C(=O)O MCULE-9509911443 [2,0,0,0,0,0|2,0,0]=4 1114 B10R1.61 C[N+]1=CC=CC=C1C(=O)[O-] MCULE-9633808834 [2,0,0,0,0,0|2,0,0]=4 1115 B10R1.61 N=C(N)C1=C(C=CC=C1)Br MCULE-3757710921 [2,0,0,0,0,0|2,0,0]=4 1116 B10R1.61 N=C(N)C1=C(C=CC=C1)Br MCULE-7761059365 [2,0,0,0,0,0|2,0,0]=4 1117 B10R1.61 N=C(N)C1=C(C=CC=C1)Cl MCULE-5883386793 [2,0,0,0,0,0|2,0,0]=4 1118 B10R1.61 N=C(N)C1=C(C=CC=C1)Cl MCULE-9730474328 [2,0,0,0,0,0|2,0,0]=4 1119 B10R1.61 N=C(N)C1=C(C=CC=C1)F MCULE-1845485741 [2,0,0,0,0,0|2,0,0]=4 1120 B10R1.61 N=C(N)C1=C(C=CC=C1)F MCULE-7139674090 [2,0,0,0,0,0|2,0,0]=4 1121 B10R1.61 N=C(N)C1=C(C=CC=C1)O MCULE-5077898189 [2,0,0,0,0,0|1,0,0]=3 1122 B10R1.61 N=C(N)C1=C(C=CC=C1)O MCULE-9455602450 [2,0,0,0,0,0|1,0,0]=3 1123 B10R1.61 N=C(N)C1=C(N=CC=C1)O MCULE-5091680971 [2,0,0,0,0,0|2,0,0]=4 1124 B10R1.61 N=C(N)C1=C(N=CC=C1)O MCULE-9847098958 [2,0,0,0,0,0|2,0,0]=4 1125 B10R1.61 NC(=O)C1=C(C=CC=C1)Br MCULE-9824828411 [2,0,0,0,0,0|1,0,0]=3 1126 B10R1.61 NC(=O)C1=C(C=CC=C1)Cl MCULE-2197159722 [2,0,0,0,0,0|1,0,0]=3 1127 B10R1.61 NC(=O)C1=C(C=CC=C1)F MCULE-1888512768 [2,0,0,0,0,0|1,0,0]=3 1128 B10R1.61 NC(=O)C1=C(C=CC=C1)O MCULE-5482995635 [2,0,0,0,0,0|0,0,0]=2 1129 B10R1.61 NC(=O)C1=C(C=CC=C1)S MCULE-6001730008 [2,0,0,0,0,0|0,1,0]=3 1130 B10R1.61 NC(=O)C1=C(C=CC=N1)Br MCULE-5589271808 [2,0,0,0,0,0|2,0,0]=4 1131 B10R1.61 NC(=O)C1=C(C=CC=N1)N MCULE-3973998454 [2,0,0,0,0,0|2,0,0]=4 1132 B10R1.61 NC(=O)C1=C(C=CC=N1)O MCULE-3212155538 [2,0,0,0,0,0|1,0,0]=3 1133 B10R1.61 NC(=O)C1=C(C=CN=C1)Cl MCULE-9875444719 [2,0,0,0,0,0|2,0,0]=4 1134 B10R1.61 NC(=O)C1=C(C=CN=C1)N MCULE-1402743622 [2,0,0,0,0,0|2,0,0]=4 1135 B10R1.61 NC(=O)C1=C(C=CN=C1)N MCULE-9586218080 [2,0,0,0,0,0|2,0,0]=4 1136 B10R1.61 NC(=O)C1=C(C=CN=C1)O MCULE-3805082690 [2,0,0,0,0,0|1,0,0]=3 1137 B10R1.61 NC(=O)C1=C(C=NC=C1)Br MCULE-9821398899 [2,0,0,0,0,0|2,0,0]=4 1138 B10R1.61 NC(=O)C1=C(C=NC=C1)Cl MCULE-4690728646 [2,0,0,0,0,0|2,0,0]=4 1139 B10R1.61 NC(=O)C1=C(C=NC=C1)F MCULE-3139012118 [2,0,0,0,0,0|2,0,0]=4 1140 B10R1.61 NC(=O)C1=C(C=NC=C1)N MCULE-7319689697 [2,0,0,0,0,0|2,0,0]=4 1141 B10R1.61 NC(=O)C1=C(N=CC=C1)Br MCULE-5384308853 [2,0,0,0,0,0|2,0,0]=4 1142 B10R1.61 NC(=O)C1=C(N=CC=C1)Cl MCULE-4022706398 [2,0,0,0,0,0|2,0,0]=4 1143 B10R1.61 NC(=O)C1=C(N=CC=C1)N MCULE-1431156151 [2,0,0,0,0,0|2,0,0]=4 1144 B10R1.61 NC(=O)C1=C(N=CC=C1)S MCULE-9849545949 [2,0,0,0,0,0|1,1,0]=4 1145 B10R1.61 NC(=O)C1=CC=CC=C1I MCULE-9927575220 [2,0,0,0,0,0|1,0,0]=3 1146 B10R1.61 NC(=O)C1=CC=CC=C1N MCULE-6335935491 [2,0,0,0,0,0|1,0,0]=3 1147 B10R1.61 NC(=O)C1=CC=CN=C1F MCULE-8064629807 [2,0,0,0,0,0|2,0,0]=4 1148 B10R1.61 NC(=O)C1=CC=CNC1=O MCULE-5159050018 [2,0,0,0,0,0|1,0,1]=4 1149 B10R1.61 NC(=O)C1=CC=NC=C1O MCULE-4727285160 [2,0,0,0,0,0|1,0,0]=3 1150 B10R1.61 NC(=O)C1=CN=CC=C1F MCULE-1603494017 [2,0,0,0,0,0|2,0,0]=4 1151 B10R1.61 NC(=O)C1=NC=CC=C1Cl MCULE-4072576423 [2,0,0,0,0,0|2,0,0]=4 1152 B10R1.61 NC(=O)C1=NC=CC=C1F MCULE-2859882052 [2,0,0,0,0,0|2,0,0]=4 1153 B10R1.61 NC(=O)C1=NC=CN=C1O MCULE-7149774620 [2,0,0,0,0,0|2,0,0]=4 1154 B10R1.61 NC(=S)C1=C(C=CC=C1)Br MCULE-9034448037 [2,0,0,0,0,0|1,1,0]=4 1155 B10R1.61 NC(=S)C1=C(C=CC=C1)F MCULE-3434438280 [2,0,0,0,0,0|1,1,0]=4 1156 B10R1.61 NC(=S)C1=C(C=CC=C1)O MCULE-1326205989 [2,0,0,0,0,0|0,1,0]=3 1157 B10R1.61 NC(=S)C1=CC=CC=C1Cl MCULE-6899783142 [2,0,0,0,0,0|1,1,0]=4 1158 B10R1.61 NC(=S)C1=CC=CC=C1I MCULE-9472151140 [2,0,0,0,0,0|1,1,0]=4 1159 B10R1.61 NC(=S)C1=CC=CC=C1N MCULE-1651353016 [2,0,0,0,0,0|1,1,0]=4 1160 B10R1.61 NC1=C(C=CC=C1)C(=O)O MCULE-8970106555 [2,0,0,0,0,0|2,0,0]=4 1161 B10R1.61 O=C(Cl)C1=C(C=CC=C1)Br MCULE-1832009044 [2,0,0,0,0,0|2,0,0]=4 1162 B10R1.61 O=C(Cl)C1=C(C=CC=C1)F MCULE-7273089296 [2,0,0,0,0,0|2,0,0]=4 1163 B10R1.61 O=C(Cl)C1=C(C=CC=C1)I MCULE-2174057030 [2,0,0,0,0,0|2,0,0]=4 1164 B10R1.61 O=C(Cl)C1=CC=CC=C1Cl MCULE-8943630978 [2,0,0,0,0,0|2,0,0]=4 1165 B10R1.61 O=C(Cl)C1=CC=CC=C1O MCULE-4010403743 [2,0,0,0,0,0|1,0,0]=3 1166 B10R1.61 O=C(Cl)C1=CC=CC=C1S MCULE-5048802101 [2,0,0,0,0,0|1,1,0]=4 1167 B10R1.61 O=C(Cl)C1=NC=CC=C1O MCULE-3590462423 [2,0,0,0,0,0|2,0,0]=4 1168 B10R1.61 O=C(O)C1=C(C=CC=C1)Br MCULE-3239222085 [2,0,0,0,0,0|2,0,0]=4 1169 B10R1.61 O=C(O)C1=C(C=CC=C1)Cl MCULE-1696137032 [2,0,0,0,0,0|2,0,0]=4 1170 B10R1.61 O=C(O)C1=C(C=CC=C1)O MCULE-4238157211 [2,0,0,0,0,0|1,0,0]=3 1171 B10R1.61 O=C(O)C1=C(C=CC=C1)S MCULE-8297385152 [2,0,0,0,0,0|1,1,0]=4 1172 B10R1.61 O=C(O)C1=C(C=CC=N1)O MCULE-7115836080 [2,0,0,0,0,0|2,0,0]=4 1173 B10R1.61 O=C(O)C1=C(C=CN=C1)O MCULE-9587370315 [2,0,0,0,0,0|2,0,0]=4 1174 B10R1.61 O=C(O)C1=C(C=NC=C1)O MCULE-6913534695 [2,0,0,0,0,0|2,0,0]=4 1175 B10R1.61 O=C(O)C1=CC=CC=C1F MCULE-2885931404 [2,0,0,0,0,0|2,0,0]=4 1176 B10R1.61 O=C(O)C1=CC=CC=C1I MCULE-5987010449 [2,0,0,0,0,0|2,0,0]=4 1177 B10R1.61 O=C(O)C1=CC=CC=C1O MCULE-8407868694 [2,0,0,0,0,0|1,0,0]=3 1178 B10R1.61 O=C(O)C1=CC=CC=C1O MCULE-8756695354 [2,0,0,0,0,0|1,0,0]=3 1179 B10R1.61 O=C(O)C1=CC=CC=C1O MCULE-9332636114 [2,0,0,0,0,0|1,0,0]=3 1180 B10R1.61 O=C(O)C1=CC=CN=C1O MCULE-3119679537 [2,0,0,0,0,0|2,0,0]=4 1181 B10R1.61 O=C([O-])C1=C(C=CC=C1)Cl MCULE-5343724494 [2,0,0,0,0,0|2,0,0]=4 1182 B10R1.61 O=C([O-])C1=C(C=CC=C1)O MCULE-8473693653 [2,0,0,0,0,0|1,0,0]=3 1183 B10R1.61 O=C([O-])C1=C(C=CC=C1)S MCULE-8341188760 [2,0,0,0,0,0|1,1,0]=4 1184 B10R1.61 O=C([O-])C1=C(C=CN=C1)O MCULE-5831902195 [2,0,0,0,0,0|2,0,0]=4 1185 B10R1.61 O=C([O-])C1=C(N=CC=C1)O MCULE-9169400221 [2,0,0,0,0,0|2,0,0]=4 1186 B10R1.61 O=C([O-])C1=CC=CC=C1Cl MCULE-5178645893 [2,0,0,0,0,0|2,0,0]=4 1187 B10R1.61 O=C([O-])C1=CC=CC=C1F MCULE-2391457515 [2,0,0,0,0,0|2,0,0]=4 1188 B10R1.61 O=C([O-])C1=CC=CC=C1O MCULE-9355450041 [2,0,0,0,0,0|1,0,0]=3 1189 B10R1.61 O=N(=O)C1=C(C=CC=C1)O MCULE-1415513135 [2,0,0,0,0,0|2,0,0]=4 1190 B10R1.61 O=P(O)C1=C(C=CC=C1)O MCULE-9956328914 [2,0,0,0,0,0|2,0,0]=4 1191 B10R1.61 OC(=S)C1=CC=CC=C1O MCULE-2639793618 [2,0,0,0,0,0|1,0,1]=4 1192 B10R1.61 OC1=C(C=CC=C1)C(=S)S MCULE-7166145980 [2,0,0,0,0,0|1,1,0]=4 1193 B12R0.248 CCCC=CC=CC=CC(=O)OC MCULE-8330581603 [0,1,1,0,0,0|2,0,0]=4 1194 B12R1.75 C#CC1=C(C=CC=C1)OC(C)C MCULE-1076755590 [1,1,0,0,0,0|1,0,1]=4 1195 B12R1.75 C(F)(F)OC1=CC=CC=C1CN MCULE-5572521284 [1,1,0,0,0,0|1,0,1]=4 1196 B12R1.75 C=CC1=C(C=CC=C1)OC(=O)C MCULE-2315461667 [1,1,0,0,0,0|1,0,1]=4 1197 B12R1.75 C=CC1=C(C=CC=C1)OC(C)C MCULE-2084426988 [1,1,0,0,0,0|1,0,0]=3 1198 B12R1.75 CC(=O)NC1=C(C=CC=C1)C=O MCULE-1063993291 [1,1,0,0,0,0|1,0,1]=4 1199 B12R1.75 CC(=O)OC1=C(C=CC=C1)C=O MCULE-3586473282 [1,1,0,0,0,0|0,0,1]=3 1200 B12R1.75 CC(=O)OC1=C(C=CC=C1)CN MCULE-7198985146 [1,1,0,0,0,0|0,0,2]=4 1201 B12R1.75 CC(=O)OC1=C(C=CC=C1)CN MCULE-7277701614 [1,1,0,0,0,0|0,0,2]=4 1202 B12R1.75 CC(C)CC1=C(C=CC=C1)C=O MCULE-5851902292 [1,1,0,0,0,0|1,0,0]=3 1203 B12R1.75 CC(C)CC1=C(C=CC=C1)CN MCULE-1007375617 [1,1,0,0,0,0|1,0,1]=4 1204 B12R1.75 CC(C)CC1=CC=CC=C1CN MCULE-3193324379 [1,1,0,0,0,0|1,0,1]=4 1205 B12R1.75 CC(C)OC1=C(C=CC=C1)C=O MCULE-5158119520 [1,1,0,0,0,0|0,0,0]=2 1206 B12R1.75 CC(C)OC1=C(C=CC=C1)CCl MCULE-8564000550 [1,1,0,0,0,0|1,0,1]=4 1207 B12R1.75 CC(C)OC1=C(C=CC=C1)CO MCULE-3248229982 [1,1,0,0,0,0|0,0,2]=4 1208 B12R1.75 CC(C)OC1=C(C=CC=N1)C=O MCULE-4052924627 [1,1,0,0,0,0|1,0,0]=3 1209 B12R1.75 CC(C)OC1=C(C=CC=N1)CN MCULE-8090958389 [1,1,0,0,0,0|1,0,1]=4 1210 B12R1.75 CC(C)OC1=C(C=CN=C1)CN MCULE-4843911969 [1,1,0,0,0,0|1,0,1]=4 1211 B12R1.75 CC(C)OC1=CC=CC=C1C#N MCULE-3202299490 [1,1,0,0,0,0|0,0,2]=4 1212 B12R1.75 CC(C)OC1=CC=CC=C1CN MCULE-1925489407 [1,1,0,0,0,0|0,0,1]=3 1213 B12R1.75 CC(C)OC1=CC=CC=C1CN MCULE-7725165437 [1,1,0,0,0,0|0,0,1]=3 1214 B12R1.75 CC(C)OC1=CC=CN=C1C=O MCULE-8032401820 [1,1,0,0,0,0|1,0,0]=3 1215 B12R1.75 CC(C)OC1=NC=CC=C1CN MCULE-7394708307 [1,1,0,0,0,0|1,0,1]=4 1216 B12R1.75 CN(C)CC1=C(C=CC=C1)C=O MCULE-7186944605 [1,1,0,0,0,0|2,0,0]=4 1217 B12R1.75 CSC1=CC=CC=C1OC(C)C MCULE-7457850249 [1,1,0,0,0,0|2,0,0]=4 1218 B12R1.75 NCC1=CC=CC=C1OC(F)F MCULE-3809400770 [1,1,0,0,0,0|1,0,1]=4 1219 B12R1.75 O=CC1=C(C=CC=C1)OC(F)F MCULE-9090796604 [1,1,0,0,0,0|1,0,0]=3 1220 B12R1.75 O=CC1=CC=CN=C1OC(F)F MCULE-6322130761 [1,1,0,0,0,0|2,0,0]=4 1221 B12R1.77 CCN(C)C1=C(C=CC=C1)CN MCULE-4929754458 [1,1,0,0,0,0|1,0,1]=4 1222 B12R1.77 COC(=O)C1=C(C=CC=C1)C=O MCULE-4277651382 [1,1,0,0,0,0|2,0,0]=4 1223 B12R1.112 C#CC1=CC(=CC=C1OCC)Br MCULE-4615271897 [1,1,0,0,0,0|1,0,1]=4 1224 B12R1.112 C#CC1=CC(=CC=C1OCC)F MCULE-2383001710 [1,1,0,0,0,0|1,0,1]=4 1225 B12R1.112 C=CC1=CC(=CC=C1OCC)Br MCULE-7102194884 [1,1,0,0,0,0|1,0,0]=3 1226 B12R1.112 C=CC1=CC(=CC=C1OCC)Cl MCULE-4328028428 [1,1,0,0,0,0|1,0,0]=3 1227 B12R1.112 C=CC1=CC(=CC=C1OCC)F MCULE-3863023844 [1,1,0,0,0,0|1,0,0]=3 1228 B12R1.112 CCOC1=C(C=C(C=C1)Br)CC MCULE-6168051459 [1,1,0,0,0,0|1,0,1]=4 1229 B12R1.112 CCOC1=C(C=C(C=C1)C)SC MCULE-1784576027 [1,1,0,0,0,0|2,0,0]=4 1230 B12R1.112 CCOC1=C(C=C(C=C1)Cl)C#N MCULE-9070928529 [1,1,0,0,0,0|0,0,2]=4 1231 B12R1.112 CCOC1=C(C=C(C=C1)Cl)CO MCULE-9763208060 [1,1,0,0,0,0|0,0,2]=4 1232 B12R1.112 CCOC1=C(C=C(C=C1)Cl)CS MCULE-9205353393 [1,1,0,0,0,0|0,1,1]=4 1233 B12R1.112 CCOC1=C(C=C(C=C1)F)C#N MCULE-4261418137 [1,1,0,0,0,0|0,0,2]=4 1234 B12R1.112 CCOC1=C(C=C(C=C1)F)C=O MCULE-3743335913 [1,1,0,0,0,0|0,0,0]=2 1235 B12R1.112 CCOC1=C(C=C(C=C1)F)CN MCULE-8292350567 [1,1,0,0,0,0|0,0,1]=3 1236 B12R1.112 CCOC1=C(C=C(C=C1)F)CO MCULE-3675556603 [1,1,0,0,0,0|0,0,2]=4 1237 B12R1.112 CCOC1=C(C=C(C=C1)F)SC MCULE-8892076948 [1,1,0,0,0,0|2,0,0]=4 1238 B12R1.112 CCOC1=C(C=C(C=C1)N)C#N MCULE-4165562841 [1,1,0,0,0,0|0,0,2]=4 1239 B12R1.112 CCOC1=C(C=C(C=C1)N)CO MCULE-2386991036 [1,1,0,0,0,0|0,0,2]=4 1240 B12R1.112 CCOC1=C(C=C(C=N1)Br)C=O MCULE-8480598007 [1,1,0,0,0,0|1,0,0]=3 1241 B12R1.112 CCOC1=C(C=C(C=N1)Cl)C=O MCULE-1185928585 [1,1,0,0,0,0|1,0,0]=3 1242 B12R1.112 CCOC1=CC=C(C=C1C#N)Br MCULE-8300472101 [1,1,0,0,0,0|0,0,2]=4 1243 B12R1.112 CCOC1=CC=C(C=C1C#N)I MCULE-6053981905 [1,1,0,0,0,0|0,0,2]=4 1244 B12R1.112 CCOC1=CC=C(C=C1C=O)Br MCULE-2107732930 [1,1,0,0,0,0|0,0,0]=2 1245 B12R1.112 CCOC1=CC=C(C=C1C=O)C MCULE-4653471874 [1,1,0,0,0,0|0,0,0]=2 1246 B12R1.112 CCOC1=CC=C(C=C1C=O)Cl MCULE-9714474258 [1,1,0,0,0,0|0,0,0]=2 1247 B12R1.112 CCOC1=CC=C(C=C1C=O)I MCULE-7216803246 [1,1,0,0,0,0|0,0,0]=2 1248 B12R1.112 CCOC1=CC=C(C=C1CBr)Br MCULE-7681178631 [1,1,0,0,0,0|1,0,1]=4 1249 B12R1.112 CCOC1=CC=C(C=C1CC)N MCULE-7250163151 [1,1,0,0,0,0|1,0,1]=4 1250 B12R1.112 CCOC1=CC=C(C=C1CN)Br MCULE-7279126430 [1,1,0,0,0,0|0,0,1]=3 1251 B12R1.112 CCOC1=CC=C(C=C1CN)C MCULE-1656366700 [1,1,0,0,0,0|0,0,1]=3 1252 B12R1.112 CCOC1=CC=C(C=C1CN)I MCULE-1935902792 [1,1,0,0,0,0|0,0,1]=3 1253 B12R1.112 CCOC1=CC=C(C=C1CO)Br MCULE-8495611566 [1,1,0,0,0,0|0,0,2]=4 1254 B12R1.112 CCOC1=CC=C(C=C1CO)C MCULE-1074005626 [1,1,0,0,0,0|0,0,2]=4 1255 B12R1.112 CCOC1=CC=C(C=C1OC)Br MCULE-8137083541 [1,1,0,0,0,0|2,0,0]=4 1256 B12R1.112 CCOC1=CC=C(C=C1OC)C MCULE-3675583827 [1,1,0,0,0,0|2,0,0]=4 1257 B12R1.112 CCOC1=CC=C(C=C1OC)N MCULE-4154505043 [1,1,0,0,0,0|2,0,0]=4 1258 B12R1.112 CCOC1=CC=C(C=C1OC)O MCULE-8291160722 [1,1,0,0,0,0|2,0,0]=4 1259 B12R1.112 CCOC1=CC=C(C=C1SC)Cl MCULE-8481379998 [1,1,0,0,0,0|2,0,0]=4 1260 B12R1.112 CCSC1=CC=C(C=C1CN)F MCULE-1537575935 [1,1,0,0,0,0|0,1,1]=4 1261 B12R1.121 C#CC1=C(C=CC=C1)OCCC MCULE-3396722454 [1,1,0,0,0,0|1,0,1]=4 1262 B12R1.121 C#CCOC1=C(C=CC=C1)CN MCULE-7034701270 [1,1,0,0,0,0|0,0,2]=4 1263 B12R1.121 C#CCOC1=C(C=CC=C1)CN MCULE-7821925121 [1,1,0,0,0,0|0,0,2]=4 1264 B12R1.121 C#CCOC1=CC=CC=C1C=O MCULE-5266861376 [1,1,0,0,0,0|0,0,1]=3 1265 B12R1.121 C=CCCC1=C(C=CC=C1)C=O MCULE-3999997599 [1,1,0,0,0,0|1,0,1]=4 1266 B12R1.121 C=CCOC1=C(C=CC=C1)C=O MCULE-7006905286 [1,1,0,0,0,0|0,0,1]=3 1267 B12R1.121 C=CCOC1=C(C=CC=C1)CN MCULE-7177955104 [1,1,0,0,0,0|0,0,2]=4 1268 B12R1.121 CCC1=C(C=CC=C1)OCCBr MCULE-3712740725 [1,1,0,0,0,0|1,0,1]=4 1269 B12R1.121 CCC1=C(C=CC=C1)OCCN MCULE-4219414234 [1,1,0,0,0,0|1,0,1]=4 1270 B12R1.121 CCC1=C(C=CC=C1)OCOC MCULE-8340971013 [1,1,0,0,0,0|1,0,1]=4 1271 B12R1.121 CCCOC1=C(C=CC=C1)CO MCULE-3522593383 [1,1,0,0,0,0|0,0,2]=4 1272 B12R1.121 CCCOC1=C(C=CC=C1)SC MCULE-6155212059 [1,1,0,0,0,0|2,0,0]=4 1273 B12R1.121 CCCOC1=C(C=CC=N1)C=O MCULE-5574113587 [1,1,0,0,0,0|1,0,0]=3 1274 B12R1.121 CCCOC1=C(C=CC=N1)CN MCULE-8366456345 [1,1,0,0,0,0|1,0,1]=4 1275 B12R1.121 CCCOC1=C(C=CN=C1)CN MCULE-5934382117 [1,1,0,0,0,0|1,0,1]=4 1276 B12R1.121 CCCOC1=CC=CC=C1C#N MCULE-7193844564 [1,1,0,0,0,0|0,0,2]=4 1277 B12R1.121 CCCOC1=CC=CC=C1C=O MCULE-7807414930 [1,1,0,0,0,0|0,0,0]=2 1278 B12R1.121 CCCOC1=CC=CC=C1CBr MCULE-5561564500 [1,1,0,0,0,0|1,0,1]=4 1279 B12R1.121 CCCOC1=CC=CC=C1CN MCULE-9467130781 [1,1,0,0,0,0|0,0,1]=3 1280 B12R1.121 CCCOC1=CC=CC=C1NC MCULE-6658766269 [1,1,0,0,0,0|2,0,0]=4 1281 B12R1.121 CCCSC1=C(C=CC=C1)C=O MCULE-1279835793 [1,1,0,0,0,0|0,1,0]=3 1282 B12R1.121 CCOCC1=C(C=CC=C1)CN MCULE-5647422736 [1,1,0,0,0,0|0,0,1]=3 1283 B12R1.121 COC1=C(C=CC=C1)OCCBr MCULE-9535305217 [1,1,0,0,0,0|2,0,0]=4 1284 B12R1.121 COC1=C(C=CC=C1)OCCN MCULE-4440960495 [1,1,0,0,0,0|2,0,0]=4 1285 B12R1.121 COC1=C(C=CC=C1)OCCO MCULE-4436511881 [1,1,0,0,0,0|2,0,0]=4 1286 B12R1.121 COC1=CC=CC=C1OCCCl MCULE-7596457115 [1,1,0,0,0,0|2,0,0]=4 1287 B12R1.121 COC1=CC=CC=C1OCCN MCULE-1655412691 [1,1,0,0,0,0|2,0,0]=4 1288 B12R1.121 COCOC1=C(C=CC=C1)OC MCULE-6877261815 [1,1,0,0,0,0|2,0,0]=4 1289 B12R1.121 COCOC1=CC=CC=C1C#N MCULE-1908167531 [1,1,0,0,0,0|0,0,2]=4 1290 B12R1.121 COCOC1=CC=CC=C1SC MCULE-2103116756 [1,1,0,0,0,0|2,0,0]=4 1291 B12R1.121 CSC1=CC=CC=C1OCCN MCULE-2347367871 [1,1,0,0,0,0|2,0,0]=4 1292 B12R1.121 FCCOC1=C(C=CC=C1)CBr MCULE-1589789079 [1,1,0,0,0,0|1,0,1]=4 1293 B12R1.121 FCCOC1=C(C=CC=C1)CCl MCULE-7421744175 [1,1,0,0,0,0|1,0,1]=4 1294 B12R1.121 N#CC1=C(C=CC=C1)OCCBr MCULE-5837570103 [1,1,0,0,0,0|0,0,2]=4 1295 B12R1.121 N#CC1=CC=CC=C1OCCN MCULE-6015652892 [1,1,0,0,0,0|0,0,2]=4 1296 B12R1.121 N#CC1=CC=CC=C1OCCO MCULE-7159603880 [1,1,0,0,0,0|0,0,2]=4 1297 B12R1.121 N#CCOC1=C(C=CC=C1)C=O MCULE-7863978100 [1,1,0,0,0,0|0,0,1]=3 1298 B12R1.121 NCC1=C(C=CC=C1)OCCF MCULE-2136330758 [1,1,0,0,0,0|0,0,1]=3 1299 B12R1.121 NCC1=C(C=CC=C1)OCCO MCULE-1691957030 [1,1,0,0,0,0|0,0,1]=3 1300 B12R1.121 NCC1=C(C=CC=C1)OCCO MCULE-4798168616 [1,1,0,0,0,0|0,0,1]=3 1301 B12R1.121 NCC1=C(C=NC=C1)OCCO MCULE-6476106847 [1,1,0,0,0,0|1,0,1]=4 1302 B12R1.121 O=CC1=C(C=CC=C1)OCCCl MCULE-1073530018 [1,1,0,0,0,0|0,0,0]=2 1303 B12R1.121 O=CC1=C(C=CC=C1)OCCF MCULE-3166781700 [1,1,0,0,0,0|0,0,0]=2 1304 B12R1.121 O=CC1=CC=CC=C1OCCBr MCULE-4427069708 [1,1,0,0,0,0|0,0,0]=2 1305 B12R1.121 O=CC1=CC=CC=C1OCCO MCULE-7840607650 [1,1,0,0,0,0|0,0,0]=2 1306 B12R1.121 OCC1=C(C=CC=C1)OCCF MCULE-9271516819 [1,1,0,0,0,0|0,0,2]=4 1307 B12R1.169 C=CCC1=C(C=CC=C1)OCC MCULE-4842253825 [1,1,0,0,0,0|1,0,0]=3 1308 B12R1.169 CCCC1=C(C=CC=C1)N=C=O MCULE-7304693305 [1,1,0,0,0,0|1,0,1]=4 1309 B12R1.169 CCNC1=C(C=CC=C1)OCC MCULE-2872360505 [1,1,0,0,0,0|1,0,1]=4 1310 B12R1.169 CCNC1=CC=CC=C1N=C=O MCULE-7123727625 [1,1,0,0,0,0|1,0,1]=4 1311 B12R1.169 CCOC1=C(C=CC=C1)CC#N MCULE-4816839321 [1,1,0,0,0,0|0,0,2]=4 1312 B12R1.169 CCOC1=C(C=CC=C1)CCN MCULE-4221487718 [1,1,0,0,0,0|0,0,1]=3 1313 B12R1.169 CCOC1=C(C=CC=C1)CCN MCULE-6399193156 [1,1,0,0,0,0|0,0,1]=3 1314 B12R1.169 CCOC1=C(C=CC=C1)CCO MCULE-6046523375 [1,1,0,0,0,0|0,0,2]=4 1315 B12R1.169 CCOC1=C(C=CC=C1)CNC MCULE-4258783664 [1,1,0,0,0,0|0,0,1]=3 1316 B12R1.169 CCOC1=C(C=CC=C1)CNC MCULE-5090488794 [1,1,0,0,0,0|0,0,1]=3 1317 B12R1.169 CCOC1=C(C=CC=C1)NC=O MCULE-3319171176 [1,1,0,0,0,0|0,0,0]=2 1318 B12R1.169 CCOC1=CC=CC=C1CCBr MCULE-4827864120 [1,1,0,0,0,0|1,0,1]=4 1319 B12R1.169 CCOC1=CC=CC=C1CNN MCULE-7188313009 [1,1,0,0,0,0|0,0,1]=3 1320 B12R1.169 CCOC1=CC=CC=C1N=C=O MCULE-1520183489 [1,1,0,0,0,0|0,0,1]=3 1321 B12R1.169 CCOC1=CC=CC=C1N=C=S MCULE-3255403809 [1,1,0,0,0,0|0,1,1]=4 1322 B12R1.169 CCOC1=CC=CC=C1OCC MCULE-9791850249 [1,1,0,0,0,0|1,0,1]=4 1323 B12R1.169 CCSC1=C(C=CC=C1)CCN MCULE-4169772763 [1,1,0,0,0,0|0,1,1]=4 1324 B12R1.268 C#CC1=CC=C(C=C1OCC)Br MCULE-1203600783 [1,1,0,0,0,0|1,0,1]=4 1325 B12R1.268 C#CC1=CC=C(C=C1OCC)C MCULE-2618510395 [1,1,0,0,0,0|1,0,1]=4 1326 B12R1.268 C#CC1=CC=C(C=C1OCC)Cl MCULE-4050896778 [1,1,0,0,0,0|1,0,1]=4 1327 B12R1.268 CCCC1=C(C=CC(=C1)F)CN MCULE-1869287266 [1,1,0,0,0,0|1,0,1]=4 1328 B12R1.268 CCCC1=CC(=CC=C1C=O)F MCULE-9738389185 [1,1,0,0,0,0|1,0,0]=3 1329 B12R1.268 CCCC1=CC(=CC=C1CN)F MCULE-2931062990 [1,1,0,0,0,0|1,0,1]=4 1330 B12R1.268 CCNC1=C(C=NC(=C1)Cl)C=O MCULE-5374673407 [1,1,0,0,0,0|2,0,0]=4 1331 B12R1.268 CCOC1=C(C=CC(=C1)Br)C#N MCULE-9066653891 [1,1,0,0,0,0|0,0,2]=4 1332 B12R1.268 CCOC1=C(C=CC(=C1)Br)OC MCULE-3086072713 [1,1,0,0,0,0|2,0,0]=4 1333 B12R1.268 CCOC1=C(C=CC(=C1)C)C#N MCULE-6130228197 [1,1,0,0,0,0|0,0,2]=4 1334 B12R1.268 CCOC1=C(C=CC(=C1)C)CN MCULE-1978518925 [1,1,0,0,0,0|0,0,1]=3 1335 B12R1.268 CCOC1=C(C=CC(=C1)Cl)C#N MCULE-3099406272 [1,1,0,0,0,0|0,0,2]=4 1336 B12R1.268 CCOC1=C(C=CC(=C1)Cl)CN MCULE-5617484329 [1,1,0,0,0,0|0,0,1]=3 1337 B12R1.268 CCOC1=C(C=CC(=C1)Cl)CN MCULE-8302216844 [1,1,0,0,0,0|0,0,1]=3 1338 B12R1.268 CCOC1=C(C=CC(=C1)Cl)CO MCULE-2413251221 [1,1,0,0,0,0|0,0,2]=4 1339 B12R1.268 CCOC1=C(C=CC(=C1)Cl)SC MCULE-5519882475 [1,1,0,0,0,0|2,0,0]=4 1340 B12R1.268 CCOC1=C(C=CC(=C1)F)CO MCULE-5322021766 [1,1,0,0,0,0|0,0,2]=4 1341 B12R1.268 CCOC1=C(C=CC(=C1)F)SC MCULE-7631539601 [1,1,0,0,0,0|2,0,0]=4 1342 B12R1.268 CCOC1=C(C=CC(=C1)N)OC MCULE-5673388474 [1,1,0,0,0,0|2,0,0]=4 1343 B12R1.268 CCOC1=C(C=CC(=C1)S)OC MCULE-2428720715 [1,1,0,0,0,0|2,0,0]=4 1344 B12R1.268 CCOC1=C(C=NC(=C1)Cl)CN MCULE-1659168577 [1,1,0,0,0,0|1,0,1]=4 1345 B12R1.268 CCOC1=C(C=NC(=C1)Cl)CN MCULE-8025730468 [1,1,0,0,0,0|1,0,1]=4 1346 B12R1.268 CCOC1=CC(=CC=C1C#N)N MCULE-5028922634 [1,1,0,0,0,0|0,0,2]=4 1347 B12R1.268 CCOC1=CC(=CC=C1C=O)Br MCULE-3664754346 [1,1,0,0,0,0|0,0,0]=2 1348 B12R1.268 CCOC1=CC(=CC=C1C=O)C MCULE-7788524369 [1,1,0,0,0,0|0,0,0]=2 1349 B12R1.268 CCOC1=CC(=CC=C1C=O)Cl MCULE-9175823976 [1,1,0,0,0,0|0,0,0]=2 1350 B12R1.268 CCOC1=CC(=CC=C1C=O)F MCULE-9699238835 [1,1,0,0,0,0|0,0,0]=2 1351 B12R1.268 CCOC1=CC(=CC=C1C=O)O MCULE-2179239515 [1,1,0,0,0,0|0,0,0]=2 1352 B12R1.268 CCOC1=CC(=CC=C1CN)Br MCULE-6455746765 [1,1,0,0,0,0|0,0,1]=3 1353 B12R1.268 CCOC1=CC(=CC=C1CN)Br MCULE-9163352283 [1,1,0,0,0,0|0,0,1]=3 1354 B12R1.268 CCOC1=CC(=CC=C1CN)F MCULE-3309089822 [1,1,0,0,0,0|0,0,1]=3 1355 B12R1.268 CCOC1=CC(=CC=C1CN)F MCULE-3765465901 [1,1,0,0,0,0|0,0,1]=3 1356 B12R1.268 CCOC1=CC(=CC=C1CO)Br MCULE-6871286955 [1,1,0,0,0,0|0,0,2]=4 1357 B12R1.268 CCOC1=CC(=CC=C1CO)C MCULE-6942439772 [1,1,0,0,0,0|0,0,2]=4 1358 B12R1.268 CCOC1=CC(=CC=C1OC)F MCULE-9368438864 [1,1,0,0,0,0|2,0,0]=4 1359 B12R1.268 CCOC1=CC(=CC=C1OC)O MCULE-4611670178 [1,1,0,0,0,0|2,0,0]=4 1360 B12R1.268 CCSC1=C(C=CC(=C1)Br)C=O MCULE-7389081384 [1,1,0,0,0,0|0,1,0]=3 1361 B12R1.542 C#CC1=C(C=CC=C1OCC)F MCULE-7961449098 [1,1,0,0,0,0|1,0,1]=4 1362 B12R1.542 CCOC1=C(C(=CC=C1)Br)C#N MCULE-1714123904 [1,1,0,0,0,0|0,0,2]=4 1363 B12R1.542 CCOC1=C(C(=CC=C1)Br)OC MCULE-7869828008 [1,1,0,0,0,0|2,0,0]=4 1364 B12R1.542 CCOC1=C(C(=CC=C1)Cl)C=O MCULE-4020906615 [1,1,0,0,0,0|0,0,0]=2 1365 B12R1.542 CCOC1=C(C(=CC=C1)Cl)CBr MCULE-3907469184 [1,1,0,0,0,0|1,0,1]=4 1366 B12R1.542 CCOC1=C(C(=CC=C1)Cl)CN MCULE-6283999103 [1,1,0,0,0,0|0,0,1]=3 1367 B12R1.542 CCOC1=C(C(=CC=C1)Cl)CN MCULE-6299195860 [1,1,0,0,0,0|0,0,1]=3 1368 B12R1.542 CCOC1=C(C(=CC=C1)F)C=O MCULE-6858920747 [1,1,0,0,0,0|0,0,0]=2 1369 B12R1.542 CCOC1=C(C(=CC=C1)F)CN MCULE-4604194043 [1,1,0,0,0,0|0,0,1]=3 1370 B12R1.542 CCOC1=C(C(=CC=C1)F)SC MCULE-9580548826 [1,1,0,0,0,0|2,0,0]=4 1371 B12R1.542 CCOC1=C(C(=CC=N1)I)C=O MCULE-9645560478 [1,1,0,0,0,0|1,0,0]=3 1372 B12R1.542 CCOC1=CC=CC(=C1C#N)C MCULE-5882864458 [1,1,0,0,0,0|0,0,2]=4 1373 B12R1.542 CCOC1=CC=CC(=C1C#N)F MCULE-7510026148 [1,1,0,0,0,0|0,0,2]=4 1374 B12R1.542 CCOC1=CC=CC(=C1CN)Br MCULE-5927890979 [1,1,0,0,0,0|0,0,1]=3 1375 B12R1.542 CCOC1=CC=CC(=C1CO)F MCULE-1002901074 [1,1,0,0,0,0|0,0,2]=4 1376 B12R1.542 CCOC1=CN=CC(=C1C=O)Cl MCULE-1727835691 [1,1,0,0,0,0|1,0,0]=3 1377 B12R1.1112 C#CC1=C(C(=CC=C1)Cl)OCC MCULE-3135126043 [1,1,0,0,0,0|1,0,1]=4 1378 B12R1.1112 C#CC1=CC=CC(=C1OCC)C MCULE-2566761984 [1,1,0,0,0,0|1,0,1]=4 1379 B12R1.1112 C#CC1=CC=CC(=C1OCC)F MCULE-6576939110 [1,1,0,0,0,0|1,0,1]=4 1380 B12R1.1112 C=CC1=C(C(=CC=C1)Br)OCC MCULE-9134660626 [1,1,0,0,0,0|1,0,0]=3 1381 B12R1.1112 C=CC1=C(C(=CC=C1)Cl)OCC MCULE-5280700261 [1,1,0,0,0,0|1,0,0]=3 1382 B12R1.1112 C=CC1=C(C(=CC=C1)F)OCC MCULE-4685345995 [1,1,0,0,0,0|1,0,0]=3 1383 B12R1.1112 C=CC1=CC=CC(=C1OCC)C MCULE-2914357009 [1,1,0,0,0,0|1,0,0]=3 1384 B12R1.1112 CCNC1=C(C=CC=C1Br)C=O MCULE-3327897576 [1,1,0,0,0,0|1,0,0]=3 1385 B12R1.1112 CCOC1=C(C=CC=C1Br)CN MCULE-7238643011 [1,1,0,0,0,0|0,0,1]=3 1386 B12R1.1112 CCOC1=C(C=CC=C1Br)CO MCULE-7324426428 [1,1,0,0,0,0|0,0,2]=4 1387 B12R1.1112 CCOC1=C(C=CC=C1Br)OC MCULE-5778409077 [1,1,0,0,0,0|2,0,0]=4 1388 B12R1.1112 CCOC1=C(C=CC=C1C=O)Br MCULE-7202561233 [1,1,0,0,0,0|0,0,0]=2 1389 B12R1.1112 CCOC1=C(C=CC=C1C=O)C MCULE-1735025005 [1,1,0,0,0,0|0,0,0]=2 1390 B12R1.1112 CCOC1=C(C=CC=C1CN)Br MCULE-5656445609 [1,1,0,0,0,0|0,0,1]=3 1391 B12R1.1112 CCOC1=C(C=CC=C1CN)Cl MCULE-7897894489 [1,1,0,0,0,0|0,0,1]=3 1392 B12R1.1112 CCOC1=C(C=CC=C1Cl)C=O MCULE-3323979444 [1,1,0,0,0,0|0,0,0]=2 1393 B12R1.1112 CCOC1=C(C=CC=C1Cl)CN MCULE-5638493382 [1,1,0,0,0,0|0,0,1]=3 1394 B12R1.1112 CCOC1=C(C=CC=C1F)C=O MCULE-3011915991 [1,1,0,0,0,0|0,0,0]=2 1395 B12R1.1112 CCOC1=C(C=CC=C1F)CN MCULE-5461897541 [1,1,0,0,0,0|0,0,1]=3 1396 B12R1.1112 CCOC1=C(C=CC=C1F)OC MCULE-4780902359 [1,1,0,0,0,0|2,0,0]=4 1397 B12R1.1112 CCOC1=C(C=CC=C1I)OC MCULE-6296311110 [1,1,0,0,0,0|2,0,0]=4 1398 B12R1.1112 CCOC1=C(C=CC=C1I)SC MCULE-5482761932 [1,1,0,0,0,0|2,0,0]=4 1399 B12R1.1112 CCOC1=C(C=CC=C1SC)Br MCULE-7773003994 [1,1,0,0,0,0|2,0,0]=4 1400 B12R1.46 CCC1=C(C=C(C=C1)Br)C(=O)O MCULE-5810393840 [1,1,0,0,0,0|1,0,0]=3 1401 B12R1.46 CCC1=C(C=C(C=C1)F)C(=O)O MCULE-5768134144 [1,1,0,0,0,0|1,0,0]=3 1402 B12R1.46 CCC1=C(C=C(C=C1)I)C(=O)O MCULE-6419765423 [1,1,0,0,0,0|1,0,0]=3 1403 B12R1.46 CCC1=C(C=C(C=C1)N)N(=O)=O MCULE-2661449226 [1,1,0,0,0,0|2,0,0]=4 1404 B12R1.46 CCC1=C(C=C(C=N1)F)C(=O)O MCULE-6335971415 [1,1,0,0,0,0|2,0,0]=4 1405 B12R1.46 CCC1=C(C=C(N=C1)C)C(=O)O MCULE-9584187528 [1,1,0,0,0,0|2,0,0]=4 1406 B12R1.46 CCC1=C(N=C(C=C1)C)C(=O)O MCULE-9098168312 [1,1,0,0,0,0|2,0,0]=4 1407 B12R1.46 CCC1=CC=C(C=C1C(=O)O)Cl MCULE-9576429172 [1,1,0,0,0,0|1,0,0]=3 1408 B12R1.46 CCC1=CC=C(C=C1N(=O)=O)Br MCULE-3244677751 [1,1,0,0,0,0|2,0,0]=4 1409 B12R1.46 CNC1=C(C=C(C=C1)Cl)C(=O)O MCULE-8825611158 [1,1,0,0,0,0|2,0,0]=4 1410 B12R1.46 CNC1=C(C=C(C=C1)F)C(=O)O MCULE-6557290315 [1,1,0,0,0,0|2,0,0]=4 1411 B12R1.46 CNC1=CC=C(C=C1C(=O)N)Br MCULE-5774270597 [1,1,0,0,0,0|1,0,0]=3 1412 B12R1.46 CNC1=CC=C(C=C1C(=O)N)Cl MCULE-8764914723 [1,1,0,0,0,0|1,0,0]=3 1413 B12R1.46 CNC1=CC=C(C=C1C(=O)N)I MCULE-6866843192 [1,1,0,0,0,0|1,0,0]=3 1414 B12R1.46 CNC1=CC=C(C=C1C(=O)N)N MCULE-7778025942 [1,1,0,0,0,0|1,0,0]=3 1415 B12R1.46 CNC1=CC=C(C=C1C(=O)O)Br MCULE-1691569775 [1,1,0,0,0,0|2,0,0]=4 1416 B12R1.46 CNC1=CC=C(C=C1C(=O)O)C MCULE-4848176817 [1,1,0,0,0,0|2,0,0]=4 1417 B12R1.46 CNC1=CC=C(C=C1C(=O)O)I MCULE-8141389960 [1,1,0,0,0,0|2,0,0]=4 1418 B12R1.46 CNC1=CC=C(C=C1C(=O)O)N MCULE-6135898575 [1,1,0,0,0,0|2,0,0]=4 1419 B12R1.46 COC1=C(C=C(C=C1)Br)C(=O)C MCULE-8049979125 [1,1,0,0,0,0|1,0,0]=3 1420 B12R1.46 COC1=C(C=C(C=C1)Br)C(=O)Cl MCULE-7212828686 [1,1,0,0,0,0|1,0,0]=3 1421 B12R1.46 COC1=C(C=C(C=C1)Br)C(=O)N MCULE-4155621328 [1,1,0,0,0,0|0,0,0]=2 1422 B12R1.46 COC1=C(C=C(C=C1)Br)C(=O)O MCULE-8260284189 [1,1,0,0,0,0|1,0,0]=3 1423 B12R1.46 COC1=C(C=C(C=C1)Br)C(=S)N MCULE-6240134670 [1,1,0,0,0,0|0,1,0]=3 1424 B12R1.46 COC1=C(C=C(C=C1)Br)N(=O)=O MCULE-7482722317 [1,1,0,0,0,0|2,0,0]=4 1425 B12R1.46 COC1=C(C=C(C=C1)C)C(=O)C MCULE-7336091633 [1,1,0,0,0,0|1,0,0]=3 1426 B12R1.46 COC1=C(C=C(C=C1)C)C(=O)O MCULE-2816314019 [1,1,0,0,0,0|1,0,0]=3 1427 B12R1.46 COC1=C(C=C(C=C1)C)C(C)N MCULE-5144640590 [1,1,0,0,0,0|1,0,1]=4 1428 B12R1.46 COC1=C(C=C(C=C1)Cl)C(=O)C MCULE-8784491928 [1,1,0,0,0,0|1,0,0]=3 1429 B12R1.46 COC1=C(C=C(C=C1)Cl)C(=O)Cl MCULE-6998113574 [1,1,0,0,0,0|1,0,0]=3 1430 B12R1.46 COC1=C(C=C(C=C1)Cl)C(=O)N MCULE-3664074176 [1,1,0,0,0,0|0,0,0]=2 1431 B12R1.46 COC1=C(C=C(C=C1)Cl)C(=O)O MCULE-4487698118 [1,1,0,0,0,0|1,0,0]=3 1432 B12R1.46 COC1=C(C=C(C=C1)Cl)C(C)N MCULE-6158327900 [1,1,0,0,0,0|1,0,1]=4 1433 B12R1.46 COC1=C(C=C(C=C1)Cl)N(=O)=O MCULE-9096845712 [1,1,0,0,0,0|2,0,0]=4 1434 B12R1.46 COC1=C(C=C(C=C1)F)C(=O)Cl MCULE-3103477266 [1,1,0,0,0,0|1,0,0]=3 1435 B12R1.46 COC1=C(C=C(C=C1)F)C(=O)N MCULE-3361381043 [1,1,0,0,0,0|0,0,0]=2 1436 B12R1.46 COC1=C(C=C(C=C1)F)C(=O)O MCULE-9218621038 [1,1,0,0,0,0|1,0,0]=3 1437 B12R1.46 COC1=C(C=C(C=C1)F)C(C)N MCULE-8893039954 [1,1,0,0,0,0|1,0,1]=4 1438 B12R1.46 COC1=C(C=C(C=C1)F)[C@@H](C)N MCULE-8051110289 [1,1,0,0,0,0|1,0,1]=4 1439 B12R1.46 COC1=C(C=C(C=C1)F)[C@@H](C)N MCULE-9732480423 [1,1,0,0,0,0|1,0,1]=4 1440 B12R1.46 COC1=C(C=C(C=C1)I)C(=O)O MCULE-7864465132 [1,1,0,0,0,0|1,0,0]=3 1441 B12R1.46 COC1=C(C=C(C=C1)I)N(=O)=O MCULE-9411959219 [1,1,0,0,0,0|2,0,0]=4 1442 B12R1.46 COC1=C(C=C(C=C1)O)C(=O)C MCULE-6111364677 [1,1,0,0,0,0|1,0,0]=3 1443 B12R1.46 COC1=C(C=C(C=C1)O)C(=O)O MCULE-3339201501 [1,1,0,0,0,0|1,0,0]=3 1444 B12R1.46 COC1=C(C=C(C=C1)O)N(=O)=O MCULE-3573186797 [1,1,0,0,0,0|2,0,0]=4 1445 B12R1.46 COC1=C(C=C(C=N1)Br)C(=O)O MCULE-9085133579 [1,1,0,0,0,0|2,0,0]=4 1446 B12R1.46 COC1=C(C=C(C=N1)C)C(=O)O MCULE-5914666642 [1,1,0,0,0,0|2,0,0]=4 1447 B12R1.46 COC1=C(C=C(C=N1)F)C(=O)O MCULE-7377468924 [1,1,0,0,0,0|2,0,0]=4 1448 B12R1.46 COC1=C(C=C(C=N1)N)C(=O)N MCULE-9220583359 [1,1,0,0,0,0|1,0,0]=3 1449 B12R1.46 COC1=C(C=C(N=C1)Br)C(=O)O MCULE-6896935639 [1,1,0,0,0,0|2,0,0]=4 1450 B12R1.46 COC1=C(C=C(N=C1)C)C(=O)O MCULE-1562042131 [1,1,0,0,0,0|2,0,0]=4 1451 B12R1.46 COC1=C(C=C(N=C1)F)C(=O)O MCULE-9379704608 [1,1,0,0,0,0|2,0,0]=4 1452 B12R1.46 COC1=C(N=C(C=C1)C)C(=O)O MCULE-5016701848 [1,1,0,0,0,0|2,0,0]=4 1453 B12R1.46 COC1=CC=C(C=C1C(=N)N)Cl MCULE-1187900217 [1,1,0,0,0,0|1,0,0]=3 1454 B12R1.46 COC1=CC=C(C=C1C(=N)N)Cl MCULE-7582629200 [1,1,0,0,0,0|1,0,0]=3 1455 B12R1.46 COC1=CC=C(C=C1C(=O)C)F MCULE-7471611490 [1,1,0,0,0,0|1,0,0]=3 1456 B12R1.46 COC1=CC=C(C=C1C(=O)Cl)C MCULE-7883429824 [1,1,0,0,0,0|1,0,0]=3 1457 B12R1.46 COC1=CC=C(C=C1C(=O)N)N MCULE-6462713488 [1,1,0,0,0,0|0,0,0]=2 1458 B12R1.46 COC1=CC=C(C=C1C(=O)N)O MCULE-3297883463 [1,1,0,0,0,0|0,0,0]=2 1459 B12R1.46 COC1=CC=C(C=C1C(=O)O)N MCULE-1066466660 [1,1,0,0,0,0|1,0,0]=3 1460 B12R1.46 COC1=CC=C(C=C1C(=O)O)N MCULE-8685395323 [1,1,0,0,0,0|1,0,0]=3 1461 B12R1.46 COC1=CC=C(C=C1N(=O)=O)C MCULE-3486082140 [1,1,0,0,0,0|2,0,0]=4 1462 B12R1.46 COC1=CC=C(C=C1N(=O)=O)F MCULE-2479623331 [1,1,0,0,0,0|2,0,0]=4 1463 B12R1.46 COC1=CC=C(C=C1N(=O)=O)N MCULE-1021461917 [1,1,0,0,0,0|2,0,0]=4 1464 B12R1.46 COC1=CC=C(C=C1[C@@H](C)N)Br MCULE-2331151385 [1,1,0,0,0,0|1,0,1]=4 1465 B12R1.46 COC1=CC=C(C=C1[C@@H](C)N)Br MCULE-4939392350 [1,1,0,0,0,0|1,0,1]=4 1466 B12R1.46 COC1=CC=C(C=C1[C@@H](C)N)C MCULE-7017531791 [1,1,0,0,0,0|1,0,1]=4 1467 B12R1.46 COC1=CC=C(C=C1[C@@H](C)N)C MCULE-7937404285 [1,1,0,0,0,0|1,0,1]=4 1468 B12R1.46 COC1=CC=C(C=C1[C@@H](C)N)Cl MCULE-5220618630 [1,1,0,0,0,0|1,0,1]=4 1469 B12R1.46 COC1=CC=C(C=C1[C@@H](C)N)Cl MCULE-7588337049 [1,1,0,0,0,0|1,0,1]=4 1470 B12R1.46 COC1=CC=C(C=C1[C@@H](C)N)F MCULE-4532711916 [1,1,0,0,0,0|1,0,1]=4 1471 B12R1.46 COC1=CC=C(C=C1[C@@H](C)N)F MCULE-9831346135 [1,1,0,0,0,0|1,0,1]=4 1472 B12R1.46 COC1=CC=C(C=C1[C@H](C)N)Br MCULE-1418066036 [1,1,0,0,0,0|1,0,1]=4 1473 B12R1.46 COC1=CC=C(C=C1[C@H](C)N)Br MCULE-5833028646 [1,1,0,0,0,0|1,0,1]=4 1474 B12R1.46 COC1=CC=C(C=C1[C@H](C)N)C MCULE-4211577097 [1,1,0,0,0,0|1,0,1]=4 1475 B12R1.46 COC1=CC=C(C=C1[C@H](C)N)C MCULE-8942869575 [1,1,0,0,0,0|1,0,1]=4 1476 B12R1.46 COC1=CC=C(C=C1[C@H](C)N)Cl MCULE-7544922386 [1,1,0,0,0,0|1,0,1]=4 1477 B12R1.46 COC1=CC=C(C=C1[C@H](C)N)Cl MCULE-7809014779 [1,1,0,0,0,0|1,0,1]=4 1478 B12R1.46 COC1=CC=C(C=C1[C@H](C)N)F MCULE-6196136645 [1,1,0,0,0,0|1,0,1]=4 1479 B12R1.46 COC1=CC=C(C=C1[C@H](C)N)F MCULE-6487521275 [1,1,0,0,0,0|1,0,1]=4 1480 B12R1.46 COC1=CC=C(N=C1C(=O)N)Cl MCULE-6768589808 [1,1,0,0,0,0|1,0,0]=3 1481 B12R1.46 COC1=CC=C(N=C1C(=O)O)Br MCULE-4791058326 [1,1,0,0,0,0|2,0,0]=4 1482 B12R1.46 COC1=CC=C(N=C1C(=O)O)Cl MCULE-2845926342 [1,1,0,0,0,0|2,0,0]=4 1483 B12R1.46 COC1=CC=C(N=C1C(=O)O)F MCULE-4282671903 [1,1,0,0,0,0|2,0,0]=4 1484 B12R1.46 COC1=CN=C(C=C1C(=O)O)Cl MCULE-1200471638 [1,1,0,0,0,0|2,0,0]=4 1485 B12R1.46 COC1=NC=C(C=C1C(=O)C)Br MCULE-2794852756 [1,1,0,0,0,0|2,0,0]=4 1486 B12R1.46 COC1=NC=C(C=C1C(=O)C)C MCULE-3984588685 [1,1,0,0,0,0|2,0,0]=4 1487 B12R1.46 COC1=NC=C(C=C1C(=O)Cl)Br MCULE-3788800351 [1,1,0,0,0,0|2,0,0]=4 1488 B12R1.46 COC1=NC=C(C=C1C(=O)N)Br MCULE-6394196751 [1,1,0,0,0,0|1,0,0]=3 1489 B12R1.46 COC1=NC=C(C=C1C(=O)O)Cl MCULE-4928848108 [1,1,0,0,0,0|2,0,0]=4 1490 B12R1.46 COC1=NC=C(C=C1C(=O)O)I MCULE-4794551178 [1,1,0,0,0,0|2,0,0]=4 1491 B12R1.46 CSC1=C(C=C(C=C1)F)C(=O)O MCULE-5074727087 [1,1,0,0,0,0|1,1,0]=4 1492 B12R1.46 CSC1=C(C=C(C=C1)N)C(=O)O MCULE-1009101406 [1,1,0,0,0,0|1,1,0]=4 1493 B12R1.46 CSC1=CC=C(C=C1C(=O)C)C MCULE-4418182263 [1,1,0,0,0,0|1,1,0]=4 1494 B12R1.46 CSC1=CC=C(C=C1C(=O)O)Br MCULE-8848974309 [1,1,0,0,0,0|1,1,0]=4 1495 B12R1.46 CSC1=CC=C(C=C1C(=O)O)Cl MCULE-8397505747 [1,1,0,0,0,0|1,1,0]=4 1496 B12R1.57 CCC1=C(C=CC(=C1)Br)N(=O)=O MCULE-2992830015 [1,1,0,0,0,0|2,0,0]=4 1497 B12R1.57 CCC1=C(C=CC(=C1)C)C(=O)O MCULE-8594594616 [1,1,0,0,0,0|1,0,0]=3 1498 B12R1.57 CCC1=C(C=CC(=C1)F)C(=O)O MCULE-1228269240 [1,1,0,0,0,0|1,0,0]=3 1499 B12R1.57 CCC1=C(C=CC(=C1)N)C(=O)O MCULE-7524168989 [1,1,0,0,0,0|1,0,0]=3 1500 B12R1.57 CCC1=C(C=CC(=C1)O)C(=O)[O-] MCULE-2911172166 [1,1,0,0,0,0|1,0,0]=3 1501 B12R1.57 CCC1=C(C=CC(=C1)O)C(=O)[O-] MCULE-3994481972 [1,1,0,0,0,0|1,0,0]=3 1502 B12R1.57 CCC1=CC(=CC=C1C(=O)C)Cl MCULE-9469797864 [1,1,0,0,0,0|1,0,0]=3 1503 B12R1.57 CCC1=CC(=CC=C1C(=O)C)O MCULE-1094056609 [1,1,0,0,0,0|1,0,0]=3 1504 B12R1.57 CCC1=CC(=CC=C1C(=O)O)Br MCULE-4447071168 [1,1,0,0,0,0|1,0,0]=3 1505 B12R1.57 CCC1=CC(=CC=C1N(=O)=O)F MCULE-6449092802 [1,1,0,0,0,0|2,0,0]=4 1506 B12R1.57 CCC1=CC(=CC=C1N(=O)=O)O MCULE-1764496761 [1,1,0,0,0,0|2,0,0]=4 1507 B12R1.57 CCC1=NC(=CC=C1C(=O)O)O MCULE-7208282012 [1,1,0,0,0,0|2,0,0]=4 1508 B12R1.57 CNC1=C(C=CC(=C1)Br)C(=O)O MCULE-7952933630 [1,1,0,0,0,0|2,0,0]=4 1509 B12R1.57 CNC1=C(C=CC(=C1)C)C(=O)O MCULE-1628983754 [1,1,0,0,0,0|2,0,0]=4 1510 B12R1.57 CNC1=C(C=CC(=C1)Cl)C(=O)O MCULE-7088473257 [1,1,0,0,0,0|2,0,0]=4 1511 B12R1.57 CNC1=C(C=CC(=C1)F)C(=O)O MCULE-9181357615 [1,1,0,0,0,0|2,0,0]=4 1512 B12R1.57 CNC1=C(C=CC(=C1)I)C(=O)O MCULE-5657745028 [1,1,0,0,0,0|2,0,0]=4 1513 B12R1.57 CNC1=CC(=CC=C1C(=O)N)Br MCULE-3686705787 [1,1,0,0,0,0|1,0,0]=3 1514 B12R1.57 COC1=C(C=CC(=C1)Br)C(=O)C MCULE-9933310017 [1,1,0,0,0,0|1,0,0]=3 1515 B12R1.57 COC1=C(C=CC(=C1)Br)C(=O)N MCULE-7762855051 [1,1,0,0,0,0|0,0,0]=2 1516 B12R1.57 COC1=C(C=CC(=C1)Br)C(=O)O MCULE-4942529486 [1,1,0,0,0,0|1,0,0]=3 1517 B12R1.57 COC1=C(C=CC(=C1)Br)C(C)N MCULE-7345546550 [1,1,0,0,0,0|1,0,1]=4 1518 B12R1.57 COC1=C(C=CC(=C1)Br)N(=O)=O MCULE-2731622245 [1,1,0,0,0,0|2,0,0]=4 1519 B12R1.57 COC1=C(C=CC(=C1)Br)[C@@H](C)N MCULE-6305138599 [1,1,0,0,0,0|1,0,1]=4 1520 B12R1.57 COC1=C(C=CC(=C1)Br)[C@@H](C)N MCULE-9231283887 [1,1,0,0,0,0|1,0,1]=4 1521 B12R1.57 COC1=C(C=CC(=C1)Br)[C@H](C)N MCULE-1324358564 [1,1,0,0,0,0|1,0,1]=4 1522 B12R1.57 COC1=C(C=CC(=C1)Br)[C@H](C)N MCULE-2200324290 [1,1,0,0,0,0|1,0,1]=4 1523 B12R1.57 COC1=C(C=CC(=C1)C)C(=O)Cl MCULE-3799513509 [1,1,0,0,0,0|1,0,0]=3 1524 B12R1.57 COC1=C(C=CC(=C1)C)C(C)N MCULE-4999669911 [1,1,0,0,0,0|1,0,1]=4 1525 B12R1.57 COC1=C(C=CC(=C1)C)N(=O)=O MCULE-9438851205 [1,1,0,0,0,0|2,0,0]=4 1526 B12R1.57 COC1=C(C=CC(=C1)Cl)C(=O)C MCULE-7772059903 [1,1,0,0,0,0|1,0,0]=3 1527 B12R1.57 COC1=C(C=CC(=C1)Cl)C(=O)Cl MCULE-2298790175 [1,1,0,0,0,0|1,0,0]=3 1528 B12R1.57 COC1=C(C=CC(=C1)Cl)C(=O)O MCULE-3079227126 [1,1,0,0,0,0|1,0,0]=3 1529 B12R1.57 COC1=C(C=CC(=C1)Cl)C(C)N MCULE-4902495437 [1,1,0,0,0,0|1,0,1]=4 1530 B12R1.57 COC1=C(C=CC(=C1)Cl)N(=O)=O MCULE-3452568263 [1,1,0,0,0,0|2,0,0]=4 1531 B12R1.57 COC1=C(C=CC(=C1)Cl)[C@@H](C)N MCULE-4438339097 [1,1,0,0,0,0|1,0,1]=4 1532 B12R1.57 COC1=C(C=CC(=C1)Cl)[C@H](C)N MCULE-7372600923 [1,1,0,0,0,0|1,0,1]=4 1533 B12R1.57 COC1=C(C=CC(=C1)F)C(=O)Cl MCULE-5912437944 [1,1,0,0,0,0|1,0,0]=3 1534 B12R1.57 COC1=C(C=CC(=C1)F)C(=O)O MCULE-5571695055 [1,1,0,0,0,0|1,0,0]=3 1535 B12R1.57 COC1=C(C=CC(=C1)F)C(C)N MCULE-3889154194 [1,1,0,0,0,0|1,0,1]=4 1536 B12R1.57 COC1=C(C=CC(=C1)F)C(C)N MCULE-9804006906 [1,1,0,0,0,0|1,0,1]=4 1537 B12R1.57 COC1=C(C=CC(=C1)F)[C@@H](C)N MCULE-1418556409 [1,1,0,0,0,0|1,0,1]=4 1538 B12R1.57 COC1=C(C=CC(=C1)F)[C@@H](C)N MCULE-3032380284 [1,1,0,0,0,0|1,0,1]=4 1539 B12R1.57 COC1=C(C=CC(=C1)F)[C@@H](C)N MCULE-4453893910 [1,1,0,0,0,0|1,0,1]=4 1540 B12R1.57 COC1=C(C=CC(=C1)F)[C@@H](C)N MCULE-4874866031 [1,1,0,0,0,0|1,0,1]=4 1541 B12R1.57 COC1=C(C=CC(=C1)F)[C@H](C)N MCULE-4626024911 [1,1,0,0,0,0|1,0,1]=4 1542 B12R1.57 COC1=C(C=CC(=C1)F)[C@H](C)N MCULE-5493693462 [1,1,0,0,0,0|1,0,1]=4 1543 B12R1.57 COC1=C(C=CC(=C1)I)C(=O)O MCULE-4463747227 [1,1,0,0,0,0|1,0,0]=3 1544 B12R1.57 COC1=C(C=CC(=C1)N)C(=O)C MCULE-7691957580 [1,1,0,0,0,0|1,0,0]=3 1545 B12R1.57 COC1=C(C=CC(=C1)N)C(=O)N MCULE-1754802706 [1,1,0,0,0,0|0,0,0]=2 1546 B12R1.57 COC1=C(C=CC(=C1)N)C(=O)O MCULE-7151692983 [1,1,0,0,0,0|1,0,0]=3 1547 B12R1.57 COC1=C(C=CC(=C1)N)N(=O)=O MCULE-5011297685 [1,1,0,0,0,0|2,0,0]=4 1548 B12R1.57 COC1=C(C=CC(=C1)O)C(=O)C MCULE-6320722270 [1,1,0,0,0,0|1,0,0]=3 1549 B12R1.57 COC1=C(C=CC(=C1)O)C(=O)O MCULE-4756986651 [1,1,0,0,0,0|1,0,0]=3 1550 B12R1.57 COC1=C(C=CC(=C1)O)N(=O)=O MCULE-8996579428 [1,1,0,0,0,0|2,0,0]=4 1551 B12R1.57 COC1=C(C=CC(=N1)Br)C(=O)O MCULE-6186668121 [1,1,0,0,0,0|2,0,0]=4 1552 B12R1.57 COC1=C(C=CC(=N1)Cl)C(=O)C MCULE-1233158099 [1,1,0,0,0,0|2,0,0]=4 1553 B12R1.57 COC1=C(C=CC(=N1)Cl)C(=O)N MCULE-3811761831 [1,1,0,0,0,0|1,0,0]=3 1554 B12R1.57 COC1=C(C=CC(=N1)Cl)C(=O)O MCULE-1184343947 [1,1,0,0,0,0|2,0,0]=4 1555 B12R1.57 COC1=C(C=CC(=N1)N)C(=O)O MCULE-4554710198 [1,1,0,0,0,0|2,0,0]=4 1556 B12R1.57 COC1=C(C=NC(=C1)C)C(=O)O MCULE-7750323451 [1,1,0,0,0,0|2,0,0]=4 1557 B12R1.57 COC1=C(C=NC(=C1)Cl)C(=O)C MCULE-9877984052 [1,1,0,0,0,0|2,0,0]=4 1558 B12R1.57 COC1=C(N=CC(=C1)C)C(=O)O MCULE-3599113060 [1,1,0,0,0,0|2,0,0]=4 1559 B12R1.57 COC1=CC(=CC=C1C(=N)N)Br MCULE-9716542571 [1,1,0,0,0,0|1,0,0]=3 1560 B12R1.57 COC1=CC(=CC=C1C(=N)N)Br MCULE-9896711311 [1,1,0,0,0,0|1,0,0]=3 1561 B12R1.57 COC1=CC(=CC=C1C(=O)C)C MCULE-1289005170 [1,1,0,0,0,0|1,0,0]=3 1562 B12R1.57 COC1=CC(=CC=C1C(=O)C)F MCULE-8844186880 [1,1,0,0,0,0|1,0,0]=3 1563 B12R1.57 COC1=CC(=CC=C1C(=O)N)F MCULE-3204128798 [1,1,0,0,0,0|0,0,0]=2 1564 B12R1.57 COC1=CC(=CC=C1C(=O)N)O MCULE-5324983592 [1,1,0,0,0,0|0,0,0]=2 1565 B12R1.57 COC1=CC(=CC=C1C(=O)O)C MCULE-1345016694 [1,1,0,0,0,0|1,0,0]=3 1566 B12R1.57 COC1=CC(=CC=C1C(C)N)C MCULE-7892999621 [1,1,0,0,0,0|1,0,1]=4 1567 B12R1.57 COC1=CC(=CC=C1N(=O)=O)F MCULE-6213203962 [1,1,0,0,0,0|2,0,0]=4 1568 B12R1.57 COC1=CC(=CC=C1N(=O)=O)I MCULE-6303905362 [1,1,0,0,0,0|2,0,0]=4 1569 B12R1.57 COC1=CC(=CC=C1[C@@H](C)N)O MCULE-2629937100 [1,1,0,0,0,0|1,0,1]=4 1570 B12R1.57 COC1=CC(=CC=C1[C@@H](C)N)O MCULE-5206699091 [1,1,0,0,0,0|1,0,1]=4 1571 B12R1.57 COC1=CC(=CC=C1[C@H](C)N)O MCULE-1257660211 [1,1,0,0,0,0|1,0,1]=4 1572 B12R1.57 COC1=CC(=CC=C1[C@H](C)N)O MCULE-6123169706 [1,1,0,0,0,0|1,0,1]=4 1573 B12R1.57 COC1=CC(=CN=C1C(=O)C)Br MCULE-5373791517 [1,1,0,0,0,0|2,0,0]=4 1574 B12R1.57 COC1=CC(=CN=C1C(=O)C)Cl MCULE-4548716900 [1,1,0,0,0,0|2,0,0]=4 1575 B12R1.57 COC1=CC(=CN=C1C(=O)O)Br MCULE-3246292606 [1,1,0,0,0,0|2,0,0]=4 1576 B12R1.57 COC1=CC(=CN=C1C(=O)O)Cl MCULE-9219962991 [1,1,0,0,0,0|2,0,0]=4 1577 B12R1.57 COC1=CC(=CN=C1C(=O)O)F MCULE-8374611776 [1,1,0,0,0,0|2,0,0]=4 1578 B12R1.57 COC1=CC(=NC=C1C(=O)N)Cl MCULE-6838493178 [1,1,0,0,0,0|1,0,0]=3 1579 B12R1.57 COC1=CC(=NC=C1C(=O)O)Br MCULE-1416547338 [1,1,0,0,0,0|2,0,0]=4 1580 B12R1.57 COC1=CC(=NC=C1C(=O)O)Cl MCULE-5271886688 [1,1,0,0,0,0|2,0,0]=4 1581 B12R1.57 COC1=CC(=NC=C1C(=O)O)N MCULE-1735587722 [1,1,0,0,0,0|2,0,0]=4 1582 B12R1.57 COC1=CC(=O)NC=C1C(=O)O MCULE-3335065239 [1,1,0,0,0,0|2,0,0]=4 1583 B12R1.57 COC1=NC(=CC=C1C(=O)O)C MCULE-8590059507 [1,1,0,0,0,0|2,0,0]=4 1584 B12R1.57 COC1=NC(=CC=C1C(=O)O)F MCULE-8285518224 [1,1,0,0,0,0|2,0,0]=4 1585 B12R1.57 CSC1=C(C=CC(=C1)Br)C(=O)O MCULE-2632841955 [1,1,0,0,0,0|1,1,0]=4 1586 B12R1.57 CSC1=C(C=CC(=C1)C)C(=O)O MCULE-9507500200 [1,1,0,0,0,0|1,1,0]=4 1587 B12R1.57 CSC1=C(C=CC(=C1)F)C(=O)O MCULE-6323579606 [1,1,0,0,0,0|1,1,0]=4 1588 B12R1.57 O=C(O)C1=CC=C(C=C1CO)Br MCULE-9519472092 [1,1,0,0,0,0|2,0,0]=4 1589 B12R1.57 O=C(O)C1=CC=C(C=C1CO)Cl MCULE-9448085619 [1,1,0,0,0,0|2,0,0]=4 1590 B12R1.57 O=C(O)C1=CC=C(C=C1CO)F MCULE-8530587736 [1,1,0,0,0,0|2,0,0]=4 1591 B12R1.76 CCC1=C(C=CC=C1)S(=O)(=O)N MCULE-5648059864 [1,1,0,0,0,0|1,0,0]=3 1592 B12R1.76 CCC1=CC=CC=C1P(=O)(O)O MCULE-3358293883 [1,1,0,0,0,0|2,0,0]=4 1593 B12R1.76 CCC1=CC=CC=C1S(=O)(=O)Cl MCULE-5432254548 [1,1,0,0,0,0|2,0,0]=4 1594 B12R1.76 CNC1=C(C=CC=C1)S(=O)(=O)N MCULE-8429220763 [1,1,0,0,0,0|2,0,0]=4 1595 B12R1.76 COC1=C(C=CC=C1)C(C)(C)N MCULE-4146099543 [1,1,0,0,0,0|1,0,1]=4 1596 B12R1.76 COC1=C(C=CC=C1)C(C)(C)N MCULE-4359730208 [1,1,0,0,0,0|1,0,1]=4 1597 B12R1.76 COC1=C(C=CC=C1)S(=N)(=O)C MCULE-4984934710 [1,1,0,0,0,0|1,0,1]=4 1598 B12R1.76 COC1=C(C=CC=C1)S(=O)(=O)C MCULE-6263612111 [1,1,0,0,0,0|2,0,0]=4 1599 B12R1.76 COC1=C(C=CC=C1)S(=O)(=O)Cl MCULE-9692065314 [1,1,0,0,0,0|2,0,0]=4 1600 B12R1.76 COC1=C(C=CC=C1)S(=O)(=O)F MCULE-7153287061 [1,1,0,0,0,0|2,0,0]=4 1601 B12R1.76 COC1=C(C=CC=C1)S(=O)(=O)N MCULE-4239739719 [1,1,0,0,0,0|1,0,0]=3 1602 B12R1.76 COC1=C(C=CC=N1)S(=O)(=O)N MCULE-3370041122 [1,1,0,0,0,0|2,0,0]=4 1603 B12R1.76 COC1=C(C=NC=C1)S(=O)(=O)N MCULE-7710860954 [1,1,0,0,0,0|2,0,0]=4 1604 B12R1.76 COC1=C(N=CC=C1)S(=O)(=O)N MCULE-3440359631 [1,1,0,0,0,0|2,0,0]=4 1605 B12R1.76 COC1=CC=CC=C1S(=O)(=O)O MCULE-6564286882 [1,1,0,0,0,0|2,0,0]=4 1606 B12R1.76 NCC1=C(C=CC=C1)S(=O)(=O)N MCULE-5202412304 [1,1,0,0,0,0|2,0,0]=4 1607 B12R1.76 NCC1=C(C=CC=C1)S(=O)(=O)N MCULE-5872471099 [1,1,0,0,0,0|2,0,0]=4 1608 B12R1.76 NS(=O)(=O)C1=C(C=CC=C1)CCl MCULE-5847985683 [1,1,0,0,0,0|2,0,0]=4 1609 B12R1.76 NS(=O)(=O)C1=C(C=CC=C1)CO MCULE-3024713115 [1,1,0,0,0,0|2,0,0]=4 1610 B12R1.76 NS(=O)(=O)C1=CC=CC=C1CBr MCULE-9252522034 [1,1,0,0,0,0|2,0,0]=4 1611 B12R1.87 CC1=C(C(=CC=C1)C(=O)O)CBr MCULE-5300346605 [1,1,0,0,0,0|2,0,0]=4 1612 B12R1.87 CCC1=C(C=CC=C1C(=O)O)Br MCULE-4905286426 [1,1,0,0,0,0|1,0,0]=3 1613 B12R1.87 CCC1=C(C=CC=C1C(=O)O)Cl MCULE-7899621507 [1,1,0,0,0,0|1,0,0]=3 1614 B12R1.87 CCC1=C(C=CC=C1O)C(=O)O MCULE-8529143358 [1,1,0,0,0,0|1,0,0]=3 1615 B12R1.87 CCC1=C(C=NC=C1C(=O)O)Br MCULE-9339469477 [1,1,0,0,0,0|2,0,0]=4 1616 B12R1.87 CCC1=C(C=NC=C1C(=O)O)F MCULE-2795228084 [1,1,0,0,0,0|2,0,0]=4 1617 B12R1.87 CCN1C(=O)C=CC=C1C(=O)O MCULE-4893647462 [1,1,0,0,0,0|2,0,0]=4 1618 B12R1.87 CNC1=C(C=CC=C1C(=O)O)Br MCULE-4203386943 [1,1,0,0,0,0|2,0,0]=4 1619 B12R1.87 CNC1=C(C=CC=C1C(=O)O)C MCULE-8265374012 [1,1,0,0,0,0|2,0,0]=4 1620 B12R1.87 CNC1=C(C=CC=C1C(=O)O)N MCULE-2159403848 [1,1,0,0,0,0|2,0,0]=4 1621 B12R1.87 CNC1=C(C=CC=C1C(=O)O)N MCULE-7464919793 [1,1,0,0,0,0|2,0,0]=4 1622 B12R1.87 CNC1=C(C=CC=C1Cl)C(=O)O MCULE-3281914717 [1,1,0,0,0,0|2,0,0]=4 1623 B12R1.87 CNC1=C(C=CC=C1F)C(=O)N MCULE-2057972691 [1,1,0,0,0,0|1,0,0]=3 1624 B12R1.87 CNC1=C(C=CC=C1F)C(=O)O MCULE-8418561174 [1,1,0,0,0,0|2,0,0]=4 1625 B12R1.87 COC1=C(C=CC=C1Br)C(=O)C MCULE-5949236047 [1,1,0,0,0,0|1,0,0]=3 1626 B12R1.87 COC1=C(C=CC=C1Br)C(=O)O MCULE-6468167377 [1,1,0,0,0,0|1,0,0]=3 1627 B12R1.87 COC1=C(C=CC=C1Br)N(=O)=O MCULE-4424314409 [1,1,0,0,0,0|2,0,0]=4 1628 B12R1.87 COC1=C(C=CC=C1C(=O)C)C MCULE-2275590155 [1,1,0,0,0,0|1,0,0]=3 1629 B12R1.87 COC1=C(C=CC=C1C(=O)N)Br MCULE-9131519756 [1,1,0,0,0,0|0,0,0]=2 1630 B12R1.87 COC1=C(C=CC=C1C(=O)N)F MCULE-3562306900 [1,1,0,0,0,0|0,0,0]=2 1631 B12R1.87 COC1=C(C=CC=C1C(=O)O)N MCULE-9794965261 [1,1,0,0,0,0|1,0,0]=3 1632 B12R1.87 COC1=C(C=CC=C1C(C)N)Br MCULE-3479827704 [1,1,0,0,0,0|1,0,1]=4 1633 B12R1.87 COC1=C(C=CC=C1C(C)N)Br MCULE-9227948699 [1,1,0,0,0,0|1,0,1]=4 1634 B12R1.87 COC1=C(C=CC=C1C(C)N)F MCULE-6831724049 [1,1,0,0,0,0|1,0,1]=4 1635 B12R1.87 COC1=C(C=CC=C1C(C)N)F MCULE-8928639320 [1,1,0,0,0,0|1,0,1]=4 1636 B12R1.87 COC1=C(C=CC=C1C)C(=O)Cl MCULE-7252137088 [1,1,0,0,0,0|1,0,0]=3 1637 B12R1.87 COC1=C(C=CC=C1C)C(=O)O MCULE-4091475320 [1,1,0,0,0,0|1,0,0]=3 1638 B12R1.87 COC1=C(C=CC=C1C)N(=O)=O MCULE-6978289551 [1,1,0,0,0,0|2,0,0]=4 1639 B12R1.87 COC1=C(C=CC=C1Cl)C(=O)C MCULE-7120038361 [1,1,0,0,0,0|1,0,0]=3 1640 B12R1.87 COC1=C(C=CC=C1Cl)C(=O)O MCULE-1171155760 [1,1,0,0,0,0|1,0,0]=3 1641 B12R1.87 COC1=C(C=CC=C1Cl)N(=O)=O MCULE-1214524725 [1,1,0,0,0,0|2,0,0]=4 1642 B12R1.87 COC1=C(C=CC=C1F)C(=O)C MCULE-5075196334 [1,1,0,0,0,0|1,0,0]=3 1643 B12R1.87 COC1=C(C=CC=C1F)C(=O)Cl MCULE-3504299466 [1,1,0,0,0,0|1,0,0]=3 1644 B12R1.87 COC1=C(C=CC=C1F)C(=O)O MCULE-9813126067 [1,1,0,0,0,0|1,0,0]=3 1645 B12R1.87 COC1=C(C=CC=C1I)C(=O)O MCULE-4779777680 [1,1,0,0,0,0|1,0,0]=3 1646 B12R1.87 COC1=C(C=CC=C1N(=O)=O)F MCULE-3574486485 [1,1,0,0,0,0|2,0,0]=4 1647 B12R1.87 COC1=C(C=CC=C1N)C(=O)N MCULE-7732791377 [1,1,0,0,0,0|0,0,0]=2 1648 B12R1.87 COC1=C(C=CC=C1N)N(=O)=O MCULE-3037066855 [1,1,0,0,0,0|2,0,0]=4 1649 B12R1.87 COC1=C(C=CC=C1N)N(=O)=O MCULE-8375417562 [1,1,0,0,0,0|2,0,0]=4 1650 B12R1.87 COC1=C(C=CC=C1O)C(=O)C MCULE-7157570640 [1,1,0,0,0,0|1,0,0]=3 1651 B12R1.87 COC1=C(C=CC=C1O)C(=O)O MCULE-1033656397 [1,1,0,0,0,0|1,0,0]=3 1652 B12R1.87 COC1=C(C=CC=C1O)N(=O)=O MCULE-8012537540 [1,1,0,0,0,0|2,0,0]=4 1653 B12R1.87 COC1=C(C=CC=C1[C@@H](C)N)F MCULE-1273042890 [1,1,0,0,0,0|1,0,1]=4 1654 B12R1.87 COC1=C(C=CC=C1[C@@H](C)N)F MCULE-4792554974 [1,1,0,0,0,0|1,0,1]=4 1655 B12R1.87 COC1=C(C=CC=C1[C@H](C)N)Br MCULE-4672960239 [1,1,0,0,0,0|1,0,1]=4 1656 B12R1.87 COC1=C(C=CC=C1[C@H](C)N)F MCULE-1074369509 [1,1,0,0,0,0|1,0,1]=4 1657 B12R1.87 COC1=C(C=CC=C1[C@H](C)N)F MCULE-7639562151 [1,1,0,0,0,0|1,0,1]=4 1658 B12R1.87 COC1=C(C=CN=C1Br)C(=O)O MCULE-3257265846 [1,1,0,0,0,0|2,0,0]=4 1659 B12R1.87 COC1=C(C=CN=C1C(=O)O)Cl MCULE-1657664191 [1,1,0,0,0,0|2,0,0]=4 1660 B12R1.87 COC1=C(C=CN=C1F)C(=O)O MCULE-3694424164 [1,1,0,0,0,0|2,0,0]=4 1661 B12R1.87 COC1=C(C=CNC1=O)C(=O)O MCULE-3656853005 [1,1,0,0,0,0|2,0,0]=4 1662 B12R1.87 COC1=C(N=CC=C1C(=O)N)Cl MCULE-1496382980 [1,1,0,0,0,0|1,0,0]=3 1663 B12R1.87 COC1=C(N=CC=C1C(=O)O)Cl MCULE-8439449207 [1,1,0,0,0,0|2,0,0]=4 1664 B12R1.87 COC1=C(OC=CC1=O)C(=O)O MCULE-8207001041 [1,1,0,0,0,0|2,0,0]=4 1665 B12R1.87 CSC1=C(C=CC=C1C(=O)O)Br MCULE-7696810311 [1,1,0,0,0,0|1,1,0]=4 1666 B12R1.87 CSC1=C(C=CC=C1Cl)C(=O)O MCULE-6498533549 [1,1,0,0,0,0|1,1,0]=4 1667 B12R1.87 CSC1=C(C=CC=C1F)C(=O)O MCULE-2082963633 [1,1,0,0,0,0|1,1,0]=4 1668 B12R1.87 O=C(O)C1=C(C(=CC=C1)Br)CBr MCULE-3909720974 [1,1,0,0,0,0|2,0,0]=4 1669 B12R1.261 CC(=O)C1=C(C=CC=C1)C(=O)C MCULE-8127457015 [1,1,0,0,0,0|1,0,1]=4 1670 B12R1.261 CC(=O)C1=C(C=CC=C1)C(C)C MCULE-8529446162 [1,1,0,0,0,0|1,0,0]=3 1671 B12R1.261 CC(=O)C1=C(C=CC=C1)N(C)C MCULE-1644745832 [1,1,0,0,0,0|2,0,0]=4 1672 B12R1.261 CC(=O)C1=C(C=CN=C1)C(C)C MCULE-9673065292 [1,1,0,0,0,0|2,0,0]=4 1673 B12R1.261 CC(=O)C1=CC=CC=C1C(=O)Cl MCULE-1765251115 [1,1,0,0,0,0|1,0,1]=4 1674 B12R1.261 CC(=O)C1=CC=CC=C1C(=O)O MCULE-7363003448 [1,1,0,0,0,0|1,0,1]=4 1675 B12R1.261 CC(=O)C1=CC=CC=C1C(F)F MCULE-8753213691 [1,1,0,0,0,0|2,0,0]=4 1676 B12R1.261 CC(Br)C1=C(C=CC=C1)N(=O)=O MCULE-8158520435 [1,1,0,0,0,0|2,0,0]=4 1677 B12R1.261 CC(C)C1=C(C=CC=C1)C(=O)O MCULE-6483894536 [1,1,0,0,0,0|1,0,0]=3 1678 B12R1.261 CC(C)C1=CC=CC=C1N(=O)=O MCULE-4429412336 [1,1,0,0,0,0|2,0,0]=4 1679 B12R1.261 CC(C)C1=CC=CC=C1[C@@H](C)N MCULE-4111876146 [1,1,0,0,0,0|1,0,1]=4 1680 B12R1.261 CC(C)C1=CC=CC=C1[C@@H](C)N MCULE-7068834872 [1,1,0,0,0,0|1,0,1]=4 1681 B12R1.261 CC(C)C1=CC=CC=C1[C@H](C)N MCULE-3844182797 [1,1,0,0,0,0|1,0,1]=4 1682 B12R1.261 CC(C)C1=CC=CC=C1[C@H](C)N MCULE-5770376527 [1,1,0,0,0,0|1,0,1]=4 1683 B12R1.261 CC(N)C1=C(C=CC=C1)N(=O)=O MCULE-2237741839 [1,1,0,0,0,0|2,0,0]=4 1684 B12R1.261 CC(N)C1=C(C=CC=C1)N(=O)=O MCULE-7282586986 [1,1,0,0,0,0|2,0,0]=4 1685 B12R1.261 CC(N)C1=C(C=CC=C1)N(=O)=O MCULE-8806309464 [1,1,0,0,0,0|2,0,0]=4 1686 B12R1.261 CC(N)C1=C(C=CC=C1)N(=O)=O MCULE-9270675402 [1,1,0,0,0,0|2,0,0]=4 1687 B12R1.261 CC(N)C1=CC=CC=C1C(=O)O MCULE-8650746123 [1,1,0,0,0,0|1,0,0]=3 1688 B12R1.261 CC(N)C1=CC=CC=C1C(=O)O MCULE-9609008723 [1,1,0,0,0,0|1,0,0]=3 1689 B12R1.261 CC(O)C1=C(C=CC=C1)C(=O)O MCULE-1846110939 [1,1,0,0,0,0|1,0,0]=3 1690 B12R1.261 CC(O)C1=C(C=CC=C1)C(=O)[O-] MCULE-3438709652 [1,1,0,0,0,0|1,0,0]=3 1691 B12R1.261 CC(O)C1=C(C=CC=C1)N(=O)=O MCULE-8851254927 [1,1,0,0,0,0|2,0,0]=4 1692 B12R1.261 CN(C)C1=C(C=CC=C1)C(=O)N MCULE-7432093352 [1,1,0,0,0,0|1,0,0]=3 1693 B12R1.261 CN(C)C1=C(C=CC=C1)C(=O)O MCULE-4355771481 [1,1,0,0,0,0|2,0,0]=4 1694 B12R1.261 CN(C)C1=C(C=CC=C1)C(=O)O MCULE-5122962105 [1,1,0,0,0,0|2,0,0]=4 1695 B12R1.261 CN(C)C1=CC=CC=C1C(=N)N MCULE-1996203773 [1,1,0,0,0,0|2,0,0]=4 1696 B12R1.261 CN(C)C1=CC=CC=C1C(=N)N MCULE-5063107454 [1,1,0,0,0,0|2,0,0]=4 1697 B12R1.261 CS(=O)C1=C(C=CC=C1)C(=O)O MCULE-3173889444 [1,1,0,0,0,0|1,1,0]=4 1698 B12R1.261 C[C@@H](N)C1=C(C=CC=C1)[N+](=O)[O-] MCULE-7674618423 [1,1,0,0,0,0|2,0,0]=4 1699 B12R1.261 C[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-6849862508 [1,1,0,0,0,0|1,0,0]=3 1700 B12R1.261 C[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-9842865976 [1,1,0,0,0,0|1,0,0]=3 1701 B12R1.261 C[C@@H](N)C1=CC=CC=C1[N+](=O)[O-] MCULE-3833287505 [1,1,0,0,0,0|2,0,0]=4 1702 B12R1.261 C[C@@H](N)C1=CC=CC=C1[N+](=O)[O-] MCULE-4322968779 [1,1,0,0,0,0|2,0,0]=4 1703 B12R1.261 C[C@@H](N)C1=CC=CC=C1[N+](=O)[O-] MCULE-7586456481 [1,1,0,0,0,0|2,0,0]=4 1704 B12R1.261 C[C@@H](O)C1=C(C=CC=C1)[N+](=O)[O-] MCULE-9278710855 [1,1,0,0,0,0|2,0,0]=4 1705 B12R1.261 C[C@H](N)C1=C(C=CC=C1)[N+](=O)[O-] MCULE-3100033909 [1,1,0,0,0,0|2,0,0]=4 1706 B12R1.261 C[C@H](N)C1=C(C=CC=C1)[N+](=O)[O-] MCULE-8662462718 [1,1,0,0,0,0|2,0,0]=4 1707 B12R1.261 C[C@H](N)C1=CC=CC=C1C(=O)O MCULE-1164292262 [1,1,0,0,0,0|1,0,0]=3 1708 B12R1.261 C[C@H](N)C1=CC=CC=C1C(=O)O MCULE-7958697940 [1,1,0,0,0,0|1,0,0]=3 1709 B12R1.261 C[C@H](N)C1=CC=CC=C1[N+](=O)[O-] MCULE-3260225616 [1,1,0,0,0,0|2,0,0]=4 1710 B12R1.261 C[C@H](N)C1=CC=CC=C1[N+](=O)[O-] MCULE-3646504595 [1,1,0,0,0,0|2,0,0]=4 1711 B12R1.261 C[C@H](O)C1=C(C=CC=C1)[N+](=O)[O-] MCULE-4050015215 [1,1,0,0,0,0|2,0,0]=4 1712 B12R1.261 NC(=O)C1=C(C=CC=C1)C(=O)N MCULE-9121420422 [1,1,0,0,0,0|1,0,1]=4 1713 B12R1.261 NC(=O)C1=C(C=CC=C1)N(=O)=O MCULE-3155069269 [1,1,0,0,0,0|2,0,0]=4 1714 B12R1.261 NC(=O)C1=C(N=CC=C1)C(F)F MCULE-9676139411 [1,1,0,0,0,0|2,0,0]=4 1715 B12R1.261 NC(=O)C1=CC=CC=C1B(O)O MCULE-7189761074 [1,1,0,0,0,0|2,0,0]=4 1716 B12R1.261 NC(=O)C1=CC=CC=C1C(=O)O MCULE-4970133228 [1,1,0,0,0,0|1,0,1]=4 1717 B12R1.261 O=C(O)C1=CC=CC=C1C(F)F MCULE-2495932834 [1,1,0,0,0,0|2,0,0]=4 1718 B12R1.437 CCC1=C(C(=CC=C1)C)C(=O)O MCULE-1329555576 [1,1,0,0,0,0|1,0,0]=3 1719 B12R1.437 CCC1=C(C(=CC=C1)N)C(=O)N MCULE-3693618780 [1,1,0,0,0,0|0,0,0]=2 1720 B12R1.437 CCC1=C(C(=CC=C1)N)C(=O)O MCULE-3613770439 [1,1,0,0,0,0|1,0,0]=3 1721 B12R1.437 CCC1=C(C(=CC=C1)N)N(=O)=O MCULE-7668878856 [1,1,0,0,0,0|2,0,0]=4 1722 B12R1.437 CCC1=CC=CC(=C1C(=O)N)C MCULE-8568136182 [1,1,0,0,0,0|0,0,0]=2 1723 B12R1.437 CCC1=CC=CC(=C1C(=O)O)O MCULE-8680471350 [1,1,0,0,0,0|1,0,0]=3 1724 B12R1.437 CNC1=C(C(=CC=C1)Br)C(=O)O MCULE-8314389028 [1,1,0,0,0,0|2,0,0]=4 1725 B12R1.437 CNC1=C(C(=CC=C1)C)C(=O)O MCULE-8302778786 [1,1,0,0,0,0|2,0,0]=4 1726 B12R1.437 CNC1=C(C(=CC=C1)Cl)C(=O)O MCULE-8330394386 [1,1,0,0,0,0|2,0,0]=4 1727 B12R1.437 CNC1=C(C(=CC=C1)I)C(=O)O MCULE-2807166920 [1,1,0,0,0,0|2,0,0]=4 1728 B12R1.437 CNC1=CC=CC(=C1C(=O)O)F MCULE-4948407285 [1,1,0,0,0,0|2,0,0]=4 1729 B12R1.437 COC1=C(C(=CC=C1)Br)C(=O)C MCULE-5747065932 [1,1,0,0,0,0|1,0,0]=3 1730 B12R1.437 COC1=C(C(=CC=C1)Br)C(=O)Cl MCULE-4064195076 [1,1,0,0,0,0|1,0,0]=3 1731 B12R1.437 COC1=C(C(=CC=C1)Br)C(=O)N MCULE-2803020658 [1,1,0,0,0,0|0,0,0]=2 1732 B12R1.437 COC1=C(C(=CC=C1)Br)C(=O)O MCULE-7048674637 [1,1,0,0,0,0|1,0,0]=3 1733 B12R1.437 COC1=C(C(=CC=C1)Br)C(C)N MCULE-2807809939 [1,1,0,0,0,0|1,0,1]=4 1734 B12R1.437 COC1=C(C(=CC=C1)Br)C(C)N MCULE-7449410636 [1,1,0,0,0,0|1,0,1]=4 1735 B12R1.437 COC1=C(C(=CC=C1)Br)N(=O)=O MCULE-7967858547 [1,1,0,0,0,0|2,0,0]=4 1736 B12R1.437 COC1=C(C(=CC=C1)C)C(=O)O MCULE-5137124682 [1,1,0,0,0,0|1,0,0]=3 1737 B12R1.437 COC1=C(C(=CC=C1)C)N(=O)=O MCULE-8260486332 [1,1,0,0,0,0|2,0,0]=4 1738 B12R1.437 COC1=C(C(=CC=C1)Cl)C(=O)C MCULE-5741434078 [1,1,0,0,0,0|1,0,0]=3 1739 B12R1.437 COC1=C(C(=CC=C1)Cl)C(=O)N MCULE-8927802643 [1,1,0,0,0,0|0,0,0]=2 1740 B12R1.437 COC1=C(C(=CC=C1)Cl)C(=O)O MCULE-1164310721 [1,1,0,0,0,0|1,0,0]=3 1741 B12R1.437 COC1=C(C(=CC=C1)Cl)C(C)N MCULE-1815428328 [1,1,0,0,0,0|1,0,1]=4 1742 B12R1.437 COC1=C(C(=CC=C1)Cl)C(C)N MCULE-6680138994 [1,1,0,0,0,0|1,0,1]=4 1743 B12R1.437 COC1=C(C(=CC=C1)F)C(=N)N MCULE-7098533636 [1,1,0,0,0,0|1,0,0]=3 1744 B12R1.437 COC1=C(C(=CC=C1)F)C(=N)N MCULE-8599388332 [1,1,0,0,0,0|1,0,0]=3 1745 B12R1.437 COC1=C(C(=CC=C1)F)C(=O)C MCULE-1114632525 [1,1,0,0,0,0|1,0,0]=3 1746 B12R1.437 COC1=C(C(=CC=C1)F)C(=O)O MCULE-7575106111 [1,1,0,0,0,0|1,0,0]=3 1747 B12R1.437 COC1=C(C(=CC=C1)F)C(=S)N MCULE-2126365909 [1,1,0,0,0,0|0,1,0]=3 1748 B12R1.437 COC1=C(C(=CC=C1)F)C(C)N MCULE-2109979865 [1,1,0,0,0,0|1,0,1]=4 1749 B12R1.437 COC1=C(C(=CC=C1)F)C(C)N MCULE-8779400557 [1,1,0,0,0,0|1,0,1]=4 1750 B12R1.437 COC1=C(C(=CC=C1)F)N(=O)=O MCULE-8249569212 [1,1,0,0,0,0|2,0,0]=4 1751 B12R1.437 COC1=C(C(=CC=C1)F)[C@@H](C)N MCULE-2319652192 [1,1,0,0,0,0|1,0,1]=4 1752 B12R1.437 COC1=C(C(=CC=C1)F)[C@@H](C)N MCULE-4790334843 [1,1,0,0,0,0|1,0,1]=4 1753 B12R1.437 COC1=C(C(=CC=C1)F)[C@@H](C)N MCULE-6996884847 [1,1,0,0,0,0|1,0,1]=4 1754 B12R1.437 COC1=C(C(=CC=C1)F)[C@@H](C)N MCULE-8940746923 [1,1,0,0,0,0|1,0,1]=4 1755 B12R1.437 COC1=C(C(=CC=C1)F)[C@H](C)N MCULE-1063321348 [1,1,0,0,0,0|1,0,1]=4 1756 B12R1.437 COC1=C(C(=CC=C1)F)[C@H](C)N MCULE-1493423633 [1,1,0,0,0,0|1,0,1]=4 1757 B12R1.437 COC1=C(C(=CC=C1)F)[C@H](C)N MCULE-2006477737 [1,1,0,0,0,0|1,0,1]=4 1758 B12R1.437 COC1=C(C(=CC=C1)F)[C@H](C)N MCULE-4401070837 [1,1,0,0,0,0|1,0,1]=4 1759 B12R1.437 COC1=C(C(=CC=C1)I)C(=O)O MCULE-1638097104 [1,1,0,0,0,0|1,0,0]=3 1760 B12R1.437 COC1=C(C(=CC=C1)I)N(=O)=O MCULE-3721195080 [1,1,0,0,0,0|2,0,0]=4 1761 B12R1.437 COC1=C(C(=CC=C1)N)C(=O)C MCULE-5727750287 [1,1,0,0,0,0|1,0,0]=3 1762 B12R1.437 COC1=C(C(=CC=C1)N)C(=O)C MCULE-9025776825 [1,1,0,0,0,0|1,0,0]=3 1763 B12R1.437 COC1=C(C(=CC=C1)N)C(=O)N MCULE-6292075605 [1,1,0,0,0,0|0,0,0]=2 1764 B12R1.437 COC1=C(C(=CC=C1)O)C(=O)C MCULE-9445734833 [1,1,0,0,0,0|1,0,0]=3 1765 B12R1.437 COC1=C(C(=CC=C1)O)N(=O)=O MCULE-2775908650 [1,1,0,0,0,0|2,0,0]=4 1766 B12R1.437 COC1=C(C(=CC=C1)O)[C@@H](C)N MCULE-6717885300 [1,1,0,0,0,0|1,0,1]=4 1767 B12R1.437 COC1=C(C(=CC=C1)O)[C@@H](C)N MCULE-8702905747 [1,1,0,0,0,0|1,0,1]=4 1768 B12R1.437 COC1=C(C(=CC=C1)O)[C@H](C)N MCULE-1311362471 [1,1,0,0,0,0|1,0,1]=4 1769 B12R1.437 COC1=C(C(=CC=N1)Br)C(=O)O MCULE-4365016463 [1,1,0,0,0,0|2,0,0]=4 1770 B12R1.437 COC1=C(C(=CC=N1)C)C(=O)O MCULE-6488562033 [1,1,0,0,0,0|2,0,0]=4 1771 B12R1.437 COC1=C(C(=CC=N1)Cl)C(=O)O MCULE-8094169793 [1,1,0,0,0,0|2,0,0]=4 1772 B12R1.437 COC1=C(C(=CC=N1)F)C(=O)O MCULE-6591673217 [1,1,0,0,0,0|2,0,0]=4 1773 B12R1.437 COC1=C(C(=CC=N1)I)C(=O)O MCULE-8369942991 [1,1,0,0,0,0|2,0,0]=4 1774 B12R1.437 COC1=C(C(=CC=N1)N)C(=O)O MCULE-4877760468 [1,1,0,0,0,0|2,0,0]=4 1775 B12R1.437 COC1=C(C(=CC=N1)N)C(=O)O MCULE-9298192212 [1,1,0,0,0,0|2,0,0]=4 1776 B12R1.437 COC1=C(C(=CN=C1)Cl)C(=O)O MCULE-8658893610 [1,1,0,0,0,0|2,0,0]=4 1777 B12R1.437 COC1=C(C(=CN=C1)N)C(=O)O MCULE-7255030862 [1,1,0,0,0,0|2,0,0]=4 1778 B12R1.437 COC1=C(C(=NC=C1)Cl)C(=O)Cl MCULE-8645573552 [1,1,0,0,0,0|2,0,0]=4 1779 B12R1.437 COC1=C(C(=NC=C1)Cl)C(=O)O MCULE-5752857646 [1,1,0,0,0,0|2,0,0]=4 1780 B12R1.437 COC1=C(C(=NC=C1)F)C(=O)O MCULE-5862179261 [1,1,0,0,0,0|2,0,0]=4 1781 B12R1.437 COC1=C(C(=O)C=CN1)C(=O)C MCULE-7389945359 [1,1,0,0,0,0|2,0,0]=4 1782 B12R1.437 COC1=C(C(=O)NC=C1)C(=O)C MCULE-9263838419 [1,1,0,0,0,0|2,0,0]=4 1783 B12R1.437 COC1=C(C(=O)NC=C1)C(=O)O MCULE-2836700358 [1,1,0,0,0,0|2,0,0]=4 1784 B12R1.437 COC1=CC=CC(=C1C(=O)C)C MCULE-2162754257 [1,1,0,0,0,0|1,0,0]=3 1785 B12R1.437 COC1=CC=CC(=C1C(=O)Cl)F MCULE-4835916316 [1,1,0,0,0,0|1,0,0]=3 1786 B12R1.437 COC1=CC=CC(=C1C(=O)N)C MCULE-3605327750 [1,1,0,0,0,0|0,0,0]=2 1787 B12R1.437 COC1=CC=CC(=C1C(=O)N)F MCULE-2798422443 [1,1,0,0,0,0|0,0,0]=2 1788 B12R1.437 COC1=CC=CC(=C1C(=O)O)N MCULE-2153474902 [1,1,0,0,0,0|1,0,0]=3 1789 B12R1.437 COC1=CC=CC(=C1C(=O)O)O MCULE-1612767952 [1,1,0,0,0,0|1,0,0]=3 1790 B12R1.437 COC1=CC=CC(=C1N(=O)=O)Cl MCULE-6854117545 [1,1,0,0,0,0|2,0,0]=4 1791 B12R1.437 COC1=CC=CC(=C1N(=O)=O)N MCULE-6774399614 [1,1,0,0,0,0|2,0,0]=4 1792 B12R1.437 COC1=CC=CC(=C1[C@@H](C)N)Br MCULE-9331756353 [1,1,0,0,0,0|1,0,1]=4 1793 B12R1.437 COC1=CC=CC(=C1[C@H](C)N)Br MCULE-9210237297 [1,1,0,0,0,0|1,0,1]=4 1794 B12R1.437 COC1=CC=CC(=C1[C@H](C)N)O MCULE-3211284319 [1,1,0,0,0,0|1,0,1]=4 1795 B12R1.437 COC1=CC=NC(=C1C(=O)O)N MCULE-3002810046 [1,1,0,0,0,0|2,0,0]=4 1796 B12R1.437 CSC1=C(C(=CC=C1)Br)C(=O)O MCULE-8769429552 [1,1,0,0,0,0|1,1,0]=4 1797 B12R1.437 CSC1=C(C(=CC=C1)F)C(=O)O MCULE-6317398539 [1,1,0,0,0,0|1,1,0]=4 1798 B12R1.437 CSC1=C(C(=CC=C1)F)C(=S)N MCULE-7448351681 [1,1,0,0,0,0|0,2,0]=4 1799 B12R1.437 NC1=C(C(=CC=C1)CBr)C(=O)O MCULE-4360616014 [1,1,0,0,0,0|2,0,0]=4 1800 B12R1.276 CCOC1=C(SC(=C1)Cl)C(=O)O MCULE-9496904198 [0,1,0,0,1,0|2,0,0]=4 1801 B12R1.291 CCOC1=C(SC=C1)C(=O)NN MCULE-5061377168 [0,1,0,0,1,0|1,0,0]=3 1802 B12R1.291 CCOC1=C(SC=C1)C(=O)OC MCULE-9411886147 [0,1,0,0,1,0|2,0,0]=4 1803 B14R1.262 CCOC1=CC=CC=C1NS(=O)(=O)C MCULE-3503281984 [0,1,0,0,0,1|2,0,0]=4 1804 B14R1.438 CCOC1=C(C=CC(=C1)N)NC(=O)C MCULE-7659075262 [0,1,0,0,0,1|1,0,0]=3 1805 B14R1.481 CCOC1=C(C=CC=C1)C(=O)C(=O)O MCULE-5207124496 [0,1,0,0,0,1|1,0,0]=3 1806 B14R1.483 C=CC(=O)NC1=CC=CC=C1OCC MCULE-9876475747 [0,1,0,0,0,1|1,0,0]=3 1807 B14R1.483 CCOC1=C(C=CC=C1)NC(=O)CN MCULE-8072701973 [0,1,0,0,0,1|0,0,0]=2 1808 B14R1.483 CCOC1=C(C=CC=C1)NC(=O)CN MCULE-8267109360 [0,1,0,0,0,1|0,0,0]=2 1809 B14R1.483 CCOC1=C(C=CC=C1)NC(=O)CS MCULE-5867546198 [0,1,0,0,0,1|1,0,0]=3 1810 B14R1.483 CCOC1=C(C=CC=C1)NC(=S)NC MCULE-9617852656 [0,1,0,0,0,1|0,1,0]=3 1811 B14R1.483 CCOC1=C(C=CC=C1)NC(=S)NN MCULE-2134060939 [0,1,0,0,0,1|0,1,0]=3 1812 B14R1.483 CCOC1=CC=CC=C1NC(=O)CBr MCULE-4010775323 [0,1,0,0,0,1|1,0,0]=3 1813 B14R1.483 CCOC1=CC=CC=C1NC(=O)CC MCULE-4469610760 [0,1,0,0,0,1|1,0,0]=3 1814 B14R1.483 CCOC1=CC=CC=C1NC(=O)CCl MCULE-6891372771 [0,1,0,0,0,1|1,0,0]=3 1815 B14R1.744 CCC(=O)C1=CC=CC=C1OC(=O)C MCULE-6432512214 [0,1,0,0,0,1|2,0,0]=4 1816 B14R1.786 C=CCOC1=CC=CC=C1CC(=O)O MCULE-7166880416 [0,1,0,0,0,1|1,0,1]=4 1817 B14R1.786 C=CCOC1=CC=CC=C1NC(=O)C MCULE-6968346458 [0,1,0,0,0,1|1,0,1]=4 1818 B14R1.786 CC(=O)NC1=C(C=CC=C1)OCCBr MCULE-2821626089 [0,1,0,0,0,1|1,0,0]=3 1819 B14R1.786 CCCCC1=CC=CC=C1NC(=S)N MCULE-2974442789 [0,1,0,0,0,1|1,1,0]=4 1820 B14R1.786 CCCOC1=C(C=CC=C1)NC(=S)N MCULE-5539799508 [0,1,0,0,0,1|0,1,0]=3 1821 B14R1.814 CC(=O)NC1=CC=CC=C1OC(=O)C MCULE-6109053973 [0,1,0,0,0,1|1,0,1]=4 1822 B14R1.814 CC(=O)NC1=CC=CC=C1OC(F)F MCULE-7525361597 [0,1,0,0,0,1|2,0,0]=4 1823 B14R1.814 CC(=O)OC1=CC=CC=C1OC(=O)C MCULE-8588000452 [0,1,0,0,0,1|1,0,1]=4 1824 B14R1.814 CC(C)OC1=C(C=CC=C1)CC(=O)O MCULE-8599606622 [0,1,0,0,0,1|1,0,0]=3 1825 B14R1.814 NC(=S)NC1=CC=CC=C1OC(F)F MCULE-9106929832 [0,1,0,0,0,1|1,1,0]=4 1826 B14R1.814 O=C(O)CC1=C(C=CC=C1)OC(F)F MCULE-3862580446 [0,1,0,0,0,1|2,0,0]=4 1827 B14R1.5090 CCOC1=C(C=CC=C1Cl)CC(=O)O MCULE-1193223957 [0,1,0,0,0,1|1,0,0]=3 1828 B14R1.5098 CCOC1=CC=CC(=C1CC(=O)O)Cl MCULE-6289269309 [0,1,0,0,0,1|1,0,0]=3 1829 B14R1.6721 CCOC1=CC=C(C=C1CC(=O)O)Br MCULE-9734183520 [0,1,0,0,0,1|1,0,0]=3 1830 B14R1.6721 CCSC1=CC=C(C=C1CC(=O)O)Cl MCULE-3797651398 [0,1,0,0,0,1|1,1,0]=4 1831 B14R1.67 C=CCOC1=C(C=C(C=C1)Br)C(=O)C MCULE-6396438729 [0,2,0,0,0,0|1,0,1]=4 1832 B14R1.67 C=CCOC1=C(C=C(C=C1)C)C(=O)O MCULE-7088150302 [0,2,0,0,0,0|1,0,1]=4 1833 B14R1.67 C=CCOC1=C(C=C(C=C1)Cl)C(=O)O MCULE-2313578723 [0,2,0,0,0,0|1,0,1]=4 1834 B14R1.67 CC(=O)C1=C(C=CC(=C1)Br)OCCBr MCULE-9155690094 [0,2,0,0,0,0|1,0,0]=3 1835 B14R1.67 CC(=O)C1=C(C=CC(=C1)Br)OCCO MCULE-2912133847 [0,2,0,0,0,0|1,0,0]=3 1836 B14R1.67 CC(=O)C1=CC(=CC=C1OCCBr)F MCULE-6355823304 [0,2,0,0,0,0|1,0,0]=3 1837 B14R1.67 CC1=CC(=C(C=C1)OCCN)N(=O)=O MCULE-7574536208 [0,2,0,0,0,0|2,0,0]=4 1838 B14R1.67 CC1=CC=C(C(=C1)C(=O)O)OCCF MCULE-6711067247 [0,2,0,0,0,0|1,0,0]=3 1839 B14R1.67 CC1=CC=C(C(=C1)N(=O)=O)OCCN MCULE-3702899071 [0,2,0,0,0,0|2,0,0]=4 1840 B14R1.67 CCCNC1=CC=C(C=C1C(=O)O)C MCULE-6776135484 [0,2,0,0,0,0|2,0,0]=4 1841 B14R1.67 CCCOC1=C(C=C(C=C1)Cl)C(=O)C MCULE-9311751539 [0,2,0,0,0,0|1,0,0]=3 1842 B14R1.67 CCCOC1=C(C=C(C=C1)F)C(=O)C MCULE-2929608670 [0,2,0,0,0,0|1,0,0]=3 1843 B14R1.67 CCCOC1=C(C=C(C=C1)F)C(=O)O MCULE-5784726656 [0,2,0,0,0,0|1,0,0]=3 1844 B14R1.67 CCCOC1=C(C=C(C=C1)N)N(=O)=O MCULE-1168243774 [0,2,0,0,0,0|2,0,0]=4 1845 B14R1.67 CCCOC1=C(C=C(C=C1)N)N(=O)=O MCULE-4075914451 [0,2,0,0,0,0|2,0,0]=4 1846 B14R1.67 CCCOC1=CC=C(C=C1C(=O)C)C MCULE-3601145155 [0,2,0,0,0,0|1,0,0]=3 1847 B14R1.67 CCCOC1=CC=C(C=C1C(=O)Cl)Br MCULE-8465989531 [0,2,0,0,0,0|1,0,0]=3 1848 B14R1.67 CCCOC1=CC=C(C=C1C(=O)Cl)C MCULE-7645161621 [0,2,0,0,0,0|1,0,0]=3 1849 B14R1.67 CCCOC1=CC=C(C=C1C(=O)Cl)Cl MCULE-8909285486 [0,2,0,0,0,0|1,0,0]=3 1850 B14R1.67 CCCOC1=CC=C(C=C1C(=O)Cl)F MCULE-9311218662 [0,2,0,0,0,0|1,0,0]=3 1851 B14R1.67 CCCOC1=CC=C(C=C1C(=O)N)Br MCULE-8045960882 [0,2,0,0,0,0|0,0,0]=2 1852 B14R1.67 CCCOC1=CC=C(C=C1C(=O)N)Cl MCULE-9858776604 [0,2,0,0,0,0|0,0,0]=2 1853 B14R1.67 CCCOC1=CC=C(C=C1C(=O)O)Br MCULE-4286279650 [0,2,0,0,0,0|1,0,0]=3 1854 B14R1.67 CCCOC1=CC=C(C=C1C(=O)O)C MCULE-8530114045 [0,2,0,0,0,0|1,0,0]=3 1855 B14R1.67 CCCOC1=CC=C(C=C1C(=O)O)Cl MCULE-4321189481 [0,2,0,0,0,0|1,0,0]=3 1856 B14R1.67 CCCOC1=CC=C(C=C1C(=O)O)I MCULE-2766772806 [0,2,0,0,0,0|1,0,0]=3 1857 B14R1.67 CCCOC1=CC=C(C=C1C(=O)O)N MCULE-1064997734 [0,2,0,0,0,0|1,0,0]=3 1858 B14R1.67 COCOC1=CC=C(C=C1N(=O)=O)Br MCULE-1013938053 [0,2,0,0,0,0|2,0,0]=4 1859 B14R1.67 NCCOC1=CC=C(C=C1C(=O)N)F MCULE-5841191238 [0,2,0,0,0,0|0,0,0]=2 1860 B14R1.67 NCCOC1=CC=C(C=C1C(=O)N)F MCULE-7126223556 [0,2,0,0,0,0|0,0,0]=2 1861 B14R1.67 O=C(O)C1=C(C=CC(=C1)Cl)OCCF MCULE-4081986484 [0,2,0,0,0,0|1,0,0]=3 1862 B14R1.67 O=C(O)C1=CC(=CC=C1OCCF)I MCULE-3054632570 [0,2,0,0,0,0|1,0,0]=3 1863 B14R1.5213 CCOC1=C(C(=C(C=C1)Br)F)C(=O)O MCULE-8548854625 [0,2,0,0,0,0|1,0,0]=3 1864 B14R1.5213 CCOC1=C(C(=C(C=C1)C)F)C(=O)O MCULE-2466265522 [0,2,0,0,0,0|1,0,0]=3 1865 B14R1.5213 CCOC1=C(C(=C(C=C1)F)Br)N(=O)=O MCULE-8443028663 [0,2,0,0,0,0|2,0,0]=4 1866 B14R1.5213 CCOC1=C(C(=C(C=C1)F)F)C(=O)O MCULE-5937161631 [0,2,0,0,0,0|1,0,0]=3 1867 B14R1.5213 CCOC1=CC=C(C(=C1C(=O)O)C)F MCULE-8241779460 [0,2,0,0,0,0|1,0,0]=3 1868 B14R1.5213 CCOC1=CC=C(C(=C1N(=O)=O)C)Br MCULE-1290498837 [0,2,0,0,0,0|2,0,0]=4 1869 B14R1.5213 CCOC1=CC=C(C(=C1N(=O)=O)F)Br MCULE-7431499122 [0,2,0,0,0,0|2,0,0]=4 1870 B14R1.5237 C#CC1=CC=C(C(=C1)N(=O)=O)OCC MCULE-1646213200 [0,2,0,0,0,0|2,0,0]=4 1871 B14R1.5237 CCNC1=C(C=C(C=C1)OC)C(=O)O MCULE-7541216455 [0,2,0,0,0,0|2,0,0]=4 1872 B14R1.5237 CCOC1=C(C=C(C=C1)C#N)N(=O)=O MCULE-9529553610 [0,2,0,0,0,0|2,0,0]=4 1873 B14R1.5237 CCOC1=C(C=C(C=C1)C=O)C(=O)O MCULE-3829940190 [0,2,0,0,0,0|1,0,0]=3 1874 B14R1.5237 CCOC1=C(C=C(C=C1)C=O)N(=O)=O MCULE-4472411389 [0,2,0,0,0,0|2,0,0]=4 1875 B14R1.5237 CCOC1=CC=C(C=C1C(=O)O)C#N MCULE-8249775974 [0,2,0,0,0,0|1,0,0]=3 1876 B14R1.5237 CCOC1=CC=C(C=C1N(=O)=O)CN MCULE-8991855560 [0,2,0,0,0,0|2,0,0]=4 1877 B14R1.5238 C=C[C@@H](N)C1=C(C=CC(=C1)Br)OCC MCULE-4657508249 [0,2,0,0,0,0|1,0,1]=4 1878 B14R1.5238 C=C[C@@H](N)C1=C(C=CC(=C1)Br)OCC MCULE-6558800942 [0,2,0,0,0,0|1,0,1]=4 1879 B14R1.5238 C=C[C@H](N)C1=C(C=CC(=C1)Br)OCC MCULE-2197059667 [0,2,0,0,0,0|1,0,1]=4 1880 B14R1.5238 C=C[C@H](N)C1=C(C=CC(=C1)Br)OCC MCULE-4188189249 [0,2,0,0,0,0|1,0,1]=4 1881 B14R1.5238 CCNC1=C(C=C(C=C1)Cl)C(=O)OC MCULE-5401617460 [0,2,0,0,0,0|2,0,0]=4 1882 B14R1.5238 CCOC1=C(C=C(C=C1)Br)C(=O)NN MCULE-9093371869 [0,2,0,0,0,0|0,0,0]=2 1883 B14R1.5238 CCOC1=C(C=C(C=C1)Br)C(=O)OC MCULE-8829564059 [0,2,0,0,0,0|1,0,0]=3 1884 B14R1.5238 CCOC1=C(C=C(C=C1)Br)[C@@H](N)CC MCULE-1480382903 [0,2,0,0,0,0|1,0,1]=4 1885 B14R1.5238 CCOC1=C(C=C(C=C1)Br)[C@@H](N)CC MCULE-5005935426 [0,2,0,0,0,0|1,0,1]=4 1886 B14R1.5238 CCOC1=C(C=C(C=C1)Br)[C@@H](N)CF MCULE-6292520135 [0,2,0,0,0,0|1,0,1]=4 1887 B14R1.5238 CCOC1=C(C=C(C=C1)Br)[C@@H](N)CF MCULE-6724994814 [0,2,0,0,0,0|1,0,1]=4 1888 B14R1.5238 CCOC1=C(C=C(C=C1)Br)[C@@H](N)CN MCULE-8648172706 [0,2,0,0,0,0|1,0,1]=4 1889 B14R1.5238 CCOC1=C(C=C(C=C1)Br)[C@@H](N)CN MCULE-9091220687 [0,2,0,0,0,0|1,0,1]=4 1890 B14R1.5238 CCOC1=C(C=C(C=C1)Br)[C@@H](N)CO MCULE-3571735635 [0,2,0,0,0,0|0,0,2]=4 1891 B14R1.5238 CCOC1=C(C=C(C=C1)Br)[C@H](N)CC MCULE-2848992082 [0,2,0,0,0,0|1,0,1]=4 1892 B14R1.5238 CCOC1=C(C=C(C=C1)Br)[C@H](N)CC MCULE-9689864934 [0,2,0,0,0,0|1,0,1]=4 1893 B14R1.5238 CCOC1=C(C=C(C=C1)Br)[C@H](N)CF MCULE-3273925105 [0,2,0,0,0,0|1,0,1]=4 1894 B14R1.5238 CCOC1=C(C=C(C=C1)Br)[C@H](N)CF MCULE-5606782467 [0,2,0,0,0,0|1,0,1]=4 1895 B14R1.5238 CCOC1=C(C=C(C=C1)Br)[C@H](N)CN MCULE-1792235864 [0,2,0,0,0,0|1,0,1]=4 1896 B14R1.5238 CCOC1=C(C=C(C=C1)Br)[C@H](N)CN MCULE-5684316722 [0,2,0,0,0,0|1,0,1]=4 1897 B14R1.5238 CCOC1=C(C=C(C=C1)Br)[C@H](N)CO MCULE-7878675414 [0,2,0,0,0,0|0,0,2]=4 1898 B14R1.5238 CCOC1=C(C=C(C=C1)Cl)C(=O)CBr MCULE-4950534405 [0,2,0,0,0,0|1,0,0]=3 1899 B14R1.5238 CCOC1=C(C=C(C=C1)Cl)C(=O)OC MCULE-8048175154 [0,2,0,0,0,0|1,0,0]=3 1900 B14R1.5238 CCOC1=C(C=C(C=C1)F)C(=O)CC MCULE-2931433975 [0,2,0,0,0,0|1,0,0]=3 1901 B14R1.5238 CCOC1=CC=C(C=C1C(=O)CBr)F MCULE-8572932495 [0,2,0,0,0,0|1,0,0]=3 1902 B14R1.5238 CCOC1=CC=C(C=C1C(=O)CC)C MCULE-6276920324 [0,2,0,0,0,0|1,0,0]=3 1903 B14R1.5238 CCOC1=CC=C(C=C1C(=O)NC)Br MCULE-1637937157 [0,2,0,0,0,0|0,0,0]=2 1904 B14R1.5238 CCOC1=CC=C(C=C1C(=O)NC)N MCULE-1235861987 [0,2,0,0,0,0|0,0,0]=2 1905 B14R1.5238 CCOC1=CC=C(C=C1C(=O)NC)O MCULE-5139391871 [0,2,0,0,0,0|0,0,0]=2 1906 B14R1.5238 CCOC1=CC=C(C=C1C(=O)OC)C MCULE-1151874623 [0,2,0,0,0,0|1,0,0]=3 1907 B14R1.5238 CCOC1=CC=C(C=C1C(=O)OC)N MCULE-8207723601 [0,2,0,0,0,0|1,0,0]=3 1908 B14R1.5238 CCOC1=CC=C(C=C1C(=O)OC)O MCULE-9119818490 [0,2,0,0,0,0|1,0,0]=3 1909 B14R1.5238 CCOC1=CC=C(C=C1[C@@H](N)CO)Br MCULE-7507854172 [0,2,0,0,0,0|0,0,2]=4 1910 B14R1.5238 CCOC1=CC=C(C=C1[C@H](N)CO)Br MCULE-6940288234 [0,2,0,0,0,0|0,0,2]=4 1911 B14R1.5238 CCOC1=NC=C(C=C1C(=O)OC)Br MCULE-7242851012 [0,2,0,0,0,0|2,0,0]=4 1912 B14R1.5238 CCOC1=NC=C(C=C1C(=O)OC)I MCULE-4365744366 [0,2,0,0,0,0|2,0,0]=4 1913 B14R1.5238 CCSC1=CC=C(C=C1C(=O)OC)N MCULE-9829983979 [0,2,0,0,0,0|1,1,0]=4 1914 B14R1.6074 CC(=O)C1=C(C=CC(=C1)Br)OC(C)C MCULE-7583803569 [0,2,0,0,0,0|1,0,0]=3 1915 B14R1.6074 CC(=O)C1=C(C=CC(=C1)Br)OC(F)F MCULE-1606918293 [0,2,0,0,0,0|2,0,0]=4 1916 B14R1.6074 CC(=O)C1=C(C=CC(=C1)C)OC(F)F MCULE-3134387328 [0,2,0,0,0,0|2,0,0]=4 1917 B14R1.6074 CC(=O)C1=C(C=CC(=C1)Cl)OC(F)F MCULE-1266754579 [0,2,0,0,0,0|2,0,0]=4 1918 B14R1.6074 CC(=O)C1=CC(=CC=C1OC(C)C)C MCULE-3589393668 [0,2,0,0,0,0|1,0,0]=3 1919 B14R1.6074 CC(=O)OC1=C(C=C(C=C1)Br)C(=O)O MCULE-4103590957 [0,2,0,0,0,0|1,0,1]=4 1920 B14R1.6074 CC(=O)OC1=CC=C(C=C1C(=O)O)Cl MCULE-5240299802 [0,2,0,0,0,0|1,0,1]=4 1921 B14R1.6074 CC(=O)OC1=CC=C(C=C1C(=O)O)O MCULE-4585002140 [0,2,0,0,0,0|1,0,1]=4 1922 B14R1.6074 CC(C)NC1=CC=C(C=C1C(=O)O)Br MCULE-4752091474 [0,2,0,0,0,0|2,0,0]=4 1923 B14R1.6074 CC(C)NC1=CC=C(C=C1C(=O)O)Cl MCULE-8040596982 [0,2,0,0,0,0|2,0,0]=4 1924 B14R1.6074 CC(C)NC1=CC=C(C=C1C(=O)O)F MCULE-6173034008 [0,2,0,0,0,0|2,0,0]=4 1925 B14R1.6074 CC(C)NC1=CC=C(N=C1C(=O)N)Br MCULE-8248646563 [0,2,0,0,0,0|2,0,0]=4 1926 B14R1.6074 CC(C)OC1=C(C=C(C=C1)Br)C(=O)N MCULE-9779538669 [0,2,0,0,0,0|0,0,0]=2 1927 B14R1.6074 CC(C)OC1=C(C=C(C=C1)Br)C(=O)O MCULE-9639224482 [0,2,0,0,0,0|1,0,0]=3 1928 B14R1.6074 CC(C)OC1=C(C=C(C=C1)Br)N(=O)=O MCULE-6705053766 [0,2,0,0,0,0|2,0,0]=4 1929 B14R1.6074 CC(C)OC1=C(C=C(C=C1)Cl)C(=O)N MCULE-7137732731 [0,2,0,0,0,0|0,0,0]=2 1930 B14R1.6074 CC(C)OC1=C(C=C(C=C1)Cl)C(=O)O MCULE-1115740387 [0,2,0,0,0,0|1,0,0]=3 1931 B14R1.6074 CC(C)OC1=C(C=C(C=C1)Cl)N(=O)=O MCULE-8389371248 [0,2,0,0,0,0|2,0,0]=4 1932 B14R1.6074 CC(C)OC1=C(C=C(C=C1)F)N(=O)=O MCULE-6560218169 [0,2,0,0,0,0|2,0,0]=4 1933 B14R1.6074 CC(C)OC1=C(C=C(C=C1)I)C(=O)O MCULE-8257646449 [0,2,0,0,0,0|1,0,0]=3 1934 B14R1.6074 CC(C)OC1=C(C=C(C=C1)N)C(=O)N MCULE-4495444067 [0,2,0,0,0,0|0,0,0]=2 1935 B14R1.6074 CC(C)OC1=C(C=C(C=C1)N)C(=O)O MCULE-5518661202 [0,2,0,0,0,0|1,0,0]=3 1936 B14R1.6074 CC(C)OC1=CC=C(C=C1C(=O)Cl)Br MCULE-5236106525 [0,2,0,0,0,0|1,0,0]=3 1937 B14R1.6074 CC(C)OC1=CC=C(C=C1C(=O)O)Br MCULE-8228312429 [0,2,0,0,0,0|1,0,0]=3 1938 B14R1.6074 CC(C)OC1=CC=C(C=C1C(=O)O)O MCULE-5850032248 [0,2,0,0,0,0|1,0,0]=3 1939 B14R1.6074 CC(C)OC1=CC=C(C=C1C(C)N)F MCULE-3521553725 [0,2,0,0,0,0|1,0,1]=4 1940 B14R1.6074 CC(C)OC1=CC=C(C=C1N(=O)=O)O MCULE-4586910254 [0,2,0,0,0,0|2,0,0]=4 1941 B14R1.6074 CC(C)OC1=CC=C(C=C1[C@@H](C)N)Br MCULE-4825937359 [0,2,0,0,0,0|1,0,1]=4 1942 B14R1.6074 CC(C)OC1=CC=C(C=C1[C@H](C)N)Br MCULE-4172858535 [0,2,0,0,0,0|1,0,1]=4 1943 B14R1.6074 CC(C)OC1=CC=C(N=C1C(=O)O)Br MCULE-5691322363 [0,2,0,0,0,0|2,0,0]=4 1944 B14R1.6074 CC(C)OC1=NC=C(C=C1C(=O)O)Br MCULE-3983950350 [0,2,0,0,0,0|2,0,0]=4 1945 B14R1.6074 CC(C)OC1=NC=C(C=C1C(=O)O)Cl MCULE-1628729457 [0,2,0,0,0,0|2,0,0]=4 1946 B14R1.6074 CC1=CC(=C(C=C1)OC(C)C)C(=O)O MCULE-1436872663 [0,2,0,0,0,0|1,0,0]=3 1947 B14R1.6074 CC1=CC(=C(C=C1)OC(C)C)N(=O)=O MCULE-3916051020 [0,2,0,0,0,0|2,0,0]=4 1948 B14R1.6074 CC1=CC=C(C(=C1)C(=O)O)NC(C)C MCULE-3357168231 [0,2,0,0,0,0|2,0,0]=4 1949 B14R1.6074 CC1=CC=C(C(=C1)C(C)N)OC(C)C MCULE-5095950013 [0,2,0,0,0,0|1,0,1]=4 1950 B14R1.6074 NC(=O)C1=C(C=CC(=C1)F)OC(F)F MCULE-2855029114 [0,2,0,0,0,0|1,0,0]=3 1951 B14R1.6074 NC(=O)C1=CC(=CC=C1OC(F)F)Br MCULE-1983042568 [0,2,0,0,0,0|1,0,0]=3 1952 B14R1.6074 NC1=CC(=C(C=C1)OC(F)F)C(=O)O MCULE-4583200676 [0,2,0,0,0,0|2,0,0]=4 1953 B14R1.6074 NC1=CC(=C(C=C1)OC(F)F)C(=O)O MCULE-5184908703 [0,2,0,0,0,0|2,0,0]=4 1954 B14R1.6074 O=C(O)C1=C(C=CC(=C1)Br)OC(F)F MCULE-9403375658 [0,2,0,0,0,0|2,0,0]=4 1955 B14R1.6074 O=C(O)C1=C(C=CC(=C1)Cl)OC(F)F MCULE-5258265042 [0,2,0,0,0,0|2,0,0]=4 1956 B14R1.6074 O=C(O)C1=C(C=CC(=C1)F)OC(F)F MCULE-3102704800 [0,2,0,0,0,0|2,0,0]=4 1957 B14R1.6074 O=C(O)C1=C(C=CC(=C1)I)OC(F)F MCULE-4505054607 [0,2,0,0,0,0|2,0,0]=4 1958 B14R1.6722 CCOC1=C(C=C(C=C1)Br)S(=O)(=O)Cl MCULE-1090096170 [0,2,0,0,0,0|2,0,0]=4 1959 B14R1.6722 CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N MCULE-1466123773 [0,2,0,0,0,0|1,0,0]=3 1960 B14R1.6722 CCOC1=C(C=C(C=C1)C)S(=O)(=O)Cl MCULE-4999781710 [0,2,0,0,0,0|2,0,0]=4 1961 B14R1.6722 CCOC1=C(C=C(C=C1)C)S(=O)(=O)N MCULE-6125589444 [0,2,0,0,0,0|1,0,0]=3 1962 B14R1.6722 CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)Cl MCULE-6503150108 [0,2,0,0,0,0|2,0,0]=4 1963 B14R1.6722 CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)N MCULE-6092596037 [0,2,0,0,0,0|1,0,0]=3 1964 B14R1.6722 CCOC1=C(C=C(C=C1)N)S(=O)(=O)N MCULE-3387070776 [0,2,0,0,0,0|1,0,0]=3 1965 B14R1.6722 CCOC1=C(C=C(C=C1)N)S(=O)(=O)N MCULE-8987732591 [0,2,0,0,0,0|1,0,0]=3 1966 B14R1.6722 CCOC1=CC=C(C=C1S(=O)(=O)O)N MCULE-6209019916 [0,2,0,0,0,0|2,0,0]=4 1967 B14R1.10275 CCOC1=C(C=C(C(=C1)Br)Cl)N(=O)=O MCULE-4217238882 [0,2,0,0,0,0|2,0,0]=4 1968 B14R1.10275 CCOC1=C(C=C(C(=C1)Br)F)N(=O)=O MCULE-6795982319 [0,2,0,0,0,0|2,0,0]=4 1969 B14R1.10275 CCOC1=C(C=C(C(=C1)F)Br)N(=O)=O MCULE-3979038024 [0,2,0,0,0,0|2,0,0]=4 1970 B14R1.10275 CCOC1=C(C=C(C(=C1)F)C)C(=O)O MCULE-2665937597 [0,2,0,0,0,0|1,0,0]=3 1971 B14R1.10275 CCOC1=C(C=C(C(=C1)F)F)N(=O)=O MCULE-8786011847 [0,2,0,0,0,0|2,0,0]=4 1972 B14R1.10275 CCOC1=C(C=C(C(=C1)N)C)N(=O)=O MCULE-9824050217 [0,2,0,0,0,0|2,0,0]=4 1973 B14R1.10275 CCOC1=CC(=C(C=C1C(=O)O)Br)C MCULE-8750264067 [0,2,0,0,0,0|1,0,0]=3 1974 B14R1.10275 CCOC1=CC(=C(C=C1C(=O)O)C)C MCULE-4891134004 [0,2,0,0,0,0|1,0,0]=3 1975 B14R1.10275 CCOC1=CC(=C(C=C1C(=O)O)Cl)F MCULE-4806754755 [0,2,0,0,0,0|1,0,0]=3 1976 B14R1.10275 CCOC1=CC(=C(C=C1C(=O)O)Cl)N MCULE-4291451525 [0,2,0,0,0,0|1,0,0]=3 1977 B14R1.10275 CCOC1=CC(=C(C=C1C(=O)O)F)Cl MCULE-9923032178 [0,2,0,0,0,0|1,0,0]=3 1978 B14R1.10275 CCOC1=CC(=C(C=C1C(=O)O)F)F MCULE-5399141235 [0,2,0,0,0,0|1,0,0]=3 1979 B14R1.14774 CCNC1=C(C=C(C=C1Cl)Cl)C(=O)O MCULE-9799638330 [0,2,0,0,0,0|2,0,0]=4 1980 B14R1.14774 CCOC1=C(C=C(C=C1Br)C)C(=O)O MCULE-9303370734 [0,2,0,0,0,0|1,0,0]=3 1981 B14R1.14774 CCOC1=C(C=C(C=C1Br)Cl)C(=O)N MCULE-3236790196 [0,2,0,0,0,0|0,0,0]=2 1982 B14R1.14774 CCOC1=C(C=C(C=C1Br)F)N(=O)=O MCULE-1754537951 [0,2,0,0,0,0|2,0,0]=4 1983 B14R1.14774 CCOC1=C(C=C(C=C1C(=O)C)Cl)Cl MCULE-4778350451 [0,2,0,0,0,0|1,0,0]=3 1984 B14R1.14774 CCOC1=C(C=C(C=C1C(=O)N)Br)Br MCULE-4706717251 [0,2,0,0,0,0|0,0,0]=2 1985 B14R1.14774 CCOC1=C(C=C(C=C1C(=O)N)N)N MCULE-2600570885 [0,2,0,0,0,0|0,0,0]=2 1986 B14R1.14774 CCOC1=C(C=C(C=C1C(=O)O)Br)Br MCULE-7333955935 [0,2,0,0,0,0|1,0,0]=3 1987 B14R1.14774 CCOC1=C(C=C(C=C1C(=O)O)Cl)Cl MCULE-1579767780 [0,2,0,0,0,0|1,0,0]=3 1988 B14R1.14774 CCOC1=C(C=C(C=C1C)C)C(=O)O MCULE-2282042417 [0,2,0,0,0,0|1,0,0]=3 1989 B14R1.14774 CCOC1=C(C=C(C=C1C)F)C(=O)O MCULE-6102649009 [0,2,0,0,0,0|1,0,0]=3 1990 B14R1.14774 CCOC1=C(C=C(C=C1Cl)Br)C(=O)O MCULE-8719325162 [0,2,0,0,0,0|1,0,0]=3 1991 B14R1.14774 CCOC1=C(C=C(C=C1F)Br)C(=O)O MCULE-8555379056 [0,2,0,0,0,0|1,0,0]=3 1992 B14R1.14774 CCOC1=C(C=C(C=C1F)C)C(=O)O MCULE-7632115146 [0,2,0,0,0,0|1,0,0]=3 1993 B14R1.14774 CCOC1=C(C=C(C=C1F)Cl)C(=O)O MCULE-9541506744 [0,2,0,0,0,0|1,0,0]=3 1994 B14R1.14774 CCOC1=C(C=C(C=C1F)F)C(=O)C MCULE-2243490012 [0,2,0,0,0,0|1,0,0]=3 1995 B14R1.14774 CCOC1=C(C=C(C=C1F)F)C(=O)Cl MCULE-1351310052 [0,2,0,0,0,0|1,0,0]=3 1996 B14R1.14774 CCOC1=C(C=C(C=C1F)F)C(=O)N MCULE-1372104966 [0,2,0,0,0,0|0,0,0]=2 1997 B14R1.14774 CCOC1=C(C=C(C=C1F)F)C(=O)O MCULE-4673868392 [0,2,0,0,0,0|1,0,0]=3 1998 B14R1.14774 CCOC1=C(C=C(C=C1F)F)N(=O)=O MCULE-8835686230 [0,2,0,0,0,0|2,0,0]=4 1999 B14R1.14774 CCOC1=C(C=C(C=C1I)I)C(=O)O MCULE-1944542795 [0,2,0,0,0,0|1,0,0]=3 2000 B14R1.14774 CCOC1=C(C=C(C=C1N(=O)=O)Br)Cl MCULE-1310587727 [0,2,0,0,0,0|2,0,0]=4 2001 B14R1.14774 CCOC1=C(C=C(C=C1N(=O)=O)Br)F MCULE-9235536563 [0,2,0,0,0,0|2,0,0]=4 2002 B14R1.14774 CCOC1=C(C=C(C=C1N(=O)=O)C)Br MCULE-7796456226 [0,2,0,0,0,0|2,0,0]=4 2003 B14R1.164 CC(=O)C1=C(C=C(C=C1)Br)OC(C)C MCULE-7872163530 [0,2,0,0,0,0|1,0,0]=3 2004 B14R1.164 CC(=O)C1=C(C=C(C=C1)Br)OC(F)F MCULE-4421435026 [0,2,0,0,0,0|2,0,0]=4 2005 B14R1.164 CC(=O)C1=C(C=C(C=C1)Cl)OC(C)C MCULE-5901033341 [0,2,0,0,0,0|1,0,0]=3 2006 B14R1.164 CC(=O)C1=C(C=C(C=C1)F)OC(F)F MCULE-3181166983 [0,2,0,0,0,0|2,0,0]=4 2007 B14R1.164 CC(=O)C1=CC=C(C=C1OC(C)C)F MCULE-1537730923 [0,2,0,0,0,0|1,0,0]=3 2008 B14R1.164 CC(=O)NC1=C(C=CC(=C1)F)C(=O)N MCULE-9157213107 [0,2,0,0,0,0|1,0,1]=4 2009 B14R1.164 CC(=O)NC1=CC(=CC=C1C(=O)N)Br MCULE-2541166999 [0,2,0,0,0,0|1,0,1]=4 2010 B14R1.164 CC(=O)OC1=C(C=CC(=C1)C)C(=O)O MCULE-5405998716 [0,2,0,0,0,0|1,0,1]=4 2011 B14R1.164 CC(=O)OC1=CC(=CC=C1C(=O)O)Br MCULE-3667364091 [0,2,0,0,0,0|1,0,1]=4 2012 B14R1.164 CC(=O)OC1=CC(=CC=C1C(=O)O)O MCULE-3035314482 [0,2,0,0,0,0|1,0,1]=4 2013 B14R1.164 CC(C)CC1=CC(=CC=C1C(=O)O)Br MCULE-3226733694 [0,2,0,0,0,0|2,0,0]=4 2014 B14R1.164 CC(C)NC1=CC(=CC=C1C(=O)O)Br MCULE-3766080210 [0,2,0,0,0,0|2,0,0]=4 2015 B14R1.164 CC(C)NC1=CC(=CC=C1C(=O)O)Cl MCULE-8616232385 [0,2,0,0,0,0|2,0,0]=4 2016 B14R1.164 CC(C)OC1=C(C=CC(=C1)Br)C(=O)O MCULE-5640942054 [0,2,0,0,0,0|1,0,0]=3 2017 B14R1.164 CC(C)OC1=C(C=CC(=C1)Br)C(C)N MCULE-6344542971 [0,2,0,0,0,0|1,0,1]=4 2018 B14R1.164 CC(C)OC1=C(C=CC(=C1)Cl)C(=O)O MCULE-9425689388 [0,2,0,0,0,0|1,0,0]=3 2019 B14R1.164 CC(C)OC1=C(C=CC(=C1)N)C(=O)N MCULE-9574036878 [0,2,0,0,0,0|0,0,0]=2 2020 B14R1.164 CC(C)OC1=CC(=CC=C1C(=O)N)I MCULE-3444762628 [0,2,0,0,0,0|0,0,0]=2 2021 B14R1.164 CC(C)OC1=CC(=CC=C1C(=O)O)F MCULE-3465559195 [0,2,0,0,0,0|1,0,0]=3 2022 B14R1.164 CC(C)OC1=CC(=CC=C1C(C)N)Cl MCULE-1617909503 [0,2,0,0,0,0|1,0,1]=4 2023 B14R1.164 CC(C)OC1=CC(=CC=C1C(C)N)Cl MCULE-2640810790 [0,2,0,0,0,0|1,0,1]=4 2024 B14R1.164 CC(C)OC1=CC(=CC=C1C(C)N)F MCULE-9210899633 [0,2,0,0,0,0|1,0,1]=4 2025 B14R1.164 CC(C)OC1=CC(=CC=C1N(=O)=O)Cl MCULE-5919283952 [0,2,0,0,0,0|2,0,0]=4 2026 B14R1.164 CC(C)OC1=CC(=CC=C1N(=O)=O)F MCULE-4305605094 [0,2,0,0,0,0|2,0,0]=4 2027 B14R1.164 CC1=CC=C(C(=C1)OC(C)C)C(=O)O MCULE-4277695009 [0,2,0,0,0,0|1,0,0]=3 2028 B14R1.164 CC1=CC=C(C(=C1)OC(C)C)C(C)N MCULE-1529589154 [0,2,0,0,0,0|1,0,1]=4 2029 B14R1.164 CC1=CC=C(C(=C1)OC(C)C)C(C)N MCULE-9447110119 [0,2,0,0,0,0|1,0,1]=4 2030 B14R1.164 O=C(O)C1=C(C=C(C=C1)Br)OC(F)F MCULE-9416538684 [0,2,0,0,0,0|2,0,0]=4 2031 B14R1.164 O=C(O)C1=CC=C(C=C1OC(F)F)Cl MCULE-6520154004 [0,2,0,0,0,0|2,0,0]=4 2032 B14R1.440 CCOC1=CC(=CC=C1S(=O)(=O)C)Br MCULE-5094762016 [0,2,0,0,0,0|2,0,0]=4 2033 B14R1.440 CCOC1=CC(=CC=C1S(=O)(=O)N)C MCULE-1176755588 [0,2,0,0,0,0|1,0,0]=3 2034 B14R1.707 COC(=O)C1=CC(=CC=C1C(=O)N)F MCULE-7892236166 [0,2,0,0,0,0|2,0,0]=4 2035 B14R1.760 C#CCOC1=C(C=CC(=C1)Br)C(=O)C MCULE-1538107887 [0,2,0,0,0,0|1,0,1]=4 2036 B14R1.760 C#CCOC1=CC(=CC=C1C(=O)O)O MCULE-7798015573 [0,2,0,0,0,0|1,0,1]=4 2037 B14R1.760 C=CCOC1=C(C=CC(=C1)Br)C(=O)C MCULE-5452503993 [0,2,0,0,0,0|1,0,1]=4 2038 B14R1.760 C=CCOC1=CC(=CC=C1C(=O)O)I MCULE-6262255264 [0,2,0,0,0,0|1,0,1]=4 2039 B14R1.760 CC(N)C1=C(C=C(C=C1)Br)OCCO MCULE-8763650849 [0,2,0,0,0,0|1,0,1]=4 2040 B14R1.760 CCCOC1=C(C=CC(=C1)F)N(=O)=O MCULE-3352635572 [0,2,0,0,0,0|2,0,0]=4 2041 B14R1.760 CCCOC1=C(C=CC(=N1)C)C(=O)O MCULE-1620997473 [0,2,0,0,0,0|2,0,0]=4 2042 B14R1.760 CCCOC1=CC(=CC=C1C(=O)C)F MCULE-3290111263 [0,2,0,0,0,0|1,0,0]=3 2043 B14R1.760 CCCOC1=CC(=CC=C1C(=O)Cl)F MCULE-7580516409 [0,2,0,0,0,0|1,0,0]=3 2044 B14R1.760 CCCOC1=CC(=CC=C1C(=O)N)Br MCULE-2865204442 [0,2,0,0,0,0|0,0,0]=2 2045 B14R1.760 CCCOC1=CC(=CC=C1C(=O)O)Br MCULE-2204752519 [0,2,0,0,0,0|1,0,0]=3 2046 B14R1.760 CCCOC1=CC(=CC=C1C(=O)O)F MCULE-3278254901 [0,2,0,0,0,0|1,0,0]=3 2047 B14R1.760 COCOC1=CC(=CC=C1N(=O)=O)F MCULE-1013881553 [0,2,0,0,0,0|2,0,0]=4 2048 B14R1.760 NCCOC1=C(C=CC(=C1)Cl)N(=O)=O MCULE-6951583322 [0,2,0,0,0,0|2,0,0]=4 2049 B14R1.760 O=N(=O)C1=CC=C(C=C1OCCBr)O MCULE-2606492771 [0,2,0,0,0,0|2,0,0]=4 2050 B14R1.5121 C#CC1=CC=C(C(=C1)OCC)C(=O)O MCULE-1919030010 [0,2,0,0,0,0|1,0,0]=3 2051 B14R1.5121 C#CC1=CC=C(C(=C1)OCC)N(=O)=O MCULE-4921809218 [0,2,0,0,0,0|2,0,0]=4 2052 B14R1.5121 C=CC1=CC=C(C(=C1)OCC)N(=O)=O MCULE-9348707085 [0,2,0,0,0,0|2,0,0]=4 2053 B14R1.5121 CCNC1=C(C=CC(=C1)OC)C(=O)O MCULE-8857859078 [0,2,0,0,0,0|2,0,0]=4 2054 B14R1.5121 CCOC1=C(C=CC(=C1)CCl)N(=O)=O MCULE-9624301179 [0,2,0,0,0,0|2,0,0]=4 2055 B14R1.5121 CCOC1=C(C=CC(=C1)NC)N(=O)=O MCULE-9317622260 [0,2,0,0,0,0|2,0,0]=4 2056 B14R1.5121 CCOC1=CC(=CC=C1C(=O)C)OC MCULE-8315881096 [0,2,0,0,0,0|1,0,0]=3 2057 B14R1.5121 CCOC1=CC(=CC=C1C(=O)O)CC MCULE-3067313432 [0,2,0,0,0,0|1,0,0]=3 2058 B14R1.5121 CCOC1=CC(=CC=C1N(=O)=O)OC MCULE-9028009698 [0,2,0,0,0,0|2,0,0]=4 2059 B14R1.5122 CCOC1=C(C=CC(=C1)Br)C(=O)OC MCULE-8714220702 [0,2,0,0,0,0|1,0,0]=3 2060 B14R1.5122 CCOC1=C(C=CC(=C1)Cl)C(=O)OC MCULE-5747386202 [0,2,0,0,0,0|1,0,0]=3 2061 B14R1.5122 CCOC1=C(C=CC(=C1)F)C(=O)OC MCULE-7586529308 [0,2,0,0,0,0|1,0,0]=3 2062 B14R1.5122 CCOC1=C(C=CC(=C1)I)C(=O)OC MCULE-7411166597 [0,2,0,0,0,0|1,0,0]=3 2063 B14R1.5122 CCOC1=C(C=CC(=C1)N)C(=O)NC MCULE-7833666880 [0,2,0,0,0,0|0,0,0]=2 2064 B14R1.5122 CCOC1=C(C=CC(=N1)Cl)C(=O)OC MCULE-8608943261 [0,2,0,0,0,0|2,0,0]=4 2065 B14R1.5122 CCOC1=CC(=CC=C1C(=O)NC)Br MCULE-1825508261 [0,2,0,0,0,0|0,0,0]=2 2066 B14R1.5122 CCOC1=CC(=CC=C1C(=O)OC)N MCULE-5871181276 [0,2,0,0,0,0|1,0,0]=3 2067 B14R1.5320 CCCC1=C(C(=CC(=C1)O)O)C(=O)O MCULE-7584378616 [0,2,0,0,0,0|2,0,0]=4 2068 B14R1.5320 CCOC1=C(C(=CC(=C1)Br)F)C(=O)C MCULE-7195661862 [0,2,0,0,0,0|1,0,0]=3 2069 B14R1.5320 CCOC1=C(C(=CC(=C1)F)Br)N(=O)=O MCULE-2706744675 [0,2,0,0,0,0|2,0,0]=4 2070 B14R1.5320 CCOC1=C(C(=CC(=C1)F)F)N(=O)=O MCULE-5286410255 [0,2,0,0,0,0|2,0,0]=4 2071 B14R1.5320 CCOC1=CC(=CC(=C1N(=O)=O)F)Br MCULE-9206333269 [0,2,0,0,0,0|2,0,0]=4 2072 B14R1.5320 CCSC1=NC(=CC(=C1C(=O)N)C)C MCULE-1259398498 [0,2,0,0,0,0|1,1,0]=4 2073 B14R1.14833 CCOC1=C(C(=CC=C1C(=O)O)Cl)F MCULE-9104825865 [0,2,0,0,0,0|1,0,0]=3 2074 B14R1.14833 CCOC1=C(C(=CC=C1C(=O)O)F)F MCULE-1746041334 [0,2,0,0,0,0|1,0,0]=3 2075 B14R1.14833 CCOC1=C(C(=CC=C1N(=O)=O)Br)F MCULE-4690161017 [0,2,0,0,0,0|2,0,0]=4 2076 B14R1.14833 CCOC1=C(C=CC(=C1Br)F)N(=O)=O MCULE-7832888303 [0,2,0,0,0,0|2,0,0]=4 2077 B14R1.14833 CCOC1=C(C=CC(=C1C)F)C(=O)O MCULE-8129703614 [0,2,0,0,0,0|1,0,0]=3 2078 B14R1.788 NS(=O)(=O)C1=CC=CC=C1OCCCl MCULE-2572351038 [0,2,0,0,0,0|1,0,0]=3 2079 B14R1.788 O=P(O)(O)C1=C(C=CC=C1)OCCCl MCULE-6829277678 [0,2,0,0,0,0|2,0,0]=4 2080 B14R1.815 NS(=O)(=O)C1=C(C=CC=C1)OC(F)F MCULE-7718803875 [0,2,0,0,0,0|2,0,0]=4 2081 B14R1.263 C=CC[C@@H](N)C1=C(C=CC=C1)OCC MCULE-4497000156 [0,2,0,0,0,0|1,0,1]=4 2082 B14R1.263 C=CC[C@@H](N)C1=C(C=CC=C1)OCC MCULE-6346582297 [0,2,0,0,0,0|1,0,1]=4 2083 B14R1.263 C=CC[C@H](N)C1=C(C=CC=C1)OCC MCULE-2618958214 [0,2,0,0,0,0|1,0,1]=4 2084 B14R1.263 C=CC[C@H](N)C1=C(C=CC=C1)OCC MCULE-2661593986 [0,2,0,0,0,0|1,0,1]=4 2085 B14R1.263 CCCC(=O)C1=C(C=CC=C1)OCC MCULE-4057631490 [0,2,0,0,0,0|1,0,0]=3 2086 B14R1.263 CCCC(=O)C1=C(C=CN=C1)OCC MCULE-4226038733 [0,2,0,0,0,0|2,0,0]=4 2087 B14R1.263 CCCC(N)C1=CC=CC=C1OCC MCULE-1178357427 [0,2,0,0,0,0|1,0,1]=4 2088 B14R1.263 CCC[C@@H](N)C1=C(C=CC=C1)OCC MCULE-3982169066 [0,2,0,0,0,0|1,0,1]=4 2089 B14R1.263 CCC[C@@H](N)C1=CC=CC=C1OCC MCULE-8933626754 [0,2,0,0,0,0|1,0,1]=4 2090 B14R1.263 CCC[C@H](N)C1=C(C=CC=C1)OCC MCULE-1646991509 [0,2,0,0,0,0|1,0,1]=4 2091 B14R1.263 CCC[C@H](N)C1=CC=CC=C1OCC MCULE-1930814255 [0,2,0,0,0,0|1,0,1]=4 2092 B14R1.263 CCNC(=O)C1=C(C=CC=C1)SCC MCULE-7658551225 [0,2,0,0,0,0|0,1,0]=3 2093 B14R1.263 CCNC1=C(C=CC=C1)C(=O)OCC MCULE-7283382530 [0,2,0,0,0,0|2,0,0]=4 2094 B14R1.263 CCOC(=O)C1=CC=CC=C1OCC MCULE-5446202568 [0,2,0,0,0,0|1,0,0]=3 2095 B14R1.263 CCOC(=O)C1=CC=CN=C1OCC MCULE-4137113036 [0,2,0,0,0,0|2,0,0]=4 2096 B14R1.263 CCOC(=O)C1=CN=CC=C1OCC MCULE-6656984503 [0,2,0,0,0,0|2,0,0]=4 2097 B14R1.263 CCOC1=C(C=CC=C1)C(C)NC=O MCULE-4571609583 [0,2,0,0,0,0|1,0,1]=4 2098 B14R1.263 CCOC1=C(C=CC=C1)[C@@H](N)CC#N MCULE-3127540605 [0,2,0,0,0,0|1,0,1]=4 2099 B14R1.263 CCOC1=C(C=CC=C1)[C@@H](N)CC#N MCULE-6897715168 [0,2,0,0,0,0|1,0,1]=4 2100 B14R1.263 CCOC1=C(C=CC=C1)[C@@H](N)CCF MCULE-6865503306 [0,2,0,0,0,0|1,0,1]=4 2101 B14R1.263 CCOC1=C(C=CC=C1)[C@@H](N)CCF MCULE-6928634550 [0,2,0,0,0,0|1,0,1]=4 2102 B14R1.263 CCOC1=C(C=CC=C1)[C@@H](N)CCN MCULE-4480905654 [0,2,0,0,0,0|1,0,1]=4 2103 B14R1.263 CCOC1=C(C=CC=C1)[C@@H](N)CCN MCULE-5756323353 [0,2,0,0,0,0|1,0,1]=4 2104 B14R1.263 CCOC1=C(C=CC=C1)[C@@H](N)CCO MCULE-7077869292 [0,2,0,0,0,0|0,0,2]=4 2105 B14R1.263 CCOC1=C(C=CC=C1)[C@@H](N)CCO MCULE-7462033003 [0,2,0,0,0,0|0,0,2]=4 2106 B14R1.263 CCOC1=C(C=CC=C1)[C@H](N)CC#N MCULE-7436277642 [0,2,0,0,0,0|1,0,1]=4 2107 B14R1.263 CCOC1=C(C=CC=C1)[C@H](N)CC#N MCULE-7502942386 [0,2,0,0,0,0|1,0,1]=4 2108 B14R1.263 CCOC1=C(C=CC=C1)[C@H](N)CCF MCULE-2675181165 [0,2,0,0,0,0|1,0,1]=4 2109 B14R1.263 CCOC1=C(C=CC=C1)[C@H](N)CCF MCULE-3595065518 [0,2,0,0,0,0|1,0,1]=4 2110 B14R1.263 CCOC1=C(C=CC=C1)[C@H](N)CCN MCULE-5552586796 [0,2,0,0,0,0|1,0,1]=4 2111 B14R1.263 CCOC1=C(C=CC=C1)[C@H](N)CCN MCULE-9645432708 [0,2,0,0,0,0|1,0,1]=4 2112 B14R1.263 CCOC1=C(C=CC=C1)[C@H](N)CCO MCULE-1139487133 [0,2,0,0,0,0|0,0,2]=4 2113 B14R1.263 CCOC1=C(C=CC=C1)[C@H](N)CCO MCULE-4896161953 [0,2,0,0,0,0|0,0,2]=4 2114 B14R1.263 CCOC1=CC=CC=C1C(=O)CC#N MCULE-3546724297 [0,2,0,0,0,0|0,0,1]=3 2115 B14R1.746 CCC(=O)C1=CC=CC=C1C(=O)OC MCULE-7498309002 [0,2,0,0,0,0|2,0,0]=4 2116 B14R1.746 CC[C@@H](N)C1=C(C=CC=C1)C(=O)OC MCULE-5572176354 [0,2,0,0,0,0|2,0,0]=4 2117 B14R1.746 CC[C@@H](N)C1=C(C=CC=C1)C(=O)OC MCULE-7794345331 [0,2,0,0,0,0|2,0,0]=4 2118 B14R1.746 CC[C@H](N)C1=C(C=CC=C1)C(=O)OC MCULE-1681813372 [0,2,0,0,0,0|2,0,0]=4 2119 B14R1.746 CC[C@H](N)C1=C(C=CC=C1)C(=O)OC MCULE-6107208651 [0,2,0,0,0,0|2,0,0]=4 2120 B14R1.746 CNC(=O)C1=CC=CC=C1C(=O)NC MCULE-2052307811 [0,2,0,0,0,0|2,0,0]=4 2121 B14R1.789 C#CCOC1=C(C=CC=C1)C(=O)OC MCULE-2582471396 [0,2,0,0,0,0|1,0,1]=4 2122 B14R1.789 C=CCOC1=CC=CC=C1C(=O)NN MCULE-5990135358 [0,2,0,0,0,0|0,0,1]=3 2123 B14R1.789 CCCOC1=C(C=CC=C1)C(=O)CN MCULE-1340893566 [0,2,0,0,0,0|0,0,0]=2 2124 B14R1.789 CCCOC1=C(C=CC=C1)C(=O)CN MCULE-8722450330 [0,2,0,0,0,0|0,0,0]=2 2125 B14R1.789 CCCOC1=C(C=CC=C1)C(=O)NN MCULE-6324481251 [0,2,0,0,0,0|0,0,0]=2 2126 B14R1.789 CCCOC1=NC=CC=C1C(=O)OC MCULE-9448575483 [0,2,0,0,0,0|2,0,0]=4 2127 B14R1.789 COC(=O)C1=C(C=CC=C1)OCC#N MCULE-5885516942 [0,2,0,0,0,0|1,0,1]=4 2128 B14R1.789 COC(=O)C1=C(C=CC=C1)OCCBr MCULE-8364254291 [0,2,0,0,0,0|1,0,0]=3 2129 B14R1.789 COC(=O)C1=C(C=CC=C1)OCCN MCULE-8287119427 [0,2,0,0,0,0|1,0,0]=3 2130 B14R1.789 COC(=O)C1=C(C=CC=C1)OCCO MCULE-3258485949 [0,2,0,0,0,0|1,0,0]=3 2131 B14R1.789 COC(=O)C1=CC=CC=C1NCCO MCULE-8832392420 [0,2,0,0,0,0|2,0,0]=4 2132 B14R1.3101 CCCC1=C(C=CC=C1C(=O)OC)O MCULE-3799748541 [0,2,0,0,0,0|2,0,0]=4 2133 B14R1.3101 CCOC1=C(C=CC=C1C(=O)OC)N MCULE-7116395264 [0,2,0,0,0,0|1,0,0]=3 2134 B14R1.3101 CCOC1=C(C=CC=C1C(N)CC)C MCULE-6061638901 [0,2,0,0,0,0|1,0,1]=4 2135 B14R1.3101 CCOC1=C(C=CC=C1C(N)CC)C MCULE-7895139610 [0,2,0,0,0,0|1,0,1]=4 2136 B14R1.3101 CCOC1=C(C=CC=C1C(N)CC)F MCULE-3263186698 [0,2,0,0,0,0|1,0,1]=4 2137 B14R1.3101 CCOC1=C(C=CC=C1C(N)CC)F MCULE-9078171250 [0,2,0,0,0,0|1,0,1]=4 2138 B14R1.3101 CCOC1=C(C=CC=C1N)C(=O)NC MCULE-3784889346 [0,2,0,0,0,0|0,0,0]=2 2139 B14R1.317 CCC(C)(C)C1=CC=CC=C1C(=O)O MCULE-8311992938 [0,2,0,0,0,0|2,0,0]=4 2140 B14R1.317 CCS(=O)(=O)C1=C(C=CC=C1)C(=O)N MCULE-2267822550 [0,2,0,0,0,0|0,1,0]=3 2141 B14R1.317 CCS(=O)(=O)C1=C(C=CC=C1)C(=O)O MCULE-3108831573 [0,2,0,0,0,0|1,1,0]=4 2142 B14R1.429 C[C@@H](O)[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-2128401048 [0,2,0,0,0,0|2,0,0]=4 2143 B14R1.429 C[C@@H](O)[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-5443176028 [0,2,0,0,0,0|2,0,0]=4 2144 B14R1.429 C[C@H](O)[C@H](N)C1=CC=CC=C1C(=O)O MCULE-3188978105 [0,2,0,0,0,0|2,0,0]=4 2145 B14R1.429 C[C@H](O)[C@H](N)C1=CC=CC=C1C(=O)O MCULE-6397971679 [0,2,0,0,0,0|2,0,0]=4 2146 B14R1.623 CCC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-5789306179 [0,2,0,0,0,0|2,0,0]=4 2147 B14R1.623 CCC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-9204885614 [0,2,0,0,0,0|2,0,0]=4 2148 B14R1.623 CCC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-4370494862 [0,2,0,0,0,0|2,0,0]=4 2149 B14R1.623 CCC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-9805126332 [0,2,0,0,0,0|2,0,0]=4 2150 B14R1.623 CCOC(=O)C1=C(C=CC=C1)C(=O)C MCULE-7822545927 [0,2,0,0,0,0|1,0,0]=3 2151 B14R1.623 CCOC(=O)C1=C(C=CC=C1)N(=O)=O MCULE-8877877433 [0,2,0,0,0,0|2,0,0]=4 2152 B14R1.623 CCOC(=O)C1=C(N=CC=C1)C(=O)C MCULE-3374145269 [0,2,0,0,0,0|2,0,0]=4 2153 B14R1.623 CCOC(=O)C1=CC=CN=C1C(=O)O MCULE-1420682383 [0,2,0,0,0,0|2,0,0]=4 2154 B14R1.623 NCC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-1053634533 [0,2,0,0,0,0|2,0,0]=4 2155 B14R1.623 NCC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-1462703532 [0,2,0,0,0,0|2,0,0]=4 2156 B14R1.623 NCC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-4017292379 [0,2,0,0,0,0|2,0,0]=4 2157 B14R1.623 NCC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-5999835646 [0,2,0,0,0,0|2,0,0]=4 2158 B14R1.623 N[C@@H](CCF)C1=CC=CC=C1C(=O)O MCULE-2918706888 [0,2,0,0,0,0|2,0,0]=4 2159 B14R1.623 N[C@@H](CCF)C1=CC=CC=C1C(=O)O MCULE-7090959004 [0,2,0,0,0,0|2,0,0]=4 2160 B14R1.623 N[C@@H](CCO)C1=CC=CC=C1C(=O)O MCULE-2964614242 [0,2,0,0,0,0|2,0,0]=4 2161 B14R1.623 N[C@@H](CCO)C1=CC=CC=C1C(=O)O MCULE-6981692938 [0,2,0,0,0,0|2,0,0]=4 2162 B14R1.623 N[C@H](CCF)C1=CC=CC=C1C(=O)O MCULE-2587716976 [0,2,0,0,0,0|2,0,0]=4 2163 B14R1.623 N[C@H](CCF)C1=CC=CC=C1C(=O)O MCULE-5751324787 [0,2,0,0,0,0|2,0,0]=4 2164 B14R1.623 N[C@H](CCO)C1=CC=CC=C1C(=O)O MCULE-5600559750 [0,2,0,0,0,0|2,0,0]=4 2165 B14R1.623 N[C@H](CCO)C1=CC=CC=C1C(=O)O MCULE-8456943868 [0,2,0,0,0,0|2,0,0]=4 2166 B14R1.623 O=C(O)C1=CC=CC=C1S(=O)CCO MCULE-2177222526 [0,2,0,0,0,0|1,1,0]=4 2167 B14R1.903 C=CCCOC1=CC=CC=C1C(=O)N MCULE-5771080177 [0,2,0,0,0,0|0,0,0]=2 2168 B14R1.903 CC#CCOC1=C(C=CC=N1)C(=O)O MCULE-5365961215 [0,2,0,0,0,0|2,0,0]=4 2169 B14R1.903 CC#CCOC1=NC=CC=C1C(=N)N MCULE-5455326684 [0,2,0,0,0,0|2,0,0]=4 2170 B14R1.903 CC#CCOC1=NC=CC=C1C(=O)Cl MCULE-2225399929 [0,2,0,0,0,0|2,0,0]=4 2171 B14R1.903 CC#CCOC1=NC=CC=C1C(=S)N MCULE-1878812923 [0,2,0,0,0,0|1,1,0]=4 2172 B14R1.903 CC=CCOC1=CC=CC=C1C(=O)N MCULE-2390373145 [0,2,0,0,0,0|0,0,0]=2 2173 B14R1.903 CCCCNC1=CC=CC=C1C(=O)O MCULE-5804543532 [0,2,0,0,0,0|2,0,0]=4 2174 B14R1.903 CCCCOC1=C(C=CC=C1)C(=O)Cl MCULE-7987200887 [0,2,0,0,0,0|1,0,0]=3 2175 B14R1.903 CCCCOC1=CC=CC=C1C(=O)C MCULE-3679722833 [0,2,0,0,0,0|1,0,0]=3 2176 B14R1.903 CCCCOC1=CC=CC=C1C(=O)O MCULE-1629628067 [0,2,0,0,0,0|1,0,0]=3 2177 B14R1.903 CCCCOC1=CC=CC=C1N(=O)=O MCULE-3939604067 [0,2,0,0,0,0|2,0,0]=4 2178 B14R1.903 CCCCOC1=NC=CC=C1C(=O)O MCULE-6001673419 [0,2,0,0,0,0|2,0,0]=4 2179 B14R1.903 CCCCSC1=C(C=CC=C1)C(=O)C MCULE-3637333747 [0,2,0,0,0,0|1,1,0]=4 2180 B14R1.903 CCCCSC1=C(C=CC=C1)C(=O)Cl MCULE-9079945176 [0,2,0,0,0,0|1,1,0]=4 2181 B14R1.903 CCCCSC1=C(C=CC=C1)C(=O)O MCULE-6465717857 [0,2,0,0,0,0|1,1,0]=4 2182 B14R1.903 CCCCSC1=CC=CC=C1C(=O)N MCULE-7889882768 [0,2,0,0,0,0|0,1,0]=3 2183 B14R1.903 CNCCOC1=CC=CC=C1N(=O)=O MCULE-9658895454 [0,2,0,0,0,0|2,0,0]=4 2184 B14R1.903 COCCOC1=C(C=CC=C1)C(=O)O MCULE-3683927750 [0,2,0,0,0,0|1,0,0]=3 2185 B14R1.903 COCCOC1=C(C=CC=C1)C(C)N MCULE-7299907864 [0,2,0,0,0,0|1,0,1]=4 2186 B14R1.903 COCCOC1=C(C=CC=N1)C(=O)O MCULE-3383285504 [0,2,0,0,0,0|2,0,0]=4 2187 B14R1.903 COCCOC1=C(C=CN=C1)C(=O)O MCULE-5631252425 [0,2,0,0,0,0|2,0,0]=4 2188 B14R1.903 COCCOC1=C(C=NC=C1)C(=O)O MCULE-4377794267 [0,2,0,0,0,0|2,0,0]=4 2189 B14R1.903 COCCOC1=C(N=CC=C1)C(=O)O MCULE-8937211043 [0,2,0,0,0,0|2,0,0]=4 2190 B14R1.903 COCCOC1=CC=CC=C1N(=O)=O MCULE-8879672549 [0,2,0,0,0,0|2,0,0]=4 2191 B14R1.903 COCCSC1=C(C=CC=C1)C(=O)O MCULE-7151836758 [0,2,0,0,0,0|1,1,0]=4 2192 B14R1.903 N#CCCNC1=CC=CC=C1C(=O)O MCULE-4978968143 [0,2,0,0,0,0|2,0,0]=4 2193 B14R1.903 NCCCOC1=CC=CC=C1C(=O)N MCULE-7651389921 [0,2,0,0,0,0|0,0,0]=2 2194 B14R1.903 NCCCOC1=CC=CC=C1N(=O)=O MCULE-8051585790 [0,2,0,0,0,0|2,0,0]=4 2195 B14R1.903 O=N(=O)C1=C(C=CC=C1)OCCCBr MCULE-3101737521 [0,2,0,0,0,0|2,0,0]=4 2196 B14R1.3302 CC(C#N)NC1=CC=CC=C1C(=O)O MCULE-5185450482 [0,2,0,0,0,0|2,0,0]=4 2197 B14R1.3302 CCC(=O)NC1=C(C=CC=C1)C(=O)N MCULE-6424883380 [0,2,0,0,0,0|1,0,0]=3 2198 B14R1.3302 CCC(=O)NC1=CC=CC=C1C(=O)O MCULE-4894157635 [0,2,0,0,0,0|2,0,0]=4 2199 B14R1.3302 CCC(=O)OC1=CC=CC=C1C(=O)O MCULE-1553940048 [0,2,0,0,0,0|1,0,0]=3 2200 B14R1.3302 CCC(C)OC1=C(C=CC=C1)C(=O)O MCULE-8336729442 [0,2,0,0,0,0|1,0,0]=3 2201 B14R1.3302 CNC(=S)NC1=CC=CC=C1C(=O)N MCULE-3720864511 [0,2,0,0,0,0|1,0,1]=4 2202 B14R1.3302 COC(=O)NC1=C(C=CC=C1)C(=O)N MCULE-2977910621 [0,2,0,0,0,0|1,0,1]=4 2203 B14R1.3302 NC(=O)C1=CC=CC=C1NC(=O)CCl MCULE-4878920317 [0,2,0,0,0,0|1,0,1]=4 2204 B14R1.4432 C=CCOC1=C(C(=CC=C1)F)C(=O)O MCULE-3578050130 [0,2,0,0,0,0|1,0,1]=4 2205 B14R1.4432 C=CCOC1=C(C(=CC=C1)O)C(=O)C MCULE-9678347108 [0,2,0,0,0,0|1,0,1]=4 2206 B14R1.4432 CCCOC1=CC=CC(=C1C(=O)O)C MCULE-5591155140 [0,2,0,0,0,0|1,0,0]=3 2207 B14R1.4432 CCCOC1=CC=CC(=C1N(=O)=O)F MCULE-9235298038 [0,2,0,0,0,0|2,0,0]=4 2208 B14R1.4432 CCCOC1=CC=CC(=C1N(=O)=O)N MCULE-9169302858 [0,2,0,0,0,0|2,0,0]=4 2209 B14R1.4432 COCOC1=C(C(=CC=C1)Br)C(=O)C MCULE-6859781826 [0,2,0,0,0,0|1,0,0]=3 2210 B14R1.4432 COCOC1=CC=CC(=C1C(=O)C)Cl MCULE-8658375206 [0,2,0,0,0,0|1,0,0]=3 2211 B14R1.4432 COCOC1=CC=CC(=C1C(=O)O)Cl MCULE-4890179099 [0,2,0,0,0,0|1,0,0]=3 2212 B14R1.4522 C=C(C)CCC1=CC=CC=C1C(=O)O MCULE-5465546948 [0,2,0,0,0,0|2,0,0]=4 2213 B14R1.4522 C=C(C)COC1=CC=CC=C1C(=O)O MCULE-4644369979 [0,2,0,0,0,0|1,0,0]=3 2214 B14R1.4522 C=C(C)CSC1=CC=CC=C1C(=O)N MCULE-1499441520 [0,2,0,0,0,0|0,1,0]=3 2215 B14R1.4522 CC(=O)C1=C(C=CC=C1)OCC(=O)N MCULE-4548725272 [0,2,0,0,0,0|1,0,1]=4 2216 B14R1.4522 CC(=O)C1=C(C=CC=C1)SCC(C)C MCULE-2050466004 [0,2,0,0,0,0|1,1,0]=4 2217 B14R1.4522 CC(=O)C1=CC=CC=C1OCC(=O)O MCULE-3363266465 [0,2,0,0,0,0|1,0,1]=4 2218 B14R1.4522 CC(=O)C1=CC=CC=C1OCC(C)C MCULE-8993929345 [0,2,0,0,0,0|1,0,0]=3 2219 B14R1.4522 CC(=O)COC1=CC=CC=C1N(=O)=O MCULE-5088899540 [0,2,0,0,0,0|2,0,0]=4 2220 B14R1.4522 CC(=O)CSC1=CC=CC=C1C(=O)O MCULE-6104140904 [0,2,0,0,0,0|1,1,0]=4 2221 B14R1.4522 CC(C)CNC1=CC=CC=C1C(=O)O MCULE-7634559502 [0,2,0,0,0,0|2,0,0]=4 2222 B14R1.4522 CC(C)COC1=C(C=CC=C1)C(=O)O MCULE-5005785928 [0,2,0,0,0,0|1,0,0]=3 2223 B14R1.4522 CC(C)COC1=C(C=CC=N1)C(=O)O MCULE-3140132402 [0,2,0,0,0,0|2,0,0]=4 2224 B14R1.4522 CC(C)COC1=C(C=CN=C1)C(=O)O MCULE-7657471911 [0,2,0,0,0,0|2,0,0]=4 2225 B14R1.4522 CC(C)COC1=CC=CC=C1C(=O)Cl MCULE-1215392458 [0,2,0,0,0,0|1,0,0]=3 2226 B14R1.4522 CC(C)COC1=CC=CC=C1C(=O)N MCULE-6365786250 [0,2,0,0,0,0|0,0,0]=2 2227 B14R1.4522 CC(C)CSC1=CC=CC=C1C(=O)Cl MCULE-2175762884 [0,2,0,0,0,0|1,1,0]=4 2228 B14R1.4522 CC(C)CSC1=CC=CC=C1C(=O)O MCULE-1036927752 [0,2,0,0,0,0|1,1,0]=4 2229 B14R1.4522 CC(C)OCC1=CC=CC=C1C(=O)O MCULE-7047399214 [0,2,0,0,0,0|1,0,0]=3 2230 B14R1.4522 CN(C)CCC1=C(C=CC=C1)C(=O)O MCULE-8810500745 [0,2,0,0,0,0|2,0,0]=4 2231 B14R1.4522 CN(C)CCC1=C(C=CC=C1)C(=O)O MCULE-9463655612 [0,2,0,0,0,0|2,0,0]=4 2232 B14R1.4522 NC(=O)C1=C(C=CC=C1)CCC(=O)O MCULE-2466282902 [0,2,0,0,0,0|1,0,1]=4 2233 B14R1.4522 NC(=O)C1=C(C=CC=C1)NCC(=O)O MCULE-7889488839 [0,2,0,0,0,0|1,0,1]=4 2234 B14R1.4522 NC(=O)C1=C(C=CC=C1)OCC(=O)[O-] MCULE-7247474488 [0,2,0,0,0,0|0,0,1]=3 2235 B14R1.4522 NC(=O)C1=CC=CC=C1CCN(=O)=O MCULE-7251439797 [0,2,0,0,0,0|2,0,0]=4 2236 B14R1.4522 NC(=O)C1=CC=CC=C1OCC(=O)O MCULE-5913894164 [0,2,0,0,0,0|0,0,1]=3 2237 B14R1.4522 NC(=O)COC1=C(C=CC=C1)C(=O)O MCULE-2788333356 [0,2,0,0,0,0|1,0,1]=4 2238 B14R1.4522 O=C(O)C1=C(C=CC=N1)OCC(F)F MCULE-3867833428 [0,2,0,0,0,0|2,0,0]=4 2239 B14R1.4522 O=C(O)C1=C(N=CC=C1)OCC(F)F MCULE-1656970202 [0,2,0,0,0,0|2,0,0]=4 2240 B14R1.4522 O=C(O)COC1=C(C=CC=C1)C(=O)O MCULE-9315481619 [0,2,0,0,0,0|1,0,1]=4 2241 B14R1.4522 O=N(=O)C1=CC=CC=C1OCC(F)F MCULE-2365570394 [0,2,0,0,0,0|2,0,0]=4 2242 B14R1.7480 C=CCOC1=C(C=CC=C1C(=O)O)C MCULE-4915285706 [0,2,0,0,0,0|1,0,1]=4 2243 B14R1.7480 CCCOC1=C(C=CC=C1C(=O)C)Br MCULE-6810252961 [0,2,0,0,0,0|1,0,0]=3 2244 B14R1.7480 CCCOC1=C(C=CC=C1C(=O)C)C MCULE-5877623569 [0,2,0,0,0,0|1,0,0]=3 2245 B14R1.7480 CCCOC1=C(C=CC=C1C(=O)C)Cl MCULE-6394006721 [0,2,0,0,0,0|1,0,0]=3 2246 B14R1.7480 CCCOC1=C(C=CC=C1C(=O)N)N MCULE-6152849684 [0,2,0,0,0,0|0,0,0]=2 2247 B14R1.7480 CCCOC1=C(C=CC=C1C(=O)O)Br MCULE-1467108344 [0,2,0,0,0,0|1,0,0]=3 2248 B14R1.7480 CCCOC1=C(C=CC=C1C(=O)O)C MCULE-4499944250 [0,2,0,0,0,0|1,0,0]=3 2249 B14R1.7480 CCCOC1=C(C=CC=C1C(C)N)Br MCULE-2742083411 [0,2,0,0,0,0|1,0,1]=4 2250 B14R1.7480 CCCOC1=C(C=CC=C1C(C)N)Br MCULE-6113009633 [0,2,0,0,0,0|1,0,1]=4 2251 B14R1.7480 CCCOC1=C(C=CC=C1C(C)N)Cl MCULE-1101080206 [0,2,0,0,0,0|1,0,1]=4 2252 B14R1.7480 CCCOC1=C(C=CC=C1C(C)N)Cl MCULE-7269191932 [0,2,0,0,0,0|1,0,1]=4 2253 B14R1.7480 COCOC1=C(C=CN=C1F)C(=O)O MCULE-8663178673 [0,2,0,0,0,0|2,0,0]=4 2254 B14R1.7480 NCCNC1=C(C=CC=C1N)C(=O)O MCULE-3408616904 [0,2,0,0,0,0|2,0,0]=4 2255 B14R1.7480 NCCOC1=C(C=CC=C1Br)N(=O)=O MCULE-5712215905 [0,2,0,0,0,0|2,0,0]=4 2256 B14R1.7480 NCCOC1=C(C=CC=C1Br)N(=O)=O MCULE-6881688688 [0,2,0,0,0,0|2,0,0]=4 2257 B14R1.4894 CC(=O)C1=CC=CC(=C1OC(C)C)Br MCULE-1723748138 [0,2,0,0,0,0|1,0,0]=3 2258 B14R1.4894 CC(=O)C1=CC=CC(=C1OC(C)C)C MCULE-5206167224 [0,2,0,0,0,0|1,0,0]=3 2259 B14R1.4894 CC(=O)C1=CC=CC(=C1OC(C)C)Cl MCULE-5623820296 [0,2,0,0,0,0|1,0,0]=3 2260 B14R1.4894 CC(=O)OC1=C(C=CC=C1C(=O)O)C MCULE-6533937024 [0,2,0,0,0,0|1,0,1]=4 2261 B14R1.4894 CC(C)NC1=C(C=CC=C1Cl)C(=O)O MCULE-4934933101 [0,2,0,0,0,0|2,0,0]=4 2262 B14R1.4894 CC(C)NC1=C(C=CC=C1F)C(=O)O MCULE-6912358802 [0,2,0,0,0,0|2,0,0]=4 2263 B14R1.4894 CC(C)OC1=C(C=CC=C1C(=O)O)Br MCULE-3676404796 [0,2,0,0,0,0|1,0,0]=3 2264 B14R1.4894 CC(C)OC1=C(C=CC=C1C(C)N)Cl MCULE-1722776352 [0,2,0,0,0,0|1,0,1]=4 2265 B14R1.4894 CC(C)OC1=C(C=CC=C1C(C)N)Cl MCULE-2811929694 [0,2,0,0,0,0|1,0,1]=4 2266 B14R1.4894 CC(C)OC1=C(C=CC=C1C(C)N)F MCULE-2200428226 [0,2,0,0,0,0|1,0,1]=4 2267 B14R1.4894 CC(C)OC1=C(C=CC=C1C(C)N)F MCULE-7530731003 [0,2,0,0,0,0|1,0,1]=4 2268 B14R1.4894 CC(C)OC1=C(C=CC=C1Cl)C(=O)O MCULE-3773755065 [0,2,0,0,0,0|1,0,0]=3 2269 B14R1.4894 CC(C)OC1=C(C=CC=C1F)C(=O)O MCULE-3276537468 [0,2,0,0,0,0|1,0,0]=3 2270 B14R1.4894 CC(C)OC1=C(C=CC=C1F)N(=O)=O MCULE-4062159616 [0,2,0,0,0,0|2,0,0]=4 2271 B14R1.4894 CC(C)OC1=C(C=CC=C1N(=O)=O)Br MCULE-4449663942 [0,2,0,0,0,0|2,0,0]=4 2272 B14R1.4894 CC(C)OC1=C(C=CC=C1N)C(=O)N MCULE-4609414741 [0,2,0,0,0,0|0,0,0]=2 2273 B14R1.4894 CC(C)OC1=C(C=CC=C1N)C(=O)O MCULE-1416413319 [0,2,0,0,0,0|1,0,0]=3 2274 B14R1.4894 CC(C)OC1=C(C=CC=C1N)C(=O)O MCULE-2002309868 [0,2,0,0,0,0|1,0,0]=3 2275 B14R1.4894 CC1=CC=CC(=C1CC(C)C)C(=O)O MCULE-6217913606 [0,2,0,0,0,0|2,0,0]=4 2276 B14R1.4894 NC(=O)C1=C(C(=CC=C1)N)OC(F)F MCULE-3564523389 [0,2,0,0,0,0|1,0,0]=3 2277 B14R1.4894 O=C(O)C1=C(C(=CC=C1)Br)OC(F)F MCULE-3866836249 [0,2,0,0,0,0|2,0,0]=4 2278 B14R1.4894 O=C(O)C1=CC=CC(=C1OC(F)F)F MCULE-3932126279 [0,2,0,0,0,0|2,0,0]=4 2279 B14R1.4926 CC(=O)C1=C(C=CC=C1F)OC(F)F MCULE-8311374223 [0,2,0,0,0,0|2,0,0]=4 2280 B14R1.4926 CC(=O)OC1=C(C(=CC=C1)C)C(=O)O MCULE-6695004571 [0,2,0,0,0,0|1,0,1]=4 2281 B14R1.4926 CC(C)NC1=CC=CC(=C1C(=O)O)Cl MCULE-6373403776 [0,2,0,0,0,0|2,0,0]=4 2282 B14R1.4926 CC(C)OC1=C(C(=CC=C1)Br)C(=O)N MCULE-9667834310 [0,2,0,0,0,0|0,0,0]=2 2283 B14R1.4926 CC(C)OC1=C(C(=CC=C1)Br)N(=O)=O MCULE-2276912308 [0,2,0,0,0,0|2,0,0]=4 2284 B14R1.4926 CC(C)OC1=C(C(=CC=C1)Cl)C(=O)O MCULE-7925123814 [0,2,0,0,0,0|1,0,0]=3 2285 B14R1.4926 CC(C)OC1=C(C(=CC=C1)F)C(=O)O MCULE-4273829174 [0,2,0,0,0,0|1,0,0]=3 2286 B14R1.4926 CC(C)OC1=C(C(=CC=C1)F)N(=O)=O MCULE-5711404092 [0,2,0,0,0,0|2,0,0]=4 2287 B14R1.4926 CC1=C(C(=CC=C1)OC(C)C)C(=O)O MCULE-7442685627 [0,2,0,0,0,0|1,0,0]=3 2288 B14R1.4926 CC1=C(C(=CC=C1)OC(C)C)N(=O)=O MCULE-6541440753 [0,2,0,0,0,0|2,0,0]=4 2289 B14R1.4926 NC(=S)C1=C(C=CC=C1F)OC(F)F MCULE-9198896112 [0,2,0,0,0,0|1,1,0]=4 2290 B14R1.4926 NC1=C(C(=CC=C1)OC(F)F)C(=O)O MCULE-1402634572 [0,2,0,0,0,0|2,0,0]=4 2291 B14R1.4926 O=C(O)C1=C(C=CC=C1Cl)OC(F)F MCULE-7409717924 [0,2,0,0,0,0|2,0,0]=4 2292 B14R1.4926 O=C(O)C1=C(C=CC=C1F)OC(F)F MCULE-3552104855 [0,2,0,0,0,0|2,0,0]=4 2293 B14R1.6312 CC(=O)C1=C(C=CC=C1)OC(F)(F)F MCULE-6931575539 [0,2,0,0,0,0|2,0,0]=4 2294 B14R1.6312 CC(=O)C1=C(C=CC=C1)SC(C)(C)C MCULE-4206628936 [0,2,0,0,0,0|1,1,0]=4 2295 B14R1.6312 CC(C)(C)CC1=C(C=CC=C1)C(=O)O MCULE-4509910397 [0,2,0,0,0,0|2,0,0]=4 2296 B14R1.6312 CC(C)(C)OC1=C(C=CC=C1)C(=O)O MCULE-8057528367 [0,2,0,0,0,0|1,0,0]=3 2297 B14R1.6312 CC(C)(C)OC1=C(C=CC=C1)N(=O)=O MCULE-3395505746 [0,2,0,0,0,0|2,0,0]=4 2298 B14R1.6312 CC(C)(C)OC1=CC=CC=C1C(=O)N MCULE-5621593408 [0,2,0,0,0,0|0,0,0]=2 2299 B14R1.6312 CC(C)(C)SC1=C(C=CC=C1)C(=O)O MCULE-7579239549 [0,2,0,0,0,0|1,1,0]=4 2300 B14R1.6312 CS(=O)(=O)NC1=CC=CC=C1C(=O)N MCULE-4403665822 [0,2,0,0,0,0|2,0,0]=4 2301 B14R1.6312 N=C(N)C1=CC=CC=C1OC(F)(F)F MCULE-1095157291 [0,2,0,0,0,0|2,0,0]=4 2302 B14R1.6312 N=C(N)C1=CC=CC=C1OC(F)(F)F MCULE-7577714613 [0,2,0,0,0,0|2,0,0]=4 2303 B14R1.6312 NC(=O)C1=C(C=CC=C1)OC(F)(F)F MCULE-5783525334 [0,2,0,0,0,0|1,0,0]=3 2304 B14R1.6312 NC(=S)C1=C(C=CC=C1)OC(F)(F)F MCULE-3233990203 [0,2,0,0,0,0|1,1,0]=4 2305 B14R1.6312 O=C(Cl)C1=CC=CC=C1OC(F)(F)F MCULE-5265625311 [0,2,0,0,0,0|2,0,0]=4 2306 B14R1.6312 O=C(O)C1=C(C=CC=C1)OC(F)(F)F MCULE-3664743205 [0,2,0,0,0,0|2,0,0]=4 2307 B14R1.5136 CCOC1=C(C(=CC=C1Br)F)N(=O)=O MCULE-3155931492 [0,2,0,0,0,0|2,0,0]=4 2308 B14R1.5136 CCOC1=C(C(=CC=C1F)Br)N(=O)=O MCULE-5899435340 [0,2,0,0,0,0|2,0,0]=4 2309 B14R1.5136 CCOC1=C(C=CC(=C1C(=O)O)F)Br MCULE-7977446759 [0,2,0,0,0,0|1,0,0]=3 2310 B14R1.5136 CCOC1=C(C=CC(=C1C(=O)O)F)Cl MCULE-4426973250 [0,2,0,0,0,0|1,0,0]=3 2311 B14R1.5565 CCNC1=CC=CC(=C1C(=O)O)OC MCULE-9464248749 [0,2,0,0,0,0|2,0,0]=4 2312 B14R1.3100 CCNC1=C(C=CC=C1C(=O)O)OC MCULE-5206670302 [0,2,0,0,0,0|2,0,0]=4 2313 B14R1.3100 CCOC1=C(C=CC=C1C(=O)Cl)OC MCULE-9682063831 [0,2,0,0,0,0|1,0,0]=3 2314 B14R1.3100 CCOC1=C(C=CC=C1C(=O)N)OC MCULE-1206410189 [0,2,0,0,0,0|0,0,0]=2 2315 B14R1.3100 CCOC1=C(C=CC=C1C(=O)O)OC MCULE-5378339846 [0,2,0,0,0,0|1,0,0]=3 2316 B14R1.3100 CCOC1=C(C=CC=C1OC)C(=O)C MCULE-3629938185 [0,2,0,0,0,0|1,0,0]=3 2317 B14R1.3100 CCOC1=C(C=CC=C1SC)C(=O)O MCULE-3201007382 [0,2,0,0,0,0|1,0,0]=3 2318 B12R1.56 CCC1=C(C=CC(=C1)C(=O)N)Cl MCULE-1548718478 [0,0,1,1,0,0|2,0,0]=4 2319 B12R1.41 C=CC1=CC(=CC(=C1)Cl)OCC MCULE-7585114733 [0,0,1,1,0,0|2,0,0]=4 2320 B12R1.41 C=CC1=CC(=CC(=C1)OCC)C MCULE-1174105302 [0,0,1,1,0,0|2,0,0]=4 2321 B12R1.308 CCOC(=N)C1=CC=CNC1=O MCULE-2939659138 [0,0,1,1,0,0|1,0,0]=3 2322 B12R1.308 CCOC(=N)C1=CC=CNC1=O MCULE-6159928561 [0,0,1,1,0,0|1,0,0]=3 2323 B12R1.308 CCOC(=O)C1=CC=CC=C1N MCULE-5019508143 [0,0,1,1,0,0|2,0,0]=4 2324 B12R1.308 CCOC(=O)C1=CC=CN=C1N MCULE-1324969879 [0,0,1,1,0,0|2,0,0]=4 2325 B12R1.308 CCOC(=O)C1=CN=CNC1=O MCULE-6774569622 [0,0,1,1,0,0|2,0,0]=4 2326 B12R1.125 CC1=C(C=CC=C1)C=CC(=O)N MCULE-6358361236 [0,0,1,1,0,0|1,0,1]=4 2327 B12R2.1 CCC1NCC2=C1C=CC=C2 MCULE-2239427161 [1,0,0,1,0,0|1,0,1]=4 2328 B12R2.1 CCC1NCC2=C1C=CC=C2 MCULE-6033125468 [1,0,0,1,0,0|1,0,1]=4 2329 B12R2.1 CCN1C=CC2=CC=CC=C12 MCULE-5956374216 [1,0,0,1,0,0|2,0,0]=4 2330 B12R2.18 CC1=C(C2=C(N1)C=CC=C2)N MCULE-6344323791 [1,0,0,1,0,0|1,0,1]=4 2331 B12R2.18 CC1=C(C2=C(N1)C=CC=C2)N MCULE-8198798846 [1,0,0,1,0,0|1,0,1]=4 2332 B12R2.18 CC1=C(C2=C(O1)C=CC=C2)C MCULE-4244356791 [1,0,0,1,0,0|1,0,1]=4 2333 B12R2.18 CC1=C(C2=CC=CC=C2O1)Br MCULE-4889039117 [1,0,0,1,0,0|1,0,1]=4 2334 B12R2.18 CC1CC2=C(C1=O)C=CC=C2 MCULE-4536479695 [1,0,0,1,0,0|1,0,0]=3 2335 B12R2.18 CC1CC2=C(C1N)C=CC=C2 MCULE-3453002777 [1,0,0,1,0,0|1,0,1]=4 2336 B12R2.18 CC1CC2=C(C1N)C=CC=C2 MCULE-7110136827 [1,0,0,1,0,0|1,0,1]=4 2337 B12R2.18 CC1CC2=C(N1N)C=CC=C2 MCULE-1591766825 [1,0,0,1,0,0|2,0,0]=4 2338 B12R2.18 CC1CC2=C(N1N)C=CC=C2 MCULE-7312179055 [1,0,0,1,0,0|2,0,0]=4 2339 B12R2.18 CC1OC2=C(C1N)C=CC=C2 MCULE-3094869624 [1,0,0,1,0,0|0,0,1]=3 2340 B12R2.18 CC1OC2=C(C1N)C=CC=C2 MCULE-6186551526 [1,0,0,1,0,0|0,0,1]=3 2341 B12R2.18 CC1OC2=CC=CN=C2C1=O MCULE-1614882079 [1,0,0,1,0,0|1,0,0]=3 2342 B12R2.18 CN1CC2=CC=CC=C2C1=O MCULE-4831369773 [1,0,0,1,0,0|2,0,0]=4 2343 B12R2.18 CN1N=C2C=CC=CC2=C1N MCULE-1782873754 [1,0,0,1,0,0|2,0,0]=4 2344 B12R2.18 CN1NC2=C(C1=O)C=CC=C2 MCULE-6010784439 [1,0,0,1,0,0|2,0,0]=4 2345 B12R2.18 CN1SC2=C(C1=O)C=CC=C2 MCULE-4125998377 [1,0,0,1,0,0|1,1,0]=4 2346 B12R2.18 NC1CC2=C(C1=O)C=CC=C2 MCULE-3518320199 [1,0,0,1,0,0|2,0,0]=4 2347 B12R2.18 NC1CC2=C(C1=O)C=CC=C2 MCULE-7056946009 [1,0,0,1,0,0|2,0,0]=4 2348 B12R2.18 NC1NC2=CC=CC=C2C1=O MCULE-6031674314 [1,0,0,1,0,0|2,0,0]=4 2349 B12R2.18 NC1NC2=CC=CC=C2C1=O MCULE-9512470343 [1,0,0,1,0,0|2,0,0]=4 2350 B12R2.18 O=C1C2=C(C=CC=C2)CC1Br MCULE-6932921877 [1,0,0,1,0,0|2,0,0]=4 2351 B12R2.18 O=C1C2=C(C=CC=C2)CC1Cl MCULE-3734715722 [1,0,0,1,0,0|2,0,0]=4 2352 B12R2.18 O=C1OC2=CC=CC=C2C1=O MCULE-4719196777 [1,0,0,1,0,0|1,0,1]=4 2353 B12R2.24 CC1CC2=C(C=CC=C2)CN1 MCULE-3517571472 [1,0,0,1,0,0|1,0,1]=4 2354 B12R2.24 CC1CNC2=C(O1)C=CC=C2 MCULE-5579308518 [1,0,0,1,0,0|2,0,0]=4 2355 B12R2.24 CC1CNC2=CC=CC=C2O1 MCULE-7000344526 [1,0,0,1,0,0|2,0,0]=4 2356 B12R2.24 C[C@@H]1CC2=C(C=CC=C2)CN1 MCULE-2854633516 [1,0,0,1,0,0|1,0,1]=4 2357 B12R2.24 C[C@@H]1CC2=CC=CC=C2C=N1 MCULE-4144767549 [1,0,0,1,0,0|1,0,1]=4 2358 B12R2.24 C[C@H]1CC2=CC=CC=C2CN1 MCULE-4850187575 [1,0,0,1,0,0|1,0,1]=4 2359 B12R2.24 OC1C=CC2=CC=CC=C2O1 MCULE-9142365399 [1,0,0,1,0,0|2,0,0]=4 2360 B12R2.41 C1=CC2=C(C=C1)CNCCC2 MCULE-2809792553 [1,0,0,1,0,0|1,0,1]=4 2361 B12R2.41 C1=CC2=C(C=C1)CNCCC2 MCULE-5522148577 [1,0,0,1,0,0|1,0,1]=4 2362 B12R2.41 C1=CC2=C(C=C1)NCCC=C2 MCULE-5316015753 [1,0,0,1,0,0|2,0,0]=4 2363 B12R2.41 C1=CC2=C(C=C1)NCCC=C2 MCULE-6841812801 [1,0,0,1,0,0|2,0,0]=4 2364 B12R2.41 C1=CC2=C(C=C1)NCCNC2 MCULE-3689700197 [1,0,0,1,0,0|1,0,1]=4 2365 B12R2.41 C1=CC2=C(C=C1)OCCCN2 MCULE-2058452145 [1,0,0,1,0,0|2,0,0]=4 2366 B12R2.41 C1=CC2=C(C=C1)OCCCO2 MCULE-2178861428 [1,0,0,1,0,0|2,0,0]=4 2367 B12R2.41 C1=CC2=C(C=C1)OCCNC2 MCULE-4987146186 [1,0,0,1,0,0|0,0,1]=3 2368 B12R2.41 C1=CC2=C(C=C1)OCCNC2 MCULE-5318591987 [1,0,0,1,0,0|0,0,1]=3 2369 B12R2.41 C1=CC2=C(C=C1)SCCNC2 MCULE-5811736707 [1,0,0,1,0,0|0,1,1]=4 2370 B12R2.41 C1=CC2=C(CNCCO2)N=C1 MCULE-8443985352 [1,0,0,1,0,0|1,0,1]=4 2371 B12R2.41 C1=CC2=C(N=C1)OCCNC2 MCULE-7401766856 [1,0,0,1,0,0|1,0,1]=4 2372 B12R2.41 C1=CC2=C(N=C1)OCCNC2 MCULE-9639911263 [1,0,0,1,0,0|1,0,1]=4 2373 B12R2.41 C1=CC=C2CCCC=CC2=C1 MCULE-3060031941 [1,0,0,1,0,0|2,0,0]=4 2374 B12R2.41 C1=CC=C2NCCNCC2=C1 MCULE-9804203802 [1,0,0,1,0,0|1,0,1]=4 2375 B12R2.41 C1=CC=C2OCCC=CC2=C1 MCULE-5338466697 [1,0,0,1,0,0|1,0,0]=3 2376 B12R2.41 C1=CC=C2OCCCNC2=C1 MCULE-8314577106 [1,0,0,1,0,0|2,0,0]=4 2377 B12R2.41 C1=CC=C2SCCNCC2=C1 MCULE-5847497872 [1,0,0,1,0,0|0,1,1]=4 2378 B12R2.41 C1=CN=C2OCCNCC2=C1 MCULE-5593386516 [1,0,0,1,0,0|1,0,1]=4 2379 B12R2.315 C#CC1=C2OCCC2=CC=C1 MCULE-9684102231 [1,0,0,1,0,0|1,0,1]=4 2380 B12R2.315 NCC1=C2CCCC2=CC=C1 MCULE-9808199801 [1,0,0,1,0,0|1,0,1]=4 2381 B12R2.315 NCC1=C2NCCC2=CC=C1 MCULE-2276051213 [1,0,0,1,0,0|1,0,1]=4 2382 B12R2.315 NCC1=C2OCCC2=CC=C1 MCULE-3940404762 [1,0,0,1,0,0|0,0,1]=3 2383 B12R2.315 NCC1=C2OCOC2=CC=C1 MCULE-6634227394 [1,0,0,1,0,0|1,0,1]=4 2384 B12R2.315 NCC1=CC=CC2=C1NCC2 MCULE-2539064766 [1,0,0,1,0,0|1,0,1]=4 2385 B12R2.315 NCC1=CC=CC2=C1OCC2 MCULE-5437418097 [1,0,0,1,0,0|0,0,1]=3 2386 B12R2.315 NNC1=C2CCCC2=CC=C1 MCULE-7702622471 [1,0,0,1,0,0|2,0,0]=4 2387 B12R2.315 O=CC1=C2CCOC2=CC=C1 MCULE-6791984998 [1,0,0,1,0,0|2,0,0]=4 2388 B12R2.315 O=CC1=C2OC=CC2=CC=C1 MCULE-6684020942 [1,0,0,1,0,0|0,0,2]=4 2389 B12R2.315 O=CC1=C2OCCC2=CC=C1 MCULE-4078206787 [1,0,0,1,0,0|0,0,0]=2 2390 B12R2.315 O=CC1=CC=CC2=C1CCC2 MCULE-3723039789 [1,0,0,1,0,0|1,0,0]=3 2391 B12R2.315 O=CC1=CC=CC2=C1COC2 MCULE-8970334389 [1,0,0,1,0,0|2,0,0]=4 2392 B12R2.315 O=CC1=CC=CC2=C1NCC2 MCULE-4429078155 [1,0,0,1,0,0|1,0,0]=3 2393 B12R2.315 O=CC1=CC=CC2=C1OC=N2 MCULE-3066842129 [1,0,0,1,0,0|1,0,1]=4 2394 B12R2.315 O=CC1=CC=CC2=C1OCO2 MCULE-7838832056 [1,0,0,1,0,0|1,0,0]=3 2395 B12R2.315 OCC1=CC=CC2=C1OCC2 MCULE-9963597441 [1,0,0,1,0,0|0,0,2]=4 2396 B12R2.1081 C=C1CCOC2=CC=CN=C12 MCULE-3181398200 [1,0,0,1,0,0|2,0,0]=4 2397 B12R2.1081 CN1CCOC2=CC=CC=C12 MCULE-3812742227 [1,0,0,1,0,0|2,0,0]=4 2398 B12R2.1081 ClC1CCOC2=C1C=CC=C2 MCULE-7587975442 [1,0,0,1,0,0|1,0,1]=4 2399 B12R2.1081 NC1CCCC2=C1C=CC=C2 MCULE-1373444810 [1,0,0,1,0,0|1,0,1]=4 2400 B12R2.1081 NC1CCCC2=C1C=CC=C2 MCULE-1432413466 [1,0,0,1,0,0|1,0,1]=4 2401 B12R2.1081 NC1CCCC2=C1C=CC=C2 MCULE-4202514744 [1,0,0,1,0,0|1,0,1]=4 2402 B12R2.1081 NC1CCCC2=CC=CC=C12 MCULE-1989500377 [1,0,0,1,0,0|1,0,1]=4 2403 B12R2.1081 NC1CCNC2=C1C=CC=C2 MCULE-4431837873 [1,0,0,1,0,0|1,0,1]=4 2404 B12R2.1081 NC1CCNC2=C1C=CC=C2 MCULE-4573262140 [1,0,0,1,0,0|1,0,1]=4 2405 B12R2.1081 NC1CCOC2=C1C=CC=C2 MCULE-1879317839 [1,0,0,1,0,0|0,0,1]=3 2406 B12R2.1081 NC1CCOC2=C1C=CC=C2 MCULE-3755106097 [1,0,0,1,0,0|0,0,1]=3 2407 B12R2.1081 NC1CCOC2=C1C=CC=C2 MCULE-4243407071 [1,0,0,1,0,0|0,0,1]=3 2408 B12R2.1081 NC1CCOC2=C1C=CC=N2 MCULE-6463966729 [1,0,0,1,0,0|1,0,1]=4 2409 B12R2.1081 NC1CCOC2=C1C=CC=N2 MCULE-7858826675 [1,0,0,1,0,0|1,0,1]=4 2410 B12R2.1081 NC1CCOC2=CC=CC=C12 MCULE-7397756795 [1,0,0,1,0,0|0,0,1]=3 2411 B12R2.1081 NC1CCOC2=CC=CN=C12 MCULE-9592017983 [1,0,0,1,0,0|1,0,1]=4 2412 B12R2.1081 NC1CCOC2=CC=CN=C12 MCULE-9751648422 [1,0,0,1,0,0|1,0,1]=4 2413 B12R2.1081 NC1CCSC2=C1C=CC=C2 MCULE-6075573567 [1,0,0,1,0,0|0,1,1]=4 2414 B12R2.1081 NC1CCSC2=CC=CC=C12 MCULE-4015817028 [1,0,0,1,0,0|0,1,1]=4 2415 B12R2.1081 NN1CCCC2=C1C=CC=C2 MCULE-8763428272 [1,0,0,1,0,0|2,0,0]=4 2416 B12R2.1081 NN1CCCC2=CC=CC=C12 MCULE-6937224400 [1,0,0,1,0,0|2,0,0]=4 2417 B12R2.1081 NN1CCOC2=CC=CC=C12 MCULE-1366431304 [1,0,0,1,0,0|1,0,0]=3 2418 B12R2.1081 N[C@@H]1CCCC2=C1C=CC=C2 MCULE-2619905193 [1,0,0,1,0,0|1,0,1]=4 2419 B12R2.1081 N[C@@H]1CCCC2=C1C=CC=C2 MCULE-6302305033 [1,0,0,1,0,0|1,0,1]=4 2420 B12R2.1081 N[C@@H]1CCCC2=C1C=CC=C2 MCULE-7720105858 [1,0,0,1,0,0|1,0,1]=4 2421 B12R2.1081 N[C@@H]1CCCC2=C1C=CC=C2 MCULE-9388980726 [1,0,0,1,0,0|1,0,1]=4 2422 B12R2.1081 N[C@@H]1CCNC2=C1C=CC=C2 MCULE-6163106812 [1,0,0,1,0,0|1,0,1]=4 2423 B12R2.1081 N[C@@H]1CCNC2=CC=CC=C12 MCULE-4795227060 [1,0,0,1,0,0|1,0,1]=4 2424 B12R2.1081 N[C@@H]1CCOC2=C1C=CC=C2 MCULE-1220913609 [1,0,0,1,0,0|0,0,1]=3 2425 B12R2.1081 N[C@@H]1CCOC2=C1C=CC=C2 MCULE-4830341176 [1,0,0,1,0,0|0,0,1]=3 2426 B12R2.1081 N[C@@H]1CCOC2=C1C=CC=C2 MCULE-9794866624 [1,0,0,1,0,0|0,0,1]=3 2427 B12R2.1081 N[C@@H]1CCOC2=CC=CC=C12 MCULE-7458449448 [1,0,0,1,0,0|0,0,1]=3 2428 B12R2.1081 N[C@@H]1CCSC2=C1C=CC=C2 MCULE-7595834947 [1,0,0,1,0,0|0,1,1]=4 2429 B12R2.1081 N[C@@H]1CCSC2=CC=CC=C12 MCULE-3241226906 [1,0,0,1,0,0|0,1,1]=4 2430 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 MCULE-5370569981 [1,0,0,1,0,0|1,0,1]=4 2431 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 MCULE-5931482269 [1,0,0,1,0,0|1,0,1]=4 2432 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 MCULE-9969058037 [1,0,0,1,0,0|1,0,1]=4 2433 B12R2.1081 N[C@H]1CCNC2=C1C=CC=C2 MCULE-5811200304 [1,0,0,1,0,0|1,0,1]=4 2434 B12R2.1081 N[C@H]1CCNC2=C1C=CC=C2 MCULE-8103340583 [1,0,0,1,0,0|1,0,1]=4 2435 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 MCULE-6409151806 [1,0,0,1,0,0|0,0,1]=3 2436 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 MCULE-6835939319 [1,0,0,1,0,0|0,0,1]=3 2437 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 MCULE-8240047181 [1,0,0,1,0,0|0,0,1]=3 2438 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 MCULE-9474396866 [1,0,0,1,0,0|0,0,1]=3 2439 B12R2.1081 N[C@H]1CCSC2=CC=CC=C12 MCULE-2427125271 [1,0,0,1,0,0|0,1,1]=4 2440 B12R2.1081 O=C1C=COC2=C1C=CC=C2 MCULE-8366757644 [1,0,0,1,0,0|0,0,2]=4 2441 B12R2.1081 O=C1CC=CC2=C1C=CC=C2 MCULE-2736945449 [1,0,0,1,0,0|1,0,1]=4 2442 B12R2.1081 O=C1CCCC2=C1C=CC=C2 MCULE-2380271774 [1,0,0,1,0,0|1,0,0]=3 2443 B12R2.1081 O=C1CCCC2=C1C=CC=N2 MCULE-3669354189 [1,0,0,1,0,0|2,0,0]=4 2444 B12R2.1081 O=C1CCCC2=C1C=CC=N2 MCULE-8574932429 [1,0,0,1,0,0|2,0,0]=4 2445 B12R2.1081 O=C1CCCC2=C1C=CN=C2 MCULE-8162585379 [1,0,0,1,0,0|2,0,0]=4 2446 B12R2.1081 O=C1CCCC2=C1C=CN=C2 MCULE-8827218829 [1,0,0,1,0,0|2,0,0]=4 2447 B12R2.1081 O=C1CCCC2=C1C=NC=C2 MCULE-8587602235 [1,0,0,1,0,0|2,0,0]=4 2448 B12R2.1081 O=C1CCCC2=C1C=NC=C2 MCULE-9954340755 [1,0,0,1,0,0|2,0,0]=4 2449 B12R2.1081 O=C1CCCC2=C1N=CC=C2 MCULE-1742173436 [1,0,0,1,0,0|2,0,0]=4 2450 B12R2.1081 O=C1CCC[N+]2=C1C=CC=C2 MCULE-3855733387 [1,0,0,1,0,0|2,0,0]=4 2451 B12R2.1081 O=C1CCC[N+]2=C1C=CC=C2 MCULE-8078818427 [1,0,0,1,0,0|2,0,0]=4 2452 B12R2.1081 O=C1CCNC2=C1C=CC=C2 MCULE-6874913958 [1,0,0,1,0,0|1,0,0]=3 2453 B12R2.1081 O=C1CCNC2=C1C=CC=C2 MCULE-9148857143 [1,0,0,1,0,0|1,0,0]=3 2454 B12R2.1081 O=C1CCNC2=C1C=CC=N2 MCULE-9447020562 [1,0,0,1,0,0|2,0,0]=4 2455 B12R2.1081 O=C1CCOC2=C1C=CC=C2 MCULE-6543223040 [1,0,0,1,0,0|0,0,0]=2 2456 B12R2.1081 O=C1CCOC2=C1C=CC=N2 MCULE-5191959155 [1,0,0,1,0,0|1,0,0]=3 2457 B12R2.1081 O=C1CCOC2=C1C=NC=C2 MCULE-7258696278 [1,0,0,1,0,0|1,0,0]=3 2458 B12R2.1081 O=C1CCOC2=CC=CN=C12 MCULE-6848820928 [1,0,0,1,0,0|1,0,0]=3 2459 B12R2.1081 O=C1CCSC2=C1C=CC=C2 MCULE-9214172614 [1,0,0,1,0,0|0,1,0]=3 2460 B12R2.1081 O=C1CNCC2=C1C=CC=C2 MCULE-2082833379 [1,0,0,1,0,0|2,0,0]=4 2461 B12R2.1081 O=C1CNCC2=C1C=CC=C2 MCULE-3912097622 [1,0,0,1,0,0|2,0,0]=4 2462 B12R2.1081 O=C1CNNC2=C1C=CC=C2 MCULE-1558657443 [1,0,0,1,0,0|2,0,0]=4 2463 B12R2.1081 O=C1CNNC2=C1C=CC=C2 MCULE-6756371907 [1,0,0,1,0,0|2,0,0]=4 2464 B12R2.1081 O=C1COCC2=C1C=CC=C2 MCULE-7243952851 [1,0,0,1,0,0|2,0,0]=4 2465 B12R2.1081 O=C1CSCC2=C1C=CC=C2 MCULE-7872695109 [1,0,0,1,0,0|2,0,0]=4 2466 B12R2.1081 O=C1NCCC2=C1C=CC=C2 MCULE-1919291381 [1,0,0,1,0,0|2,0,0]=4 2467 B12R2.1081 O=C1OCCC2=CC=CC=C12 MCULE-7728820052 [1,0,0,1,0,0|2,0,0]=4 2468 B12R2.1081 O=S1CCNC2=C1C=CC=C2 MCULE-7750457936 [1,0,0,1,0,0|2,0,0]=4 2469 B12R2.1081 OC1CCOC2=C1C=CC=C2 MCULE-4768713856 [1,0,0,1,0,0|0,0,2]=4 2470 B12R2.1081 O[C@@H]1CCOC2=C1C=CC=C2 MCULE-9892478702 [1,0,0,1,0,0|0,0,2]=4 2471 B12R2.1081 O[C@H]1CCOC2=C1C=CC=C2 MCULE-4780909675 [1,0,0,1,0,0|0,0,2]=4 2472 B12R2.1081 SC1CCOC2=C1C=CC=C2 MCULE-4758589396 [1,0,0,1,0,0|0,1,1]=4 2473 B12R2.2048 NCC1=CC=CC=C1C2CC2 MCULE-3324300648 [1,0,0,1,0,0|1,0,1]=4 2474 B12R2.2048 NCC1=CC=CC=C1C2CC2 MCULE-6670307278 [1,0,0,1,0,0|1,0,1]=4 2475 B12R2.2048 O=CC1=C(C=CC=C1)C2CC2 MCULE-3154219838 [1,0,0,1,0,0|1,0,0]=3 2476 B12R2.2048 O=CC1=C(N=CC=C1)C2CC2 MCULE-1734097255 [1,0,0,1,0,0|2,0,0]=4 2477 B12R2.2048 O=CC1=CC=NC=C1C2CC2 MCULE-6394788801 [1,0,0,1,0,0|2,0,0]=4 2478 B12R2.2048 O=CC1=NC=CC=C1C2CC2 MCULE-2606280490 [1,0,0,1,0,0|2,0,0]=4 2479 B12R2.1806 COC1=C2C(=O)CC2=CC=C1 MCULE-6480735292 [1,0,0,1,0,0|1,0,0]=3 2480 B12R2.2028 C=C1NC(=O)C2=C1C=CC=C2 MCULE-4826251840 [1,0,0,1,0,0|0,0,2]=4 2481 B12R2.2028 CC1CC(=O)C2=C1C=CC=C2 MCULE-9165366396 [1,0,0,1,0,0|1,0,0]=3 2482 B12R2.2028 CC1CC(C2=C1C=CC=C2)N MCULE-1822815088 [1,0,0,1,0,0|1,0,1]=4 2483 B12R2.2028 CC1CC(C2=C1C=CC=C2)N MCULE-4257682972 [1,0,0,1,0,0|1,0,1]=4 2484 B12R2.2028 CC1NC(=O)C2=CC=CC=C12 MCULE-1430775793 [1,0,0,1,0,0|0,0,0]=2 2485 B12R2.2028 CC1OC(=O)C2=C1N=CC=C2 MCULE-4287188065 [1,0,0,1,0,0|2,0,0]=4 2486 B12R2.2028 CC1OC(=O)C2=CC=CC=C12 MCULE-1928411649 [1,0,0,1,0,0|1,0,0]=3 2487 B12R2.2028 CN1C=C(C2=C1C=CC=C2)N MCULE-2702276463 [1,0,0,1,0,0|2,0,0]=4 2488 B12R2.2028 CN1C=C(C2=C1C=CC=C2)N MCULE-3993119000 [1,0,0,1,0,0|2,0,0]=4 2489 B12R2.2028 CN1N=C(C2=C1C=CC=C2)N MCULE-3587964887 [1,0,0,1,0,0|2,0,0]=4 2490 B12R2.2028 CN1NC(=O)C2=C1C=CC=C2 MCULE-7679949962 [1,0,0,1,0,0|1,0,0]=3 2491 B12R2.2028 CN1NC(=O)C2=C1N=CC=C2 MCULE-3277046027 [1,0,0,1,0,0|2,0,0]=4 2492 B12R2.2028 CN1SC(=O)C2=C1C=CC=C2 MCULE-1327551005 [1,0,0,1,0,0|2,0,0]=4 2493 B12R2.2028 C[C@@H]1CC(=O)C2=CC=CC=C12 MCULE-1085411438 [1,0,0,1,0,0|1,0,0]=3 2494 B12R2.2028 C[C@@H]1NC(=O)C2=CC=CC=C12 MCULE-9109035445 [1,0,0,1,0,0|0,0,0]=2 2495 B12R2.2028 C[C@H]1CC(=O)C2=C1C=CC=C2 MCULE-5699236425 [1,0,0,1,0,0|1,0,0]=3 2496 B12R2.2028 C[C@H]1NC(=O)C2=C1C=CC=C2 MCULE-7260969723 [1,0,0,1,0,0|0,0,0]=2 2497 B12R2.2028 C[C@H]1NC(=O)C2=C1C=CC=C2 MCULE-7619194608 [1,0,0,1,0,0|0,0,0]=2 2498 B12R2.2028 NC1CC(=O)C2=C1C=CC=C2 MCULE-2173325839 [1,0,0,1,0,0|2,0,0]=4 2499 B12R2.2028 NC1CC(=O)C2=C1C=CC=C2 MCULE-5300475166 [1,0,0,1,0,0|2,0,0]=4 2500 B12R2.2028 NC1NC(=O)C2=C1C=CC=C2 MCULE-3720527456 [1,0,0,1,0,0|1,0,0]=3 2501 B12R2.2028 O=C1CC(C2=C1C=CC=C2)Br MCULE-3940368031 [1,0,0,1,0,0|2,0,0]=4 2502 B12R2.2028 O=C1CC(C2=C1C=CC=C2)O MCULE-5369167478 [1,0,0,1,0,0|2,0,0]=4 2503 B12R2.2028 O=C1NC(=O)C2=C1C=CC=C2 MCULE-2271536382 [1,0,0,1,0,0|1,0,1]=4 2504 B12R2.2028 O=C1NC(C2=NC=CC=C12)O MCULE-5931915599 [1,0,0,1,0,0|2,0,0]=4 2505 B12R2.2028 O=C1OC(C2=C1C=CC=C2)Br MCULE-1893086762 [1,0,0,1,0,0|2,0,0]=4 2506 B12R2.2028 O=C1OC(C2=C1C=CC=C2)O MCULE-2316305945 [1,0,0,1,0,0|2,0,0]=4 2507 B12R2.2028 O=C1OC(C2=CC=CC=C12)Cl MCULE-1671207791 [1,0,0,1,0,0|2,0,0]=4 2508 B12R2.2403 CC1(CCC2=C1C=CC=C2)N MCULE-4290262561 [1,0,0,1,0,0|1,0,1]=4 2509 B12R2.2403 CC1(CCC2=C1C=CC=C2)N MCULE-9665250765 [1,0,0,1,0,0|1,0,1]=4 2510 B12R2.2403 N=S1(=O)CCC2=C1C=CC=C2 MCULE-6661644695 [1,0,0,1,0,0|1,0,1]=4 2511 B12R2.2403 NC1(CCC2=C1C=CC=C2)O MCULE-1844967572 [1,0,0,1,0,0|0,0,2]=4 2512 B12R2.2403 O=P1(COC2=C1C=CC=C2)O MCULE-7019498696 [1,0,0,1,0,0|2,0,0]=4 2513 B12R2.2403 O=S1(=O)CCC2=C1C=CC=C2 MCULE-9177566119 [1,0,0,1,0,0|2,0,0]=4 2514 B12R2.229 O=C1NCCCC2=C1C=CN2 MCULE-3623268744 [0,0,0,1,1,0|2,0,0]=4 2515 B12R2.229 O=C1NCCCC2=C1C=CN2 MCULE-9560388679 [0,0,0,1,1,0|2,0,0]=4 2516 B12R2.229 O=C1NCCCC2=C1C=CO2 MCULE-9745109592 [0,0,0,1,1,0|2,0,0]=4 2517 B12R2.229 O=C1NCCCC2=C1SC=C2 MCULE-4954797486 [0,0,0,1,1,0|2,0,0]=4 2518 B12R2.229 O=C1NCCNC2=C1SC=C2 MCULE-3966433183 [0,0,0,1,1,0|2,0,0]=4 2519 B12R2.229 O=C1NCCSC2=C1C=CS2 MCULE-9276220871 [0,0,0,1,1,0|1,1,0]=4 2520 B14R2.391 O=C1CCCCC2=C(C1)C=CC=C2 MCULE-7066203656 [0,0,0,1,0,1|2,0,0]=4 2521 B14R2.499 CCOC1=C(C=CC=C1)C2CC2N MCULE-6474231744 [0,0,0,1,0,1|1,0,1]=4 2522 B14R2.535 CCOC1=C2N=C(SC2=CC=C1)N MCULE-1330279407 [0,0,0,1,0,1|0,1,0]=3 2523 B14R2.535 CCOC1=CC=CC2=C1N=C(S2)Cl MCULE-3609725941 [0,0,0,1,0,1|1,1,0]=4 2524 B14R2.535 O=C1CC2=C(N1)C=CC=C2CCBr MCULE-4951120782 [0,0,0,1,0,1|2,0,0]=4 2525 B14R2.535 O=C1CC2=C(N1)C=CC=C2CCO MCULE-8774231521 [0,0,0,1,0,1|2,0,0]=4 2526 B14R2.535 O=C1NC2=C(O1)C(=CC=C2)CCO MCULE-7203787332 [0,0,0,1,0,1|2,0,0]=4 2527 B14R2.642 CC(=O)C1=C(OC2=C1C=CC=C2)C MCULE-3965255922 [0,0,0,1,0,1|1,0,1]=4 2528 B14R2.642 CC(=O)N1C2=CC=CC=C2CC1C MCULE-8683040116 [0,0,0,1,0,1|2,0,0]=4 2529 B14R2.642 CC1=C(C2=C(O1)C=CC=C2)C(=O)O MCULE-4427881398 [0,0,0,1,0,1|1,0,1]=4 2530 B14R2.642 CC1=C(C2=CC=CC=C2N1)C(=O)N MCULE-4117396994 [0,0,0,1,0,1|1,0,1]=4 2531 B14R2.642 CC1=C(C2=CC=CC=C2S1)C(=O)N MCULE-2477066608 [0,0,0,1,0,1|0,1,1]=4 2532 B14R2.738 CC1CC(=O)NC2=C(S1)C=CC=C2 MCULE-6907521021 [0,0,0,1,0,1|1,1,0]=4 2533 B14R2.738 CC1CC(=O)NC2=CC=CC=C2N1 MCULE-3074358862 [0,0,0,1,0,1|2,0,0]=4 2534 B14R2.738 CC1CC(=O)NC2=CC=CC=C2O1 MCULE-6071554607 [0,0,0,1,0,1|1,0,0]=3 2535 B14R2.1146 CCC1=CC(=O)NC2=CC=CC=C12 MCULE-8900615823 [0,0,0,1,0,1|2,0,0]=4 2536 B14R2.1146 CC[N+]1=C2C=CC=CC2=NC(=C1)N MCULE-6252644224 [0,0,0,1,0,1|2,0,0]=4 2537 B14R2.1146 CC[N+]1=C2C=CC=CC2=NC(=C1)N MCULE-6254253617 [0,0,0,1,0,1|2,0,0]=4 2538 B14R2.9440 CC(=O)NC1=CC=CC2=C1CCC2 MCULE-9227656780 [0,0,0,1,0,1|2,0,0]=4 2539 B14R2.9440 O=C(O)CC1=C2OCOC2=CC=C1 MCULE-9057001663 [0,0,0,1,0,1|2,0,0]=4 2540 B14R2.9577 O=C(O)CC1=C(C=CC=C1)C2CC2 MCULE-2212311798 [0,0,0,1,0,1|2,0,0]=4 2541 B14R2.31359 CC(=O)N1CCCC2=C1C=CC=C2 MCULE-3408958318 [0,0,0,1,0,1|2,0,0]=4 2542 B14R2.31359 CC(=O)N1CCNC2=CC=CC=C12 MCULE-3814507114 [0,0,0,1,0,1|2,0,0]=4 2543 B14R2.31359 CC(=O)N1CCOC2=CC=CC=C12 MCULE-8185183043 [0,0,0,1,0,1|1,0,0]=3 2544 B14R2.31359 NC(=O)C1CCNC2=C1C=CC=C2 MCULE-3988453690 [0,0,0,1,0,1|1,0,0]=3 2545 B14R2.31359 NC(=O)C1NCCC2=C1C=CC=C2 MCULE-5416602349 [0,0,0,1,0,1|2,0,0]=4 2546 B14R2.31359 NC(=O)C1NCCC2=C1C=CC=C2 MCULE-6418909734 [0,0,0,1,0,1|2,0,0]=4 2547 B14R2.31359 NC(=O)N1CCCC2=C1C=CC=C2 MCULE-6994174840 [0,0,0,1,0,1|1,0,0]=3 2548 B14R2.31359 NC(=S)C1CCCC2=C1C=CC=C2 MCULE-3367657332 [0,0,0,1,0,1|1,1,0]=4 2549 B14R2.31359 NC(=S)N1CCCC2=CC=CC=C12 MCULE-5097104101 [0,0,0,1,0,1|1,1,0]=4 2550 B14R2.31359 O=C(Cl)N1CCCC2=CC=CC=C12 MCULE-9750872450 [0,0,0,1,0,1|2,0,0]=4 2551 B14R2.31359 O=C(Cl)[C@H]1CCCC2=C1C=CC=C2 MCULE-6285684070 [0,0,0,1,0,1|2,0,0]=4 2552 B14R2.31359 O=C(O)C1CCCC2=C1C=CC=C2 MCULE-1195085515 [0,0,0,1,0,1|2,0,0]=4 2553 B14R2.31359 O=C(O)C1CCCC2=C1C=CC=C2 MCULE-4769799002 [0,0,0,1,0,1|2,0,0]=4 2554 B14R2.31359 O=C(O)C1CCNC2=C1C=CC=C2 MCULE-3938485284 [0,0,0,1,0,1|2,0,0]=4 2555 B14R2.31359 O=C(O)C1CCNC2=C1C=CC=C2 MCULE-7841644698 [0,0,0,1,0,1|2,0,0]=4 2556 B14R2.31359 O=C(O)C1CCOC2=C1C=CC=C2 MCULE-4830736482 [0,0,0,1,0,1|1,0,0]=3 2557 B14R2.31359 O=C(O)C1OCOC2=C1C=CC=C2 MCULE-4641430283 [0,0,0,1,0,1|2,0,0]=4 2558 B14R2.31359 O=C(O)[C@@H]1CCCC2=C1C=CC=C2 MCULE-2088979715 [0,0,0,1,0,1|2,0,0]=4 2559 B14R2.31359 O=C(O)[C@@H]1CCCC2=CC=CC=C12 MCULE-4562043261 [0,0,0,1,0,1|2,0,0]=4 2560 B14R2.31359 O=C(O)[C@H]1CCCC2=C1C=CC=C2 MCULE-1087218229 [0,0,0,1,0,1|2,0,0]=4 2561 B14R2.31359 O=C(O)[C@H]1CCCC2=C1C=CC=C2 MCULE-4783214142 [0,0,0,1,0,1|2,0,0]=4 2562 B14R2.628 CC(N)C1=C2OCCC2=CC(=C1)Cl MCULE-8050516569 [0,1,0,1,0,0|1,0,1]=4 2563 B14R2.628 CC(N)C1=C2OCCC2=CC(=C1)Cl MCULE-9889090432 [0,1,0,1,0,0|1,0,1]=4 2564 B14R2.628 CC1=CC(=C2OCCC2=C1)C(=O)O MCULE-5217366924 [0,1,0,1,0,0|1,0,0]=3 2565 B14R2.628 O=C(Cl)C1=CC(=CC2=C1OCC2)Br MCULE-8305455925 [0,1,0,1,0,0|1,0,0]=3 2566 B14R2.628 O=C(O)C1=C2OCCC2=CC(=C1)Br MCULE-8167201536 [0,1,0,1,0,0|1,0,0]=3 2567 B14R2.628 O=C(O)C1=C2OCCC2=CC(=C1)Cl MCULE-8367666354 [0,1,0,1,0,0|1,0,0]=3 2568 B14R2.628 O=C(O)C1=C2OCCC2=CC(=C1)F MCULE-1788178831 [0,1,0,1,0,0|1,0,0]=3 2569 B14R2.628 O=C(O)C1=C2OCOC2=CC(=C1)Br MCULE-5074855741 [0,1,0,1,0,0|2,0,0]=4 2570 B14R2.4536 CC1(CCOC2=CC=C(C=C12)F)N MCULE-4140624627 [0,1,0,1,0,0|1,0,1]=4 2571 B14R2.5637 CC1=CC2=C(C=C1)OCCCC2=O MCULE-2235188442 [0,1,0,1,0,0|1,0,0]=3 2572 B14R2.5637 NC1=CC2=C(C=C1)CCCNC2=O MCULE-1642902913 [0,1,0,1,0,0|1,0,0]=3 2573 B14R2.5637 NC1=CC2=C(C=C1)OCCNC2=O MCULE-8261837633 [0,1,0,1,0,0|0,0,0]=2 2574 B14R2.5637 NC1=CC=C2CCCCC(=O)C2=C1 MCULE-2946471229 [0,1,0,1,0,0|2,0,0]=4 2575 B14R2.5637 NC1=CC=C2NCCNC(=O)C2=C1 MCULE-3410527562 [0,1,0,1,0,0|1,0,0]=3 2576 B14R2.5637 NC1CCCOC2=C1C=C(C=C2)Br MCULE-5611915650 [0,1,0,1,0,0|1,0,1]=4 2577 B14R2.5637 NC1CCCOC2=C1C=C(C=C2)Cl MCULE-9839976835 [0,1,0,1,0,0|1,0,1]=4 2578 B14R2.5637 NC1CCCOC2=C1C=C(C=C2)F MCULE-1051329959 [0,1,0,1,0,0|1,0,1]=4 2579 B14R2.5637 NC1CCCOC2=C1C=C(C=C2)F MCULE-3985947296 [0,1,0,1,0,0|1,0,1]=4 2580 B14R2.5637 N[C@@H]1CCCOC2=CC=C(C=C12)F MCULE-7397550300 [0,1,0,1,0,0|1,0,1]=4 2581 B14R2.5637 N[C@H]1CCCOC2=CC=C(C=C12)F MCULE-1985237358 [0,1,0,1,0,0|1,0,1]=4 2582 B14R2.5637 O=C1CCCCC2=C1C=C(C=C2)Cl MCULE-9398578502 [0,1,0,1,0,0|2,0,0]=4 2583 B14R2.5637 O=C1CCCCC2=C1C=C(C=C2)F MCULE-9578101119 [0,1,0,1,0,0|2,0,0]=4 2584 B14R2.5637 O=C1CCCCC2=C1C=C(C=C2)O MCULE-8786060775 [0,1,0,1,0,0|2,0,0]=4 2585 B14R2.5637 O=C1CCCCC2=CC=C(C=C12)Br MCULE-8336865877 [0,1,0,1,0,0|2,0,0]=4 2586 B14R2.5637 O=C1CCCNC2=C1C=C(C=C2)Br MCULE-6977749046 [0,1,0,1,0,0|2,0,0]=4 2587 B14R2.5637 O=C1CCCNC2=CC=C(C=C12)Cl MCULE-9541728071 [0,1,0,1,0,0|2,0,0]=4 2588 B14R2.5637 O=C1CCCNC2=CC=C(C=C12)F MCULE-4876998977 [0,1,0,1,0,0|2,0,0]=4 2589 B14R2.5637 O=C1CCCNC2=CC=C(C=C12)F MCULE-4922038746 [0,1,0,1,0,0|2,0,0]=4 2590 B14R2.5637 O=C1CCCNC2=CC=C(C=C12)O MCULE-2634096449 [0,1,0,1,0,0|2,0,0]=4 2591 B14R2.5637 O=C1CCCOC2=C1C=C(C=C2)Br MCULE-7981332243 [0,1,0,1,0,0|1,0,0]=3 2592 B14R2.5637 O=C1CCCOC2=C1C=C(C=C2)Cl MCULE-6862676990 [0,1,0,1,0,0|1,0,0]=3 2593 B14R2.5637 O=C1CCCOC2=C1C=C(C=C2)F MCULE-4925499184 [0,1,0,1,0,0|1,0,0]=3 2594 B14R2.5637 O=C1CCCOC2=C1C=C(C=C2)I MCULE-7910431808 [0,1,0,1,0,0|1,0,0]=3 2595 B14R2.5637 O=C1CCCSC2=C1C=C(C=C2)Br MCULE-5535252538 [0,1,0,1,0,0|1,1,0]=4 2596 B14R2.5637 O=C1CCCSC2=C1C=C(C=C2)Cl MCULE-1181487383 [0,1,0,1,0,0|1,1,0]=4 2597 B14R2.5637 O=C1NCCCC2=CC=C(C=C12)Br MCULE-5581434435 [0,1,0,1,0,0|1,0,0]=3 2598 B14R2.5637 O=C1NCCCC2=CC=C(C=C12)Cl MCULE-4063811934 [0,1,0,1,0,0|1,0,0]=3 2599 B14R2.5637 O=C1NCCCC2=CC=C(C=C12)F MCULE-2888783589 [0,1,0,1,0,0|1,0,0]=3 2600 B14R2.5637 O=C1NCCNC2=C1C=C(C=C2)Br MCULE-1592576694 [0,1,0,1,0,0|1,0,0]=3 2601 B14R2.5637 O=C1NCCOC2=CC=C(C=C12)Br MCULE-1127164114 [0,1,0,1,0,0|0,0,0]=2 2602 B14R2.5637 O=C1NCCOC2=CN=C(C=C12)Br MCULE-5647134304 [0,1,0,1,0,0|1,0,0]=3 2603 B14R2.5637 O=C1NCCOC2=NC=C(C=C12)Br MCULE-7659887898 [0,1,0,1,0,0|1,0,0]=3 2604 B14R2.5637 O=C1NCCSC2=CC=C(C=C12)Br MCULE-9153150770 [0,1,0,1,0,0|0,1,0]=3 2605 B14R2.8235 CC1=CC(=O)C2=C(O1)C=CC(=C2)Br MCULE-3975389663 [0,1,0,1,0,0|1,0,1]=4 2606 B14R2.8235 CC1=CC(=O)C2=C(O1)C=CC(=C2)Cl MCULE-6018900363 [0,1,0,1,0,0|1,0,1]=4 2607 B14R2.8235 CC1=CC(=O)C2=C(O1)C=CC(=C2)N MCULE-1259094764 [0,1,0,1,0,0|1,0,1]=4 2608 B14R2.8235 CC1=CC(=O)C2=C(O1)C=CC(=C2)O MCULE-5644545708 [0,1,0,1,0,0|1,0,1]=4 2609 B14R2.8235 CC1=CC2=C(C=C(C=C2)F)C(=O)N1 MCULE-3312964659 [0,1,0,1,0,0|1,0,1]=4 2610 B14R2.8235 CC1=CC2=C(C=C1)C=C(NC2=O)C MCULE-7985623664 [0,1,0,1,0,0|1,0,1]=4 2611 B14R2.8235 CC1=CC2=C(C=C1)OC(=CC2=O)C MCULE-9631746394 [0,1,0,1,0,0|1,0,1]=4 2612 B14R2.8235 CC1=CC=C2OC(CC(C2=C1)N)C MCULE-4212780544 [0,1,0,1,0,0|1,0,1]=4 2613 B14R2.8235 CC1=CC=C2OC(CC(C2=C1)N)C MCULE-8122883329 [0,1,0,1,0,0|1,0,1]=4 2614 B14R2.8235 CC1=NC2=C(C=C(C=C2)Cl)C(=O)N1 MCULE-7254970349 [0,1,0,1,0,0|1,0,1]=4 2615 B14R2.8235 CC1=NC2=C(C=C(C=C2)F)C(=O)N1 MCULE-5939053877 [0,1,0,1,0,0|1,0,1]=4 2616 B14R2.8235 CC1=NC2=C(C=C(C=C2)I)C(=O)N1 MCULE-5682608803 [0,1,0,1,0,0|1,0,1]=4 2617 B14R2.8235 CC1=NC2=C(C=C(C=C2)O)C(=O)N1 MCULE-2132933752 [0,1,0,1,0,0|1,0,1]=4 2618 B14R2.8235 CC1CC(=O)C2=C(N1)C=CC(=C2)Cl MCULE-6013863232 [0,1,0,1,0,0|2,0,0]=4 2619 B14R2.8235 CC1CC(=O)C2=C(O1)C=CC(=C2)F MCULE-7602610292 [0,1,0,1,0,0|1,0,0]=3 2620 B14R2.8235 CC1CC(=O)C2=C(S1)C=CC(=C2)Cl MCULE-5227850406 [0,1,0,1,0,0|1,1,0]=4 2621 B14R2.8235 O=C1NC(=O)C2=C(O1)C=CC(=C2)Br MCULE-6275970916 [0,1,0,1,0,0|1,0,1]=4 2622 B14R2.8235 O=C1NC(=O)C2=C(O1)C=CC(=C2)F MCULE-1059360608 [0,1,0,1,0,0|1,0,1]=4 2623 B14R2.9205 CC1=CC(=C(C=C1)C2CC2)C(=O)O MCULE-4064449931 [0,1,0,1,0,0|2,0,0]=4 2624 B14R2.9205 O=C(O)C1=C(C=CC(=C1)F)C2CC2 MCULE-5044965725 [0,1,0,1,0,0|2,0,0]=4 2625 B14R2.9205 O=C(O)C1=CC(=CC=C1C2CC2)Br MCULE-3628544919 [0,1,0,1,0,0|2,0,0]=4 2626 B14R2.4684 CC1=CC(=C(C=C1)C(=O)O)C2CC2 MCULE-6743162911 [0,1,0,1,0,0|2,0,0]=4 2627 B14R2.4684 NC1=CC=C(C(=C1)C2CC2)C(=O)O MCULE-1720993887 [0,1,0,1,0,0|2,0,0]=4 2628 B14R2.4684 O=C(O)C1=C(C=C(C=C1)Br)C2CC2 MCULE-2878092130 [0,1,0,1,0,0|2,0,0]=4 2629 B14R2.4684 O=C(O)C1=C(C=C(C=C1)F)C2CC2 MCULE-2575893097 [0,1,0,1,0,0|2,0,0]=4 2630 B14R2.8653 CC(=O)C1=C2CCCC2=C(C=C1)O MCULE-6491313993 [0,1,0,1,0,0|2,0,0]=4 2631 B14R2.8653 CC(=O)C1=C2OCOC2=C(C=C1)Br MCULE-2921527604 [0,1,0,1,0,0|2,0,0]=4 2632 B14R2.8653 CC1=C2CCCC2=C(C=C1)C(=O)O MCULE-2105376165 [0,1,0,1,0,0|2,0,0]=4 2633 B14R2.8719 CC1=CC2=C(C=C1)C(=O)CCCO2 MCULE-4669952153 [0,1,0,1,0,0|1,0,0]=3 2634 B14R2.8719 CC1NCCOC2=CC(=CC=C12)Br MCULE-2800479769 [0,1,0,1,0,0|1,0,1]=4 2635 B14R2.8719 NC1=CC2=C(C=C1)C(=O)CCCC2 MCULE-8328429655 [0,1,0,1,0,0|2,0,0]=4 2636 B14R2.8719 NC1CCCOC2=C1C=CC(=C2)Cl MCULE-6870808943 [0,1,0,1,0,0|1,0,1]=4 2637 B14R2.8719 NC1CCCOC2=CC(=CC=C12)Br MCULE-6139139148 [0,1,0,1,0,0|1,0,1]=4 2638 B14R2.8719 O=C1CCCCC2=C1C=CC(=C2)Br MCULE-3995189314 [0,1,0,1,0,0|2,0,0]=4 2639 B14R2.8719 O=C1CCCCC2=C1C=CC(=C2)O MCULE-6800775588 [0,1,0,1,0,0|2,0,0]=4 2640 B14R2.8719 O=C1CCCCC2=CC(=CC=C12)Cl MCULE-2375079492 [0,1,0,1,0,0|2,0,0]=4 2641 B14R2.8719 O=C1CCCNC2=CC(=CC=C12)Cl MCULE-9174550939 [0,1,0,1,0,0|2,0,0]=4 2642 B14R2.8719 O=C1CCCOC2=C1C=CC(=C2)Br MCULE-2581971631 [0,1,0,1,0,0|1,0,0]=3 2643 B14R2.8719 O=C1CCCOC2=C1C=CC(=C2)Cl MCULE-9322294987 [0,1,0,1,0,0|1,0,0]=3 2644 B14R2.8719 O=C1CCCOC2=C1C=CC(=C2)F MCULE-7508647276 [0,1,0,1,0,0|1,0,0]=3 2645 B14R2.8719 O=C1NCCCC2=C1C=CC(=C2)O MCULE-9476963322 [0,1,0,1,0,0|1,0,0]=3 2646 B14R2.8719 O=C1NCCCC2=CC(=CC=C12)Br MCULE-6789293216 [0,1,0,1,0,0|1,0,0]=3 2647 B14R2.8719 O=C1NCCNC2=C1C=CC(=C2)Br MCULE-8094831467 [0,1,0,1,0,0|1,0,0]=3 2648 B14R2.8719 O=C1NCCOC2=C1C=CC(=C2)Br MCULE-8741242942 [0,1,0,1,0,0|0,0,0]=2 2649 B14R2.8719 O=C1NCCOC2=CC(=CC=C12)Cl MCULE-8955717405 [0,1,0,1,0,0|0,0,0]=2 2650 B14R2.8719 O=C1NCCOC2=CC(=CC=C12)O MCULE-2151462314 [0,1,0,1,0,0|0,0,0]=2 2651 B14R2.29365 CC1=CC(=O)C2=C(O1)C=C(C=C2)Br MCULE-2361767730 [0,1,0,1,0,0|1,0,1]=4 2652 B14R2.29365 CC1=CC(=O)C2=C(O1)C=C(C=C2)N MCULE-8329208438 [0,1,0,1,0,0|1,0,1]=4 2653 B14R2.29365 CC1=CC(=O)C2=C(O1)C=C(C=C2)O MCULE-5510677878 [0,1,0,1,0,0|1,0,1]=4 2654 B14R2.29365 CC1=CC2=C(C=C1)C(=O)NC(=O)O2 MCULE-2604170561 [0,1,0,1,0,0|1,0,1]=4 2655 B14R2.29365 CC1=CC2=C(C=CC(=C2)Br)C(=O)N1 MCULE-2244741536 [0,1,0,1,0,0|1,0,1]=4 2656 B14R2.29365 CC1=CC2=C(C=CC(=C2)Cl)C(=O)N1 MCULE-5096191131 [0,1,0,1,0,0|1,0,1]=4 2657 B14R2.29365 CC1=NC2=C(C=CC(=C2)Br)C(=O)N1 MCULE-2539235327 [0,1,0,1,0,0|1,0,1]=4 2658 B14R2.29365 CC1=NC2=C(C=CC(=C2)Cl)C(=O)N1 MCULE-6933968289 [0,1,0,1,0,0|1,0,1]=4 2659 B14R2.29365 CC1CC2=C(C=CC(=C2)Br)C(=O)N1 MCULE-4873312501 [0,1,0,1,0,0|1,0,0]=3 2660 B14R2.5495 O=S1(=O)NCCCC2=CC=CC=C12 MCULE-3333726614 [0,1,0,1,0,0|2,0,0]=4 2661 B14R2.5495 O=S1(=O)NCCOC2=CC=CC=C12 MCULE-6212275339 [0,1,0,1,0,0|1,0,0]=3 2662 B14R2.5495 O=S1(=O)NCCOC2=NC=CC=C12 MCULE-8019554412 [0,1,0,1,0,0|2,0,0]=4 2663 B14R2.15500 NS(=O)(=O)C1=C(C=CC=C1)C2CC2 MCULE-4693909165 [0,1,0,1,0,0|2,0,0]=4 2664 B14R2.15533 NS(=O)(=O)C1=C2OCCC2=CC=C1 MCULE-9156710410 [0,1,0,1,0,0|1,0,0]=3 2665 B14R2.15533 O=S(=O)(Cl)C1=C2OCCC2=CC=C1 MCULE-3049723069 [0,1,0,1,0,0|2,0,0]=4 2666 B14R2.279 NC1CCOC2=CC=CC=C2C1=O MCULE-4147955339 [0,1,0,1,0,0|0,0,0]=2 2667 B14R2.279 NC1CCOC2=CC=CC=C2C1=O MCULE-6378997799 [0,1,0,1,0,0|0,0,0]=2 2668 B14R2.279 NC1CCOC2=CC=CC=C2C1O MCULE-3083604933 [0,1,0,1,0,0|0,0,2]=4 2669 B14R2.279 NC1CCOC2=CC=CC=C2C1O MCULE-7944299282 [0,1,0,1,0,0|0,0,2]=4 2670 B14R2.279 O=C1C2=C(C=CC=C2)CCCC1Br MCULE-3526920491 [0,1,0,1,0,0|2,0,0]=4 2671 B14R2.287 O=C1CNC(=O)C2=C(N1)C=CC=C2 MCULE-1893626067 [0,1,0,1,0,0|1,0,1]=4 2672 B14R2.536 CCOC1=C2C(=CC=C1)NN=C2N MCULE-6455793065 [0,1,0,1,0,0|1,0,0]=3 2673 B14R2.536 CCOC1=C2C(=CC=C1)ON=C2N MCULE-4651639937 [0,1,0,1,0,0|0,0,1]=3 2674 B14R2.1131 CCC1=CC=C(C2=CC=CC=C12)N MCULE-6243765986 [0,1,0,1,0,0|2,0,0]=4 2675 B14R2.1131 COC1=CNC(=O)C2=CC=CC=C12 MCULE-3062977985 [0,1,0,1,0,0|2,0,0]=4 2676 B14R2.1131 NCC1=CNC(=O)C2=C1C=CC=C2 MCULE-5192558049 [0,1,0,1,0,0|2,0,0]=4 2677 B14R2.1131 NCC1=NNC(=O)C2=C1C=CC=C2 MCULE-4970646166 [0,1,0,1,0,0|2,0,0]=4 2678 B14R2.1131 NCC1=NNC(=O)C2=CC=CC=C12 MCULE-2424453138 [0,1,0,1,0,0|2,0,0]=4 2679 B14R2.1131 O=C1NC=C(C2=C1C=CC=C2)CCl MCULE-7042552835 [0,1,0,1,0,0|2,0,0]=4 2680 B14R2.1131 O=C1NN=C(C2=C1C=CC=C2)CBr MCULE-1875444729 [0,1,0,1,0,0|2,0,0]=4 2681 B14R2.1131 O=C1NN=C(C2=CC=CC=C12)CO MCULE-5122339678 [0,1,0,1,0,0|2,0,0]=4 2682 B14R2.2014 N#CC1NCCOC2=C1C=CC=C2 MCULE-4068287481 [0,1,0,1,0,0|1,0,1]=4 2683 B14R2.2014 OCC1NCCOC2=C1C=CC=C2 MCULE-2162338644 [0,1,0,1,0,0|0,0,2]=4 2684 B14R2.2014 OCC1NCCOC2=C1C=CC=C2 MCULE-4931973024 [0,1,0,1,0,0|0,0,2]=4 2685 B14R2.3459 N#CC1(CCOC2=C1C=CC=C2)N MCULE-9624547636 [0,1,0,1,0,0|1,0,1]=4 2686 B14R2.3459 NC1(CCOC2=C1C=CC=C2)CO MCULE-2460146969 [0,1,0,1,0,0|0,0,2]=4 2687 B14R2.3459 NCC1(CCOC2=C1C=CC=C2)O MCULE-1170164716 [0,1,0,1,0,0|0,0,2]=4 2688 B14R2.3459 NCC1(CCOC2=CC=CC=C12)O MCULE-3539494308 [0,1,0,1,0,0|0,0,2]=4 2689 B14R2.6558 CCOC1=C(C=CC=C1)C2CNC2 MCULE-9790976863 [0,1,0,1,0,0|1,0,1]=4 2690 B14R2.6558 CCOC1=C(C=CC=C1)[C@@H]2CCN2 MCULE-3238271864 [0,1,0,1,0,0|1,0,1]=4 2691 B14R2.6558 CCOC1=C(C=CC=C1)[C@@H]2CCN2 MCULE-3740677316 [0,1,0,1,0,0|1,0,1]=4 2692 B14R2.6558 CCOC1=C(C=CC=C1)[C@H]2CCN2 MCULE-3473288071 [0,1,0,1,0,0|1,0,1]=4 2693 B14R2.6558 CCOC1=C(C=CC=C1)[C@H]2CCN2 MCULE-4668682571 [0,1,0,1,0,0|1,0,1]=4 2694 B14R2.6558 CCOC1=CC=CC=C1C2CNC2 MCULE-7370143550 [0,1,0,1,0,0|1,0,1]=4 2695 B14R2.8188 CC1=CC2=CC=CC=C2C(=O)N1N MCULE-8039431191 [0,1,0,1,0,0|1,0,1]=4 2696 B14R2.8188 CC1=NC2=CC=CC=C2C(=O)N1C MCULE-2251538402 [0,1,0,1,0,0|1,0,1]=4 2697 B14R2.8188 CC1=NC2=CC=CC=C2C(=O)N1N MCULE-6792669097 [0,1,0,1,0,0|1,0,1]=4 2698 B14R2.8188 CC1=NC2=CC=CC=C2C(=O)N1O MCULE-4943210510 [0,1,0,1,0,0|1,0,1]=4 2699 B14R2.8188 CC1=[O+]C2=C(C=CC=C2)C(=O)N1C MCULE-3671462831 [0,1,0,1,0,0|0,0,2]=4 2700 B14R2.8188 CC1=[O+]C2=C(C=CC=C2)C(=O)N1C MCULE-7784770033 [0,1,0,1,0,0|0,0,2]=4 2701 B14R2.8188 CC1OC2=CC=CC=C2N(C1=O)C MCULE-7176606161 [0,1,0,1,0,0|2,0,0]=4 2702 B14R2.8188 CN1C(=O)OC2=CC=CC=C2C1=O MCULE-9497382063 [0,1,0,1,0,0|1,0,1]=4 2703 B14R2.8188 [NH3+]N1C(=O)C2=C(C=CC=C2)N=C1C MCULE-8686705554 [0,1,0,1,0,0|1,0,1]=4 2704 B14R2.10655 COC(=O)C1=C(C=CC=C1)C2CC2 MCULE-9223729865 [0,1,0,1,0,0|2,0,0]=4 2705 B14R2.10655 O=C(CBr)C1=C(C=CC=C1)C2CC2 MCULE-9906708930 [0,1,0,1,0,0|2,0,0]=4 2706 B14R2.10782 COC(=O)C1=C2OCCC2=CC=C1 MCULE-8591215493 [0,1,0,1,0,0|1,0,0]=3 2707 B14R2.10782 COC(=O)C1=C2OCOC2=CC=C1 MCULE-3884906636 [0,1,0,1,0,0|2,0,0]=4 2708 B14R2.10782 COC(=O)C1=CC=CC2=C1CCC2 MCULE-9361005183 [0,1,0,1,0,0|2,0,0]=4 2709 B14R2.10782 COC(=O)C1=CC=CC2=C1NCC2 MCULE-6281389305 [0,1,0,1,0,0|2,0,0]=4 2710 B14R2.10782 CSC(=O)C1=CC=CC2=C1NCC2 MCULE-7059589921 [0,1,0,1,0,0|2,0,0]=4 2711 B14R2.19306 CCN1C(=O)C(=O)C2=CC=CC=C12 MCULE-7577648622 [0,1,0,1,0,0|2,0,0]=4 2712 B14R2.19306 CCN1C(=O)C(C2=CC=CC=C12)N MCULE-3334486970 [0,1,0,1,0,0|1,0,1]=4 2713 B14R2.19306 CCN1C(=O)C(C2=CC=CC=C12)N MCULE-7912043521 [0,1,0,1,0,0|1,0,1]=4 2714 B14R2.19306 CN1C(=O)C2=C(C1CN)C=CC=C2 MCULE-2758266857 [0,1,0,1,0,0|2,0,0]=4 2715 B14R2.19306 CN1C(=O)C2=C(C1CN)C=CC=C2 MCULE-9992940298 [0,1,0,1,0,0|2,0,0]=4 2716 B14R2.19587 CCN1C=C(C2=C1C=CC=C2)C=O MCULE-8599075597 [0,1,0,1,0,0|2,0,0]=4 2717 B14R2.19587 CCN1N=C(C2=C1C=CC=C2)C=O MCULE-6258128394 [0,1,0,1,0,0|1,0,1]=4 2718 B14R2.19587 CCN1N=C(C2=CC=CC=C12)CN MCULE-1396967597 [0,1,0,1,0,0|2,0,0]=4 2719 B14R2.19587 CCN1N=C(C2=CC=CC=C12)CN MCULE-5655927974 [0,1,0,1,0,0|2,0,0]=4 2720 B14R2.782 CC1(CC1)C2=C(C=CC=C2)C(=O)O MCULE-8315816657 [0,1,0,1,0,0|2,0,0]=4 2721 B14R2.4510 CC1CCCC(=O)C2=CC=CC=C12 MCULE-2632136814 [0,1,0,1,0,0|2,0,0]=4 2722 B14R2.4510 CN1CCCC(=O)C2=C1C=CC=C2 MCULE-5571039778 [0,1,0,1,0,0|2,0,0]=4 2723 B14R2.4510 O=C1CCCC(C2=C1C=CC=C2)Br MCULE-2095817888 [0,1,0,1,0,0|2,0,0]=4 2724 B14R2.7724 CC1CC(=O)C2=C(C1=O)C=CC=C2 MCULE-7335047873 [0,1,0,1,0,0|2,0,0]=4 2725 B14R2.9532 O=C(O)C1=C(C=CC=C1)C2CCC2 MCULE-3257208461 [0,1,0,1,0,0|2,0,0]=4 2726 B14R2.9532 O=C(O)C1=CC=CC=C1[C@@H]2CCN2 MCULE-3952037000 [0,1,0,1,0,0|2,0,0]=4 2727 B14R2.9532 O=C(O)C1=CC=CC=C1[C@@H]2CCN2 MCULE-5258949414 [0,1,0,1,0,0|2,0,0]=4 2728 B14R2.9532 O=C(O)C1=CC=CC=C1[C@H]2CCN2 MCULE-3165212604 [0,1,0,1,0,0|2,0,0]=4 2729 B14R2.9532 O=C(O)C1=CC=CC=C1[C@H]2CCN2 MCULE-6731634185 [0,1,0,1,0,0|2,0,0]=4 2730 B14R2.24350 CN1CCC2=CC=CC(=C12)C(=O)O MCULE-1317669020 [0,1,0,1,0,0|2,0,0]=4 2731 B14R2.24350 NC(=O)C1=C2C(=O)NCC2=CC=C1 MCULE-4702893123 [0,1,0,1,0,0|2,0,0]=4 2732 B14R2.24350 NC(=O)C1=CC=CC2=C1C(=O)CC2 MCULE-5050589553 [0,1,0,1,0,0|1,0,0]=3 2733 B14R2.24350 O=C(O)C1=C2C(=O)CCC2=CC=C1 MCULE-6190511905 [0,1,0,1,0,0|2,0,0]=4 2734 B14R2.24350 O=C(O)C1=CC=CC2=C1C(CC2)O MCULE-5666436527 [0,1,0,1,0,0|2,0,0]=4 2735 B14R2.4 CC1COC2=C(C=CC=C12)C(=O)O MCULE-6554150259 [0,1,0,1,0,0|1,0,0]=3 2736 B14R2.4 CN1C=CC2=C1C=CC=C2C(=O)N MCULE-4188116685 [0,1,0,1,0,0|1,0,1]=4 2737 B14R2.4 CN1CCC2=C1C=CC=C2C(=O)O MCULE-9593648302 [0,1,0,1,0,0|2,0,0]=4 2738 B14R2.4 NC(=O)C1=C2OCC(=O)C2=CC=C1 MCULE-6716931927 [0,1,0,1,0,0|0,0,1]=3 2739 B14R2.4 NC(=O)C1=CC=CC2=C1CCC2=O MCULE-2295616951 [0,1,0,1,0,0|1,0,1]=4 2740 B14R2.4 NC1CCC2=C1C=CC=C2C(=O)O MCULE-2728766138 [0,1,0,1,0,0|2,0,0]=4 2741 B14R2.4 N[C@@H]1CCC2=C1C=CC=C2C(=O)O MCULE-1321735158 [0,1,0,1,0,0|2,0,0]=4 2742 B14R2.4 N[C@H]1CCC2=C1C=CC=C2C(=O)O MCULE-1702614918 [0,1,0,1,0,0|2,0,0]=4 2743 B14R2.4 O=C(O)C1=C2OCC(=O)C2=CC=C1 MCULE-3976215386 [0,1,0,1,0,0|1,0,1]=4 2744 B14R2.52 CC1CNC2=C(C=CC=C2)C(=O)N1 MCULE-8576877264 [0,1,0,1,0,0|1,0,0]=3 2745 B14R2.52 O=C1CNC2=C(C=CC=C2)C(=O)N1 MCULE-2811393673 [0,1,0,1,0,0|1,0,1]=4 2746 B14R2.52 O=C1COC2=C(C=CC=C2)C(=O)C1 MCULE-1617210134 [0,1,0,1,0,0|1,0,1]=4 2747 B14R2.52 O=C1COC2=CC=CC=C2C(=O)N1 MCULE-6841577247 [0,1,0,1,0,0|0,0,1]=3 2748 B14R2.510 CC/C=C/1\OC(=O)C2=CC=CC=C12 MCULE-5752639722 [0,1,0,1,0,0|2,0,0]=4 2749 B14R2.510 CCC=C1OC(=O)C2=CC=CC=C12 MCULE-5371579510 [0,1,0,1,0,0|2,0,0]=4 2750 B14R2.510 CCCN1N=C(C2=C1C=CC=C2)N MCULE-8611032684 [0,1,0,1,0,0|2,0,0]=4 2751 B14R2.510 CCCN1NC(=O)C2=C1N=CC=C2 MCULE-2422656961 [0,1,0,1,0,0|2,0,0]=4 2752 B14R2.510 CCOC1NC(=O)C2=C1C=CC=C2 MCULE-4227738306 [0,1,0,1,0,0|0,0,0]=2 2753 B14R2.510 CCOC1OC(=O)C2=C1C=CC=C2 MCULE-7262983965 [0,1,0,1,0,0|1,0,0]=3 2754 B14R2.510 CCOC1OC(=O)C2=C1C=CN=C2 MCULE-9059617587 [0,1,0,1,0,0|2,0,0]=4 2755 B14R2.510 CCOC1OC(=O)C2=NC=CC=C12 MCULE-8102734686 [0,1,0,1,0,0|2,0,0]=4 2756 B14R2.510 N#CCC1NC(=O)C2=C1C=CC=C2 MCULE-2430191897 [0,1,0,1,0,0|1,0,1]=4 2757 B14R2.1019 CCC1=CC(=O)C2=C(N1)C=CC=C2 MCULE-4334421068 [0,1,0,1,0,0|2,0,0]=4 2758 B14R2.1019 CCC1=CC(=O)C2=C(O1)C=CC=C2 MCULE-6362192628 [0,1,0,1,0,0|1,0,0]=3 2759 B14R2.1019 CCC1=NC(=C2C=CC=CC2=N1)N MCULE-5722077928 [0,1,0,1,0,0|2,0,0]=4 2760 B14R2.1019 CCC1=NC2=C(C=CC=C2)C(=S)N1 MCULE-1372089627 [0,1,0,1,0,0|1,1,0]=4 2761 B14R2.1019 CCC1=NC2=CC=CC=C2C(=C1)N MCULE-7906368846 [0,1,0,1,0,0|2,0,0]=4 2762 B14R2.1019 CCC1=NC2=CC=CC=C2C(=O)N1 MCULE-5880921845 [0,1,0,1,0,0|1,0,0]=3 2763 B14R2.1019 CCC1=NC2=CC=CC=C2C(=O)O1 MCULE-8407230744 [0,1,0,1,0,0|2,0,0]=4 2764 B14R2.1019 CCC1=NC2=CN=CC=C2C(=O)N1 MCULE-3243788005 [0,1,0,1,0,0|2,0,0]=4 2765 B14R2.1019 COC1=CC2=CC=CC=C2C(=O)N1 MCULE-2934526703 [0,1,0,1,0,0|1,0,1]=4 2766 B14R2.1019 COC1=NC2=C(C=CC=C2)C(=O)N1 MCULE-6482957980 [0,1,0,1,0,0|1,0,1]=4 2767 B14R2.1019 CSC1=NC2=CC=CC=C2C(=O)N1 MCULE-5579724986 [0,1,0,1,0,0|1,0,1]=4 2768 B14R2.1019 NCC1=NC2=C(C=CC=C2)C(=O)N1 MCULE-6693721385 [0,1,0,1,0,0|1,0,1]=4 2769 B14R2.1019 NCC1=NC2=CC=CC=C2C(=O)N1 MCULE-9560762259 [0,1,0,1,0,0|1,0,1]=4 2770 B14R2.1019 O=C1C=C(OC2=C1C=CC=C2)CO MCULE-9362214124 [0,1,0,1,0,0|1,0,1]=4 2771 B14R2.1019 O=C1NC(=NC2=C1C=CC=C2)CO MCULE-3898488673 [0,1,0,1,0,0|1,0,1]=4 2772 B14R2.1019 O=C1NC(=NC2=CC=CC=C12)CCl MCULE-6798737431 [0,1,0,1,0,0|1,0,1]=4 2773 B14R2.1019 O=C1NC(=NC2=CC=CC=C12)CO MCULE-7571909039 [0,1,0,1,0,0|1,0,1]=4 2774 B14R2.9513 NC(=S)C1=C(C=NC=C1)OC2CC2 MCULE-8920270020 [0,1,0,1,0,0|1,1,0]=4 2775 B14R2.9513 O=C(O)C1=C(C=CC=C1)OC2CC2 MCULE-8191871580 [0,1,0,1,0,0|1,0,0]=3 2776 B14R2.712 CC(=O)C1=C2OC(=NC2=CC=C1)C MCULE-5507972076 [0,1,0,1,0,0|1,0,1]=4 2777 B14R2.712 CC1=CC2=C(O1)C(=CC=C2)C(=O)O MCULE-3787156673 [0,1,0,1,0,0|1,0,1]=4 2778 B14R2.712 CC1=NC2=C(O1)C(=CC=C2)C(=O)O MCULE-9661991745 [0,1,0,1,0,0|1,0,1]=4 2779 B14R2.712 CC1CC2=C(O1)C(=CC=C2)C(=O)O MCULE-3951521336 [0,1,0,1,0,0|1,0,0]=3 2780 B14R2.712 CN1C=C2C(=CC=CC2=N1)C(=O)N MCULE-2007811807 [0,1,0,1,0,0|2,0,0]=4 2781 B14R2.25733 CC(C)C1CC(=O)C2=C1C=CC=C2 MCULE-2654594223 [0,1,0,1,0,0|2,0,0]=4 2782 B14R2.29496 CC1(CC(=O)C2=C(N1)C=CC=C2)C MCULE-5553451399 [0,1,0,1,0,0|2,0,0]=4 2783 B14R2.29496 CC1(CC(=O)C2=C(O1)C=CC=C2)C MCULE-7359426276 [0,1,0,1,0,0|1,0,0]=3 2784 B14R2.29496 CC1(CC(=O)C2=C(O1)N=CC=C2)C MCULE-2905065518 [0,1,0,1,0,0|2,0,0]=4 2785 B14R2.29496 CC1(CC(=O)C2=C(S1)C=CC=C2)C MCULE-4490063137 [0,1,0,1,0,0|1,1,0]=4 2786 B14R2.29496 CC1(CC(C2=CC=CC=C2O1)N)C MCULE-6632462871 [0,1,0,1,0,0|1,0,1]=4 2787 B14R2.29496 CC1(CC(C2=CC=CC=C2O1)N)C MCULE-8926237490 [0,1,0,1,0,0|1,0,1]=4 2788 B14R2.29496 CC1(CC2=C(C=CC=C2)C(=N1)N)C MCULE-5941754683 [0,1,0,1,0,0|2,0,0]=4 2789 B14R2.29496 CC1(CC2=C(C=CC=C2)C(=O)N1)C MCULE-3713483617 [0,1,0,1,0,0|1,0,0]=3 2790 B14R2.29496 CC1(CC2=CC=CC=C2C(=N1)N)C MCULE-5027601527 [0,1,0,1,0,0|2,0,0]=4 2791 B14R2.29496 CC1(C[C@@H](C2=C(O1)C=CC=C2)N)C MCULE-3802580506 [0,1,0,1,0,0|1,0,1]=4 2792 B14R2.29496 CC1(C[C@@H](C2=C(O1)C=CC=C2)N)C MCULE-5079812652 [0,1,0,1,0,0|1,0,1]=4 2793 B14R2.29496 CC1(C[C@@H](C2=C(O1)C=CC=C2)N)C MCULE-7534749852 [0,1,0,1,0,0|1,0,1]=4 2794 B14R2.29496 CC1(C[C@@H](C2=CC=CC=C2O1)N)C MCULE-6207136780 [0,1,0,1,0,0|1,0,1]=4 2795 B14R2.29496 CC1(N=C(C2=C(O1)C=CC=C2)Cl)C MCULE-3684766177 [0,1,0,1,0,0|1,0,1]=4 2796 B14R2.29496 CC1(NC(=O)C2=C(N1)C=CC=C2)C MCULE-6649625923 [0,1,0,1,0,0|1,0,0]=3 2797 B14R2.29496 CC1(NC(=O)C2=CC=CC=C2O1)C MCULE-4552072267 [0,1,0,1,0,0|0,0,0]=2 2798 B14R2.29496 CC1(NC(=S)C2=C(O1)C=CC=C2)C MCULE-5409063161 [0,1,0,1,0,0|0,1,0]=3 2799 B14R2.29496 CC1(NC(=S)C2=CC=CC=C2N1)C MCULE-4985784969 [0,1,0,1,0,0|1,1,0]=4 2800 B14R2.4497 CC(=O)C1=C(C=CC2=C1OCO2)Br MCULE-8694300767 [0,1,0,1,0,0|2,0,0]=4 2801 B14R2.4497 O=C(O)C1=C(C=CC2=C1OCC2)F MCULE-6070173005 [0,1,0,1,0,0|1,0,0]=3 2802 B14R2.4497 O=C(O)C1=C(C=CC2=C1OCO2)F MCULE-4031352735 [0,1,0,1,0,0|2,0,0]=4 2803 B14R2.4497 O=C(O)C1=C2OCOC2=CC=C1Br MCULE-6829132885 [0,1,0,1,0,0|2,0,0]=4 2804 B14R2.4497 O=C(O)C1=C2OCOC2=CC=C1Cl MCULE-7120793680 [0,1,0,1,0,0|2,0,0]=4 2805 B14R2.9055 CC1=C(C(=CC=C1)C2CC2)C(=O)O MCULE-8703189588 [0,1,0,1,0,0|2,0,0]=4 2806 B14R2.9055 NC1=CC=CC(=C1C(=O)O)C2CC2 MCULE-4612652260 [0,1,0,1,0,0|2,0,0]=4 2807 B14R2.9055 O=C(O)C1=C(C=CC=C1F)C2CC2 MCULE-2875557719 [0,1,0,1,0,0|2,0,0]=4 2808 B14R2.14868 CCN1N=C(C2=C1C=CC=C2Cl)N MCULE-8530741324 [0,1,0,1,0,0|2,0,0]=4 2809 B14R2.28471 CC1(CCOC2=CC=CC(=C12)F)N MCULE-8774770888 [0,1,0,1,0,0|1,0,1]=4 2810 B14R2.28480 CC1=C2C(=O)CC(OC2=CC=C1)C MCULE-6545344085 [0,1,0,1,0,0|1,0,0]=3 2811 B14R2.28480 CC1=CC(=O)C2=C(O1)C=CC=C2O MCULE-4530227739 [0,1,0,1,0,0|1,0,1]=4 2812 B14R2.28480 CC1=CC2=C(C(=O)N1)C(=CC=C2)Br MCULE-7777951869 [0,1,0,1,0,0|1,0,1]=4 2813 B14R2.28480 CC1=NC2=C(C(=O)N1)C(=CC=C2)Cl MCULE-6083074798 [0,1,0,1,0,0|1,0,1]=4 2814 B14R2.28480 CC1CC2=C(C(=O)O1)C(=CC=C2)O MCULE-7308433312 [0,1,0,1,0,0|2,0,0]=4 2815 B14R2.28480 C[C@@H]1CC2=C(C(=O)O1)C(=CC=C2)O MCULE-3900678739 [0,1,0,1,0,0|2,0,0]=4 2816 B14R2.28480 C[C@@H]1CC2=CC=CC(=C2C(=O)O1)O MCULE-3634552031 [0,1,0,1,0,0|2,0,0]=4 2817 B14R2.28480 C[C@H]1CC2=CC=CC(=C2C(=O)O1)O MCULE-5617748034 [0,1,0,1,0,0|2,0,0]=4 2818 B14R2.685 CC1=C2OCCCC(=O)C2=CC=C1 MCULE-8221556032 [0,1,0,1,0,0|1,0,0]=3 2819 B14R2.685 CC1=CC=CC2=C1OCCCC2N MCULE-5830876380 [0,1,0,1,0,0|1,0,1]=4 2820 B14R2.685 CC1=CC=CC2=C1OCCNC2=O MCULE-4027676593 [0,1,0,1,0,0|0,0,0]=2 2821 B14R2.685 NC1=C2CCCCC(=O)C2=CC=C1 MCULE-3246775341 [0,1,0,1,0,0|2,0,0]=4 2822 B14R2.685 NC1=C2NCCNC(=O)C2=CC=C1 MCULE-2511814766 [0,1,0,1,0,0|1,0,0]=3 2823 B14R2.685 NC1CCCOC2=C1C=CC=C2Br MCULE-1042936588 [0,1,0,1,0,0|1,0,1]=4 2824 B14R2.685 NC1CCCOC2=C1C=CC=C2Cl MCULE-5349982348 [0,1,0,1,0,0|1,0,1]=4 2825 B14R2.685 NC1CCCOC2=C1C=CC=C2F MCULE-3709313888 [0,1,0,1,0,0|1,0,1]=4 2826 B14R2.685 O=C1CCCCC2=C(C=CC=C12)Br MCULE-8096866063 [0,1,0,1,0,0|2,0,0]=4 2827 B14R2.685 O=C1CCCOC2=C(C=CC=C12)Br MCULE-2476936250 [0,1,0,1,0,0|1,0,0]=3 2828 B14R2.685 O=C1CCCOC2=C(C=CC=C12)Cl MCULE-1160372746 [0,1,0,1,0,0|1,0,0]=3 2829 B14R2.685 O=C1CCCOC2=C1C=CC=C2F MCULE-2900039604 [0,1,0,1,0,0|1,0,0]=3 2830 B14R2.685 O=C1NCCCC2=C1C=CC=C2Br MCULE-1475007588 [0,1,0,1,0,0|1,0,0]=3 2831 B14R2.685 O=C1NCCNC2=C(C=CC=C12)F MCULE-8398351661 [0,1,0,1,0,0|1,0,0]=3 2832 B14R2.685 O=C1NCCNC2=C1C=CC=C2I MCULE-5905327360 [0,1,0,1,0,0|1,0,0]=3 2833 B14R2.8045 CC1=CC2=C(C=CC=C2C(=O)N1)N MCULE-6588843849 [0,1,0,1,0,0|1,0,1]=4 2834 B14R2.8045 CC1=NC2=C(C=CC=C2O)C(=O)N1 MCULE-8108879612 [0,1,0,1,0,0|1,0,1]=4 2835 B14R2.8045 CC1CC2=C(C=CC=C2Br)C(=O)N1 MCULE-6497071573 [0,1,0,1,0,0|1,0,0]=3 2836 B14R2.9068 O=C(O)C1=CC=CC(=C1C2CC2)Br MCULE-9383109594 [0,1,0,1,0,0|2,0,0]=4 2837 B14R3.12265 O=C1NC2(CC2)C3=C1C=CC=C3 MCULE-1125110629 [0,0,0,2,0,0|1,0,0]=3 2838 B10R1.5 CCCN1C=CC=C1C=O MCULE-9144781738 [1,0,0,0,1,0|2,0,0]=4 2839 B10R1.39 CCC1=C(C=CN1)C(=O)O MCULE-6354695157 [1,0,0,0,1,0|2,0,0]=4 2840 B10R1.39 CCC1=C(C=CO1)C(=O)O MCULE-3678135782 [1,0,0,0,1,0|2,0,0]=4 2841 B10R1.39 CCC1=C(C=CS1)C(=O)O MCULE-8509523486 [1,0,0,0,1,0|2,0,0]=4 2842 B10R1.39 CCC1=C(OC=C1)C(=O)O MCULE-9646471250 [1,0,0,0,1,0|2,0,0]=4 2843 B10R1.39 CCC1=C(SC=C1)C(=O)O MCULE-8486371421 [1,0,0,0,1,0|2,0,0]=4 2844 B10R1.39 CCC1=CNC=C1C(=O)O MCULE-2156378229 [1,0,0,0,1,0|2,0,0]=4 2845 B10R1.39 CCC1=CSC=C1C(=O)O MCULE-8937787346 [1,0,0,0,1,0|2,0,0]=4 2846 B10R1.39 CCN1C=CC=C1C(=O)C MCULE-6372252385 [1,0,0,0,1,0|2,0,0]=4 2847 B10R1.39 CCN1C=CC=C1C(=O)O MCULE-8676474840 [1,0,0,0,1,0|2,0,0]=4 2848 B10R1.39 CCN1N=CC=C1C(=O)N MCULE-3000487933 [1,0,0,0,1,0|2,0,0]=4 2849 B10R1.39 COC1=C(C=CS1)C(=O)O MCULE-8538241423 [1,0,0,0,1,0|2,0,0]=4 2850 B10R1.39 COC1=C(OC=C1)C(=O)C MCULE-8704265469 [1,0,0,0,1,0|2,0,0]=4 2851 B10R1.39 COC1=C(OC=C1)C(=O)O MCULE-4712559734 [1,0,0,0,1,0|2,0,0]=4 2852 B10R1.39 COC1=C(SC=C1)C(=O)C MCULE-5997980163 [1,0,0,0,1,0|2,0,0]=4 2853 B10R1.39 COC1=C(SC=C1)C(=O)Cl MCULE-2023690761 [1,0,0,0,1,0|2,0,0]=4 2854 B10R1.39 COC1=C(SC=C1)C(=O)N MCULE-5736935234 [1,0,0,0,1,0|1,0,0]=3 2855 B10R1.39 COC1=C(SC=C1)C(=O)O MCULE-3070084501 [1,0,0,0,1,0|2,0,0]=4 2856 B10R1.39 COC1=CSC=C1C(=O)Cl MCULE-7267035429 [1,0,0,0,1,0|2,0,0]=4 2857 B10R1.39 COC1=CSC=C1C(=O)N MCULE-4769347701 [1,0,0,0,1,0|1,0,0]=3 2858 B10R1.39 COC1=CSC=C1C(=O)O MCULE-6921030563 [1,0,0,0,1,0|2,0,0]=4 2859 B12R1.279 CCCC1=CC=CC(=C1)C(=O)O MCULE-9597281086 [0,0,0,0,1,1|2,0,0]=4 2860 B12R1.279 CCCC1=NC=CC(=C1)C(=O)N MCULE-3329373146 [0,0,0,0,1,1|2,0,0]=4 2861 B12R1.279 CCOC1=CC(=CC=C1)C(=O)Cl MCULE-7595697210 [0,0,0,0,1,1|1,0,0]=3 2862 B12R1.279 CCOC1=CC(=CC=C1)C(=O)N MCULE-5490716076 [0,0,0,0,1,1|0,0,0]=2 2863 B12R1.279 CCOC1=CC(=CC=C1)C(=S)N MCULE-1978893588 [0,0,0,0,1,1|0,1,0]=3 2864 B12R1.279 CCOC1=CC(=CC=C1)C(C)N MCULE-7878235015 [0,0,0,0,1,1|1,0,1]=4 2865 B12R1.279 CCOC1=CC(=CC=C1)[C@@H](C)N MCULE-1403275057 [0,0,0,0,1,1|1,0,1]=4 2866 B12R1.279 CCOC1=CC(=CC=C1)[C@@H](C)N MCULE-4850261521 [0,0,0,0,1,1|1,0,1]=4 2867 B12R1.279 CCOC1=CC(=CN=C1)C(=O)O MCULE-5354619663 [0,0,0,0,1,1|2,0,0]=4 2868 B12R1.279 CCOC1=CC(=NC=C1)C(=O)O MCULE-7682530185 [0,0,0,0,1,1|2,0,0]=4 2869 B12R1.279 CCOC1=CC(=NC=C1)C(=O)O MCULE-7872524127 [0,0,0,0,1,1|2,0,0]=4 2870 B12R1.279 CCOC1=CC=CC(=C1)C(=O)C MCULE-8106274239 [0,0,0,0,1,1|1,0,0]=3 2871 B12R1.279 CCOC1=CC=CC(=C1)C(=O)O MCULE-7432305245 [0,0,0,0,1,1|1,0,0]=3 2872 B12R1.279 CCOC1=CC=CC(=C1)C(C)N MCULE-2678109014 [0,0,0,0,1,1|1,0,1]=4 2873 B12R1.279 CCOC1=CC=CC(=C1)N(=O)=O MCULE-7886778575 [0,0,0,0,1,1|2,0,0]=4 2874 B12R1.279 CCOC1=CC=CC(=C1)[C@@H](C)N MCULE-1021372343 [0,0,0,0,1,1|1,0,1]=4 2875 B12R1.279 CCOC1=CC=CC(=C1)[C@@H](C)N MCULE-5806295044 [0,0,0,0,1,1|1,0,1]=4 2876 B12R1.279 CCOC1=CC=CC(=C1)[C@H](C)N MCULE-2436324489 [0,0,0,0,1,1|1,0,1]=4 2877 B12R1.279 CCOC1=CC=CC(=C1)[C@H](C)N MCULE-5367190821 [0,0,0,0,1,1|1,0,1]=4 2878 B12R1.279 CCOC1=CC=CC(=N1)C(=O)O MCULE-6500895534 [0,0,0,0,1,1|1,0,0]=3 2879 B12R1.279 CCOC1=CN=CC(=C1)C(=O)C MCULE-9520404965 [0,0,0,0,1,1|2,0,0]=4 2880 B12R1.279 CCOC1=NC(=CC=N1)C(=O)O MCULE-6903415409 [0,0,0,0,1,1|2,0,0]=4 2881 B12R1.279 CCOC1=NC(=CN=C1)C(=O)O MCULE-4095377122 [0,0,0,0,1,1|2,0,0]=4 2882 B12R1.279 CCOC1=NC(=NC=C1)C(=O)O MCULE-3815912252 [0,0,0,0,1,1|2,0,0]=4 2883 B12R1.279 CCOC1=NC=CC(=C1)C(=O)O MCULE-5968329907 [0,0,0,0,1,1|2,0,0]=4 2884 B12R1.279 CCOC1=NC=NC(=C1)C(=O)N MCULE-3373208766 [0,0,0,0,1,1|2,0,0]=4 2885 B12R1.279 CCSC1=CC(=CC=C1)C(=O)O MCULE-7070052311 [0,0,0,0,1,1|1,1,0]=4 2886 B12R1.279 NCCC1=CC(=CC=C1)C(=O)N MCULE-1278534427 [0,0,0,0,1,1|2,0,0]=4 2887 B12R1.279 NCCC1=CC(=CC=C1)C(=O)N MCULE-7022418273 [0,0,0,0,1,1|2,0,0]=4 2888 B14R1.482 C=C(Br)CCC1=C(C=CC=C1)OCC MCULE-6262271282 [0,0,0,0,0,2|2,0,0]=4 2889 B14R1.482 C=C(C)CCC1=C(C=CC=C1)OCC MCULE-3433800045 [0,0,0,0,0,2|2,0,0]=4 2890 B14R1.482 C=C(Cl)CCC1=C(C=CC=C1)OCC MCULE-5452707667 [0,0,0,0,0,2|2,0,0]=4 2891 B14R1.482 CCCC1=CC=CC=C1OCC(=O)O MCULE-4342520465 [0,0,0,0,0,2|2,0,0]=4 2892 B14R1.482 CCOC1=C(C=CC=C1)CCC(=O)O MCULE-3532433032 [0,0,0,0,0,2|1,0,0]=3 2893 B14R1.482 CCOC1=C(C=CC=C1)CNC(=O)C MCULE-8793036824 [0,0,0,0,0,2|1,0,0]=3 2894 B14R1.482 CCOC1=C(C=CC=C1)CNC(=O)N MCULE-7978844389 [0,0,0,0,0,2|0,0,0]=2 2895 B14R1.482 CCOC1=C(C=CC=C1)OCC(=O)O MCULE-2394958933 [0,0,0,0,0,2|1,0,0]=3 2896 B14R1.482 CCOC1=C(C=CC=C1)OCC(C)N MCULE-1152980616 [0,0,0,0,0,2|1,0,1]=4 2897 B14R1.482 CCOC1=CC=CC=C1/C=C/C(=O)Cl MCULE-6270397575 [0,0,0,0,0,2|1,0,0]=3 2898 B14R1.482 CCOC1=CC=CC=C1/C=C/C(=O)O MCULE-1564202838 [0,0,0,0,0,2|1,0,0]=3 2899 B14R1.482 CCOC1=CC=CC=C1C=CC(=O)O MCULE-5931303971 [0,0,0,0,0,2|1,0,0]=3 2900 B14R1.482 CCOC1=CC=CC=C1OCC(=O)C MCULE-1236152485 [0,0,0,0,0,2|1,0,0]=3