0 B13R1.572 C#CCOC1=C(C=CC=C1)C(=O)O MCULE-7741074874 [0,0,0,0,0,0|1,1,2]=4 1 B13R1.572 C#CCSC1=C(C=CC=C1)C(=O)O MCULE-5839235873 [0,0,0,0,0,0|1,0,2]=3 2 B13R1.572 C=CCCC1=CC=CC=C1C(=O)O MCULE-5632595640 [0,0,0,0,0,0|2,0,2]=4 3 B13R1.572 C=CCNC1=C(C=CC=C1)C(=O)O MCULE-9702416960 [0,0,0,0,0,0|2,0,2]=4 4 B13R1.572 C=CCOC1=C(C=CC=C1)C(=O)O MCULE-1089670819 [0,0,0,0,0,0|1,1,2]=4 5 B13R1.572 C=CCSC1=C(C=CC=C1)C(=O)O MCULE-1695833130 [0,0,0,0,0,0|1,0,2]=3 6 B13R1.572 C=CCSC1=NC=CC=C1C(=O)O MCULE-5881608200 [0,0,0,0,0,0|2,0,2]=4 7 B13R1.572 CC(=O)C1=C(C=CC=C1)OCCBr MCULE-1480010588 [0,0,0,0,0,0|3,1,0]=4 8 B13R1.572 CCCCC1=C(C=CC=C1)S(=O)[O-] MCULE-1377248898 [0,0,0,0,0,0|3,0,1]=4 9 B13R1.572 CCCCC1=C(C=CC=C1)S(=O)[O-] MCULE-5584840118 [0,0,0,0,0,0|3,0,1]=4 10 B13R1.572 CCCCC1=CC=CC=C1N(=O)=O MCULE-5486377007 [0,0,0,0,0,0|3,0,1]=4 11 B13R1.572 CCCNC1=C(C=CC=C1)C(=O)O MCULE-2686863166 [0,0,0,0,0,0|2,0,0]=2 12 B13R1.572 CCCNC1=C(C=CC=N1)C(=O)N MCULE-4755931477 [0,0,0,0,0,0|4,0,0]=4 13 B13R1.572 CCCNC1=C(C=CC=N1)C(=O)O MCULE-8200252997 [0,0,0,0,0,0|3,0,0]=3 14 B13R1.572 CCCOC1=C(C=CC=C1)C(=O)Cl MCULE-8210790334 [0,0,0,0,0,0|2,1,0]=3 15 B13R1.572 CCCOC1=C(C=CC=C1)C(=O)O MCULE-4040231132 [0,0,0,0,0,0|1,1,0]=2 16 B13R1.572 CCCOC1=C(C=CC=C1)C(=S)N MCULE-7349568312 [0,0,0,0,0,0|2,2,0]=4 17 B13R1.572 CCCOC1=C(C=CC=N1)C(=O)N MCULE-2575608500 [0,0,0,0,0,0|3,1,0]=4 18 B13R1.572 CCCOC1=C(C=CC=N1)C(=O)O MCULE-2016017979 [0,0,0,0,0,0|2,1,0]=3 19 B13R1.572 CCCOC1=C(N=CC=C1)C(=O)O MCULE-3598840448 [0,0,0,0,0,0|2,1,0]=3 20 B13R1.572 CCCOC1=CC=CC=C1B(O)O MCULE-8328492055 [0,0,0,0,0,0|2,1,1]=4 21 B13R1.572 CCCOC1=CC=CC=C1C(=N)N MCULE-6467101067 [0,0,0,0,0,0|3,1,0]=4 22 B13R1.572 CCCOC1=CC=CC=C1C(=O)C MCULE-3884621389 [0,0,0,0,0,0|2,1,0]=3 23 B13R1.572 CCCOC1=CC=CC=C1C(=O)N MCULE-3029543543 [0,0,0,0,0,0|2,1,0]=3 24 B13R1.572 CCCOC1=CC=CC=C1C(C)O MCULE-2342045926 [0,0,0,0,0,0|2,1,1]=4 25 B13R1.572 CCCOC1=CC=CC=C1N(=O)=O MCULE-8355957094 [0,0,0,0,0,0|2,1,1]=4 26 B13R1.572 CCCSC1=C(C=CC=C1)C(=O)C MCULE-3953451992 [0,0,0,0,0,0|2,0,0]=2 27 B13R1.572 CCCSC1=C(C=CC=C1)C(=O)Cl MCULE-5010866395 [0,0,0,0,0,0|2,0,0]=2 28 B13R1.572 CCCSC1=C(C=CC=C1)C(=O)N MCULE-6795941589 [0,0,0,0,0,0|2,0,0]=2 29 B13R1.572 CCCSC1=C(C=CC=C1)C(=O)O MCULE-6053101485 [0,0,0,0,0,0|1,0,0]=1 30 B13R1.572 CCCSC1=C(C=CC=C1)C(C)O MCULE-5575977098 [0,0,0,0,0,0|2,0,1]=3 31 B13R1.572 CCCSC1=C(C=CC=N1)C(=O)N MCULE-7750921543 [0,0,0,0,0,0|3,0,0]=3 32 B13R1.572 CCCSC1=C(C=CC=N1)C(=O)O MCULE-9640193622 [0,0,0,0,0,0|2,0,0]=2 33 B13R1.572 CCCSC1=NC=CC=C1C(=O)Cl MCULE-2694537248 [0,0,0,0,0,0|3,0,0]=3 34 B13R1.572 CCNCC1=C(C=CC=C1)B(O)O MCULE-5073172009 [0,0,0,0,0,0|3,0,1]=4 35 B13R1.572 CCNCC1=C(C=CC=C1)C(=O)O MCULE-4361791787 [0,0,0,0,0,0|2,0,0]=2 36 B13R1.572 CCNCC1=C(C=CC=C1)C(=O)O MCULE-6028265223 [0,0,0,0,0,0|2,0,0]=2 37 B13R1.572 CCNCC1=C(C=CC=C1)N(=O)=O MCULE-6063380604 [0,0,0,0,0,0|3,0,1]=4 38 B13R1.572 CCNCC1=C(C=CC=C1)N(=O)=O MCULE-7027231264 [0,0,0,0,0,0|3,0,1]=4 39 B13R1.572 CCOCC1=CC=CC=C1B(O)O MCULE-8721913937 [0,0,0,0,0,0|3,0,1]=4 40 B13R1.572 CCOCC1=CC=CC=C1C(=O)O MCULE-7012384334 [0,0,0,0,0,0|2,0,0]=2 41 B13R1.572 CCSCC1=C(C=CC=C1)C(=O)O MCULE-1032867479 [0,0,0,0,0,0|2,0,0]=2 42 B13R1.572 COCCC1=C(C=CC=C1)C(=O)O MCULE-4800031009 [0,0,0,0,0,0|3,0,0]=3 43 B13R1.572 COCOC1=CC=CC=C1C(=O)C MCULE-7840841654 [0,0,0,0,0,0|3,1,0]=4 44 B13R1.572 N#CCOC1=CC=CC=C1C(=O)O MCULE-4069343397 [0,0,0,0,0,0|2,1,1]=4 45 B13R1.572 N#CCSC1=CC=CC=C1C(=O)O MCULE-6190273389 [0,0,0,0,0,0|2,0,1]=3 46 B13R1.572 N#N=NCC1=C(C=CC=C1)C(=O)O MCULE-3484505016 [0,0,0,0,0,0|4,0,0]=4 47 B13R1.572 NC(=O)C1=C(C=CC=C1)OCCCl MCULE-1036908877 [0,0,0,0,0,0|3,1,0]=4 48 B13R1.572 NC(=O)C1=C(C=CC=C1)OCCO MCULE-9109793930 [0,0,0,0,0,0|3,1,0]=4 49 B13R1.572 NC(=O)C1=CC=CC=C1NCCCl MCULE-1849239600 [0,0,0,0,0,0|4,0,0]=4 50 B13R1.572 NC(=O)C1=CC=CC=C1OCCBr MCULE-7751341846 [0,0,0,0,0,0|3,1,0]=4 51 B13R1.572 NCCNC1=CC=CC=C1C(=O)O MCULE-1486888569 [0,0,0,0,0,0|3,0,0]=3 52 B13R1.572 NCCNC1=CC=CC=C1C(=O)O MCULE-5947576201 [0,0,0,0,0,0|3,0,0]=3 53 B13R1.572 NCCNC1=NC=CC=C1C(=O)O MCULE-8241332120 [0,0,0,0,0,0|4,0,0]=4 54 B13R1.572 NCCOC1=CC=CC=C1C(=O)N MCULE-9991178429 [0,0,0,0,0,0|3,1,0]=4 55 B13R1.572 NCCSC1=CC=CC=C1C(=O)O MCULE-4576165477 [0,0,0,0,0,0|2,0,0]=2 56 B13R1.572 NCCSC1=CC=CC=C1C(=O)O MCULE-7455628895 [0,0,0,0,0,0|2,0,0]=2 57 B13R1.572 O=C(O)C1=C(C=CC=C1)NCCO MCULE-8120654197 [0,0,0,0,0,0|3,0,0]=3 58 B13R1.572 O=C(O)C1=C(C=CC=C1)OCCO MCULE-7898157705 [0,0,0,0,0,0|2,1,0]=3 59 B13R1.572 O=C(O)C1=C(C=CC=C1)SCCO MCULE-5541181003 [0,0,0,0,0,0|2,0,0]=2 60 B13R1.572 O=C(O)C1=C(N=CC=C1)NCCO MCULE-3858468150 [0,0,0,0,0,0|4,0,0]=4 61 B13R1.572 O=C(O)C1=C(N=CC=C1)OCCO MCULE-3685380826 [0,0,0,0,0,0|3,1,0]=4 62 B13R1.572 O=C(O)C1=CC=CC=C1OCCF MCULE-6186730357 [0,0,0,0,0,0|2,1,0]=3 63 B13R1.572 O=C(O)C1=NC=CC=C1OCCO MCULE-4308585496 [0,0,0,0,0,0|3,1,0]=4 64 B13R1.572 O=C(O)C1=NC=CC=C1OCCO MCULE-6759099665 [0,0,0,0,0,0|3,1,0]=4 65 B12R1.121 CCCOC1=C(C=CC=C1)CO MCULE-3522593383 [1,0,0,0,0,0|1,1,1]=4 66 B12R1.121 CCCOC1=C(C=CC=N1)C=O MCULE-5574113587 [1,0,0,0,0,0|2,1,0]=4 67 B12R1.121 CCCOC1=CC=CC=C1C=O MCULE-7807414930 [1,0,0,0,0,0|1,1,0]=3 68 B12R1.121 CCCSC1=C(C=CC=C1)C=O MCULE-1279835793 [1,0,0,0,0,0|1,0,0]=2 69 B12R1.121 CCCSC1=C(C=CC=C1)CO MCULE-1531044166 [1,0,0,0,0,0|1,0,1]=3 70 B12R1.121 CCCSC1=C(C=CC=C1)SC MCULE-6586317823 [1,0,0,0,0,0|3,0,0]=4 71 B12R1.121 CCCSC1=CC=CC=C1OC MCULE-6410640260 [1,0,0,0,0,0|3,0,0]=4 72 B12R1.121 O=CC1=C(C=CC=C1)OCCCl MCULE-1073530018 [1,0,0,0,0,0|2,1,0]=4 73 B12R1.121 O=CC1=C(C=CC=C1)OCCF MCULE-3166781700 [1,0,0,0,0,0|2,1,0]=4 74 B12R1.121 O=CC1=CC=CC=C1OCCBr MCULE-4427069708 [1,0,0,0,0,0|2,1,0]=4 75 B12R1.121 O=CC1=CC=CC=C1OCCO MCULE-7840607650 [1,0,0,0,0,0|2,1,0]=4 76 B12R1.283 C=CCC1=CC=CC=C1C(=O)O MCULE-1091378974 [1,0,0,0,0,0|1,0,2]=4 77 B12R1.283 CCCC1=C(C=CC=C1)B(O)O MCULE-8508228210 [1,0,0,0,0,0|2,0,1]=4 78 B12R1.283 CCCC1=C(C=CC=C1)C(=O)O MCULE-8469879199 [1,0,0,0,0,0|1,0,0]=2 79 B12R1.283 CCCC1=C(C=NC=N1)C(=O)O MCULE-5950783587 [1,0,0,0,0,0|3,0,0]=4 80 B12R1.283 CCCC1=CC=CN=C1C(=O)O MCULE-7682254205 [1,0,0,0,0,0|2,0,0]=3 81 B12R1.283 CCNC1=C(C=CC=C1)C(=O)O MCULE-5226367609 [1,0,0,0,0,0|1,0,0]=2 82 B12R1.283 CCNC1=C(C=CC=C1)N(=O)=O MCULE-7178422589 [1,0,0,0,0,0|2,0,1]=4 83 B12R1.283 CCNC1=CC=CN=C1C(=O)O MCULE-2828865660 [1,0,0,0,0,0|2,0,0]=3 84 B12R1.283 CCNC1=CC=CN=C1C(=O)O MCULE-5929167420 [1,0,0,0,0,0|2,0,0]=3 85 B12R1.283 CCNC1=NC=CC=C1C(=O)O MCULE-2120786961 [1,0,0,0,0,0|2,0,0]=3 86 B12R1.283 CCOC1=C(C=CC=C1)C(=N)N MCULE-5922998663 [1,0,0,0,0,0|2,1,0]=4 87 B12R1.283 CCOC1=C(C=CC=C1)C(=N)N MCULE-7041745200 [1,0,0,0,0,0|2,1,0]=4 88 B12R1.283 CCOC1=C(C=CC=C1)C(=O)C MCULE-1751068861 [1,0,0,0,0,0|1,1,0]=3 89 B12R1.283 CCOC1=C(C=CC=C1)C(=S)N MCULE-9679793141 [1,0,0,0,0,0|1,2,0]=4 90 B12R1.283 CCOC1=C(C=CC=C1)C(C)O MCULE-5334441472 [1,0,0,0,0,0|1,1,1]=4 91 B12R1.283 CCOC1=C(C=CC=C1)[C@H](C)O MCULE-1875599425 [1,0,0,0,0,0|1,1,1]=4 92 B12R1.283 CCOC1=C(C=CC=N1)C(=O)N MCULE-8595017314 [1,0,0,0,0,0|2,1,0]=4 93 B12R1.283 CCOC1=C(C=CN=C1)C(=O)O MCULE-7349876413 [1,0,0,0,0,0|1,1,0]=3 94 B12R1.283 CCOC1=C(N=CC=C1)C(=O)O MCULE-5509609544 [1,0,0,0,0,0|1,1,0]=3 95 B12R1.283 CCOC1=CC=CC=C1B(O)O MCULE-8547658682 [1,0,0,0,0,0|1,1,1]=4 96 B12R1.283 CCOC1=CC=CC=C1C(=O)Cl MCULE-9111125316 [1,0,0,0,0,0|1,1,0]=3 97 B12R1.283 CCOC1=CC=CC=C1C(=O)N MCULE-4151494884 [1,0,0,0,0,0|1,1,0]=3 98 B12R1.283 CCOC1=CC=CC=C1C(=O)O MCULE-8428889014 [1,0,0,0,0,0|0,1,0]=2 99 B12R1.283 CCOC1=CC=CC=C1N(=O)=O MCULE-5995501561 [1,0,0,0,0,0|1,1,1]=4 100 B12R1.283 CCOC1=CC=CN=C1C(=O)C MCULE-3280380919 [1,0,0,0,0,0|2,1,0]=4 101 B12R1.283 CCOC1=CC=NC=C1C(=O)O MCULE-6292642166 [1,0,0,0,0,0|1,1,0]=3 102 B12R1.283 CCOC1=NC=CC=C1C(=O)C MCULE-1586843009 [1,0,0,0,0,0|2,1,0]=4 103 B12R1.283 CCOC1=NC=CC=C1C(=O)Cl MCULE-8353243811 [1,0,0,0,0,0|2,1,0]=4 104 B12R1.283 CCOC1=NC=CC=C1C(=O)O MCULE-7005430233 [1,0,0,0,0,0|1,1,0]=3 105 B12R1.283 CCOC1=NC=CN=C1C(=O)O MCULE-8012529476 [1,0,0,0,0,0|2,1,0]=4 106 B12R1.283 CCSC1=C(C=CC=C1)C(=O)C MCULE-4484259642 [1,0,0,0,0,0|1,0,0]=2 107 B12R1.283 CCSC1=C(C=CC=C1)C(=O)O MCULE-8967903143 [1,0,0,0,0,0|0,0,0]=1 108 B12R1.283 CCSC1=C(C=CC=C1)C(C)C MCULE-8792690055 [1,0,0,0,0,0|2,0,1]=4 109 B12R1.283 CCSC1=C(C=CC=N1)N(=O)=O MCULE-7520930951 [1,0,0,0,0,0|2,0,1]=4 110 B12R1.283 CCSC1=C(C=CN=C1)C(=O)O MCULE-6106365678 [1,0,0,0,0,0|1,0,0]=2 111 B12R1.283 CCSC1=C(N=CC=C1)C(=O)O MCULE-2281159092 [1,0,0,0,0,0|1,0,0]=2 112 B12R1.283 CCSC1=C(N=CC=N1)C(=O)O MCULE-7922212684 [1,0,0,0,0,0|2,0,0]=3 113 B12R1.283 CCSC1=CC=CC=C1B(O)O MCULE-5868914147 [1,0,0,0,0,0|1,0,1]=3 114 B12R1.283 CCSC1=CC=CN=C1C(=O)C MCULE-9261558140 [1,0,0,0,0,0|2,0,0]=3 115 B12R1.283 CCSC1=CC=NC=C1N(=O)=O MCULE-2414891552 [1,0,0,0,0,0|2,0,1]=4 116 B12R1.283 CCSC1=NC=CC=C1C(=O)Cl MCULE-5664836937 [1,0,0,0,0,0|2,0,0]=3 117 B12R1.283 CCSC1=NC=CC=C1C(=O)N MCULE-6494574451 [1,0,0,0,0,0|2,0,0]=3 118 B12R1.283 CCSC1=NC=CC=C1C(=O)O MCULE-1303756734 [1,0,0,0,0,0|1,0,0]=2 119 B12R1.283 CNCC1=C(C=CC=C1)C(=O)O MCULE-8342449642 [1,0,0,0,0,0|2,0,0]=3 120 B12R1.283 COCC1=C(C=CC=C1)C(=O)O MCULE-6800520007 [1,0,0,0,0,0|2,0,0]=3 121 B12R1.283 COCC1=CC=CC=C1C(=O)C MCULE-2485252541 [1,0,0,0,0,0|3,0,0]=4 122 B12R1.283 CSCC1=C(N=CC=C1)C(=O)O MCULE-1965156711 [1,0,0,0,0,0|3,0,0]=4 123 B12R1.283 CSSC1=C(C=CC=C1)C(=O)O MCULE-8098427569 [1,0,0,0,0,0|1,0,0]=2 124 B12R1.283 N#CCC1=CC=CC=C1C(=O)O MCULE-1971288593 [1,0,0,0,0,0|2,0,1]=4 125 B12R1.283 N#N=NC1=CC=CC=C1C(=O)O MCULE-7645929034 [1,0,0,0,0,0|3,0,0]=4 126 B12R1.283 NCCC1=C(C=CC=C1)C(=O)O MCULE-5271162895 [1,0,0,0,0,0|2,0,0]=3 127 B12R1.283 NCCC1=C(C=CC=C1)C(=O)O MCULE-5470409795 [1,0,0,0,0,0|2,0,0]=3 128 B12R1.283 O=CNC1=C(C=CC=C1)C(=O)O MCULE-3344929418 [1,0,0,0,0,0|2,0,1]=4 129 B14R1.67 C=CCSC1=CC=C(C=C1C(=O)O)Cl MCULE-1013488780 [0,1,0,0,0,0|1,0,2]=4 130 B14R1.67 CC1=CC=C(C(=C1)C(=O)O)OCCF MCULE-6711067247 [0,1,0,0,0,0|2,1,0]=4 131 B14R1.67 CCCNC1=CC=C(C=C1C(=O)O)C MCULE-6776135484 [0,1,0,0,0,0|2,0,0]=3 132 B14R1.67 CCCOC1=C(C=C(C=C1)Cl)C(=O)C MCULE-9311751539 [0,1,0,0,0,0|2,1,0]=4 133 B14R1.67 CCCOC1=C(C=C(C=C1)F)C(=O)C MCULE-2929608670 [0,1,0,0,0,0|2,1,0]=4 134 B14R1.67 CCCOC1=C(C=C(C=C1)F)C(=O)O MCULE-5784726656 [0,1,0,0,0,0|1,1,0]=3 135 B14R1.67 CCCOC1=CC=C(C=C1C(=O)C)C MCULE-3601145155 [0,1,0,0,0,0|2,1,0]=4 136 B14R1.67 CCCOC1=CC=C(C=C1C(=O)Cl)Br MCULE-8465989531 [0,1,0,0,0,0|2,1,0]=4 137 B14R1.67 CCCOC1=CC=C(C=C1C(=O)Cl)C MCULE-7645161621 [0,1,0,0,0,0|2,1,0]=4 138 B14R1.67 CCCOC1=CC=C(C=C1C(=O)Cl)Cl MCULE-8909285486 [0,1,0,0,0,0|2,1,0]=4 139 B14R1.67 CCCOC1=CC=C(C=C1C(=O)Cl)F MCULE-9311218662 [0,1,0,0,0,0|2,1,0]=4 140 B14R1.67 CCCOC1=CC=C(C=C1C(=O)N)Br MCULE-8045960882 [0,1,0,0,0,0|2,1,0]=4 141 B14R1.67 CCCOC1=CC=C(C=C1C(=O)N)Cl MCULE-9858776604 [0,1,0,0,0,0|2,1,0]=4 142 B14R1.67 CCCOC1=CC=C(C=C1C(=O)O)Br MCULE-4286279650 [0,1,0,0,0,0|1,1,0]=3 143 B14R1.67 CCCOC1=CC=C(C=C1C(=O)O)C MCULE-8530114045 [0,1,0,0,0,0|1,1,0]=3 144 B14R1.67 CCCOC1=CC=C(C=C1C(=O)O)Cl MCULE-4321189481 [0,1,0,0,0,0|1,1,0]=3 145 B14R1.67 CCCOC1=CC=C(C=C1C(=O)O)I MCULE-2766772806 [0,1,0,0,0,0|1,1,0]=3 146 B14R1.67 CCCOC1=CC=C(C=C1C(=O)O)N MCULE-1064997734 [0,1,0,0,0,0|1,1,0]=3 147 B14R1.67 CCCSC1=C(C=C(C=C1)Cl)N(=O)=O MCULE-8948081135 [0,1,0,0,0,0|2,0,1]=4 148 B14R1.67 O=C(O)C1=C(C=CC(=C1)Cl)OCCF MCULE-4081986484 [0,1,0,0,0,0|2,1,0]=4 149 B14R1.67 O=C(O)C1=CC(=CC=C1OCCF)I MCULE-3054632570 [0,1,0,0,0,0|2,1,0]=4 150 B14R1.623 CCC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-5789306179 [0,1,0,0,0,0|2,0,0]=3 151 B14R1.623 CCC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-9204885614 [0,1,0,0,0,0|2,0,0]=3 152 B14R1.623 CCC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-4370494862 [0,1,0,0,0,0|2,0,0]=3 153 B14R1.623 CCC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-9805126332 [0,1,0,0,0,0|2,0,0]=3 154 B14R1.623 CCOC(=O)C1=C(C=CC=C1)C(=O)C MCULE-7822545927 [0,1,0,0,0,0|3,0,0]=4 155 B14R1.623 CCOC(=O)C1=CC=CN=C1C(=O)O MCULE-1420682383 [0,1,0,0,0,0|3,0,0]=4 156 B14R1.623 NCC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-1053634533 [0,1,0,0,0,0|3,0,0]=4 157 B14R1.623 NCC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-1462703532 [0,1,0,0,0,0|3,0,0]=4 158 B14R1.623 NCC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-4017292379 [0,1,0,0,0,0|3,0,0]=4 159 B14R1.623 NCC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-5999835646 [0,1,0,0,0,0|3,0,0]=4 160 B14R1.623 N[C@@H](CCF)C1=CC=CC=C1C(=O)O MCULE-2918706888 [0,1,0,0,0,0|3,0,0]=4 161 B14R1.623 N[C@@H](CCF)C1=CC=CC=C1C(=O)O MCULE-7090959004 [0,1,0,0,0,0|3,0,0]=4 162 B14R1.623 N[C@@H](CCO)C1=CC=CC=C1C(=O)O MCULE-2964614242 [0,1,0,0,0,0|3,0,0]=4 163 B14R1.623 N[C@@H](CCO)C1=CC=CC=C1C(=O)O MCULE-6981692938 [0,1,0,0,0,0|3,0,0]=4 164 B14R1.623 N[C@H](CCF)C1=CC=CC=C1C(=O)O MCULE-2587716976 [0,1,0,0,0,0|3,0,0]=4 165 B14R1.623 N[C@H](CCF)C1=CC=CC=C1C(=O)O MCULE-5751324787 [0,1,0,0,0,0|3,0,0]=4 166 B14R1.623 N[C@H](CCO)C1=CC=CC=C1C(=O)O MCULE-5600559750 [0,1,0,0,0,0|3,0,0]=4 167 B14R1.623 N[C@H](CCO)C1=CC=CC=C1C(=O)O MCULE-8456943868 [0,1,0,0,0,0|3,0,0]=4 168 B14R1.623 O=C(O)C1=CC=CC=C1S(=O)CCO MCULE-2177222526 [0,1,0,0,0,0|2,0,1]=4 169 B14R1.760 CCCOC1=C(C=CC(=N1)C)C(=O)O MCULE-1620997473 [0,1,0,0,0,0|2,1,0]=4 170 B14R1.760 CCCOC1=CC(=CC=C1C(=O)C)F MCULE-3290111263 [0,1,0,0,0,0|2,1,0]=4 171 B14R1.760 CCCOC1=CC(=CC=C1C(=O)Cl)F MCULE-7580516409 [0,1,0,0,0,0|2,1,0]=4 172 B14R1.760 CCCOC1=CC(=CC=C1C(=O)N)Br MCULE-2865204442 [0,1,0,0,0,0|2,1,0]=4 173 B14R1.760 CCCOC1=CC(=CC=C1C(=O)O)Br MCULE-2204752519 [0,1,0,0,0,0|1,1,0]=3 174 B14R1.760 CCCOC1=CC(=CC=C1C(=O)O)F MCULE-3278254901 [0,1,0,0,0,0|1,1,0]=3 175 B14R1.789 CCCOC1=C(C=CC=C1)C(=O)CN MCULE-1340893566 [0,1,0,0,0,0|2,1,0]=4 176 B14R1.789 CCCOC1=C(C=CC=C1)C(=O)CN MCULE-8722450330 [0,1,0,0,0,0|2,1,0]=4 177 B14R1.789 CCCOC1=C(C=CC=C1)C(=O)NN MCULE-6324481251 [0,1,0,0,0,0|2,1,0]=4 178 B14R1.789 CCCOC1=NC=CC=C1C(=O)OC MCULE-9448575483 [0,1,0,0,0,0|2,1,0]=4 179 B14R1.789 COC(=O)C1=C(C=CC=C1)OCCBr MCULE-8364254291 [0,1,0,0,0,0|2,1,0]=4 180 B14R1.789 COC(=O)C1=C(C=CC=C1)OCCN MCULE-8287119427 [0,1,0,0,0,0|2,1,0]=4 181 B14R1.789 COC(=O)C1=C(C=CC=C1)OCCO MCULE-3258485949 [0,1,0,0,0,0|2,1,0]=4 182 B14R1.789 COC(=O)C1=C(C=CC=C1)SCC#N MCULE-4089331361 [0,1,0,0,0,0|2,0,1]=4 183 B14R1.789 COC(=O)C1=CC=CC=C1C#CCO MCULE-1027683354 [0,1,0,0,0,0|3,0,0]=4 184 B14R1.789 COC(=O)C1=CC=CC=C1NCCO MCULE-8832392420 [0,1,0,0,0,0|3,0,0]=4 185 B14R1.903 CCCCNC1=C(C=CC=N1)C(=O)O MCULE-7063162334 [0,1,0,0,0,0|3,0,0]=4 186 B14R1.903 CCCCNC1=CC=CC=C1C(=O)O MCULE-5804543532 [0,1,0,0,0,0|2,0,0]=3 187 B14R1.903 CCCCOC1=C(C=CC=C1)C(=O)Cl MCULE-7987200887 [0,1,0,0,0,0|2,1,0]=4 188 B14R1.903 CCCCOC1=CC=CC=C1C(=O)C MCULE-3679722833 [0,1,0,0,0,0|2,1,0]=4 189 B14R1.903 CCCCOC1=CC=CC=C1C(=O)O MCULE-1629628067 [0,1,0,0,0,0|1,1,0]=3 190 B14R1.903 CCCCOC1=NC=CC=C1C(=O)O MCULE-6001673419 [0,1,0,0,0,0|2,1,0]=4 191 B14R1.903 CCCCSC1=C(C=CC=C1)C(=O)C MCULE-3637333747 [0,1,0,0,0,0|2,0,0]=3 192 B14R1.903 CCCCSC1=C(C=CC=C1)C(=O)Cl MCULE-9079945176 [0,1,0,0,0,0|2,0,0]=3 193 B14R1.903 CCCCSC1=C(C=CC=C1)C(=O)O MCULE-6465717857 [0,1,0,0,0,0|1,0,0]=2 194 B14R1.903 CCCCSC1=C(C=CC=C1)C(C)O MCULE-2417565482 [0,1,0,0,0,0|2,0,1]=4 195 B14R1.903 CCCCSC1=CC=CC=C1C(=O)N MCULE-7889882768 [0,1,0,0,0,0|2,0,0]=3 196 B14R1.903 COCCNC1=NC=CC=C1C(=O)O MCULE-5553465862 [0,1,0,0,0,0|3,0,0]=4 197 B14R1.903 COCCOC1=C(C=CC=C1)C(=O)O MCULE-3683927750 [0,1,0,0,0,0|1,1,0]=3 198 B14R1.903 COCCOC1=C(C=CC=N1)C(=O)O MCULE-3383285504 [0,1,0,0,0,0|2,1,0]=4 199 B14R1.903 COCCOC1=C(C=CN=C1)C(=O)O MCULE-5631252425 [0,1,0,0,0,0|2,1,0]=4 200 B14R1.903 COCCOC1=C(C=NC=C1)C(=O)O MCULE-4377794267 [0,1,0,0,0,0|2,1,0]=4 201 B14R1.903 COCCOC1=C(N=CC=C1)C(=O)O MCULE-8937211043 [0,1,0,0,0,0|2,1,0]=4 202 B14R1.903 COCCSC1=C(C=CC=C1)C(=O)O MCULE-7151836758 [0,1,0,0,0,0|1,0,0]=2 203 B14R1.903 N#CCCNC1=CC=CC=C1C(=O)O MCULE-4978968143 [0,1,0,0,0,0|2,0,1]=4 204 B14R1.903 N#CCCSC1=NC=CC=C1C(=O)O MCULE-4996284040 [0,1,0,0,0,0|2,0,1]=4 205 B14R1.903 NCCCNC1=NC=CC=C1C(=O)O MCULE-8717616750 [0,1,0,0,0,0|3,0,0]=4 206 B14R1.903 NCCCOC1=CC=CC=C1C(=O)N MCULE-7651389921 [0,1,0,0,0,0|2,1,0]=4 207 B14R1.903 O=C(O)C1=C(N=CC=C1)NCCCO MCULE-9656784191 [0,1,0,0,0,0|3,0,0]=4 208 B14R1.3302 CCC(=O)NC1=C(C=CC=C1)C(=O)N MCULE-6424883380 [0,1,0,0,0,0|3,0,0]=4 209 B14R1.3302 CCC(=O)NC1=CC=CC=C1C(=O)O MCULE-4894157635 [0,1,0,0,0,0|2,0,0]=3 210 B14R1.3302 CCC(=O)OC1=CC=CC=C1C(=O)O MCULE-1553940048 [0,1,0,0,0,0|1,1,0]=3 211 B14R1.3302 CCC(C)NC1=C(C=CC=N1)C(=O)O MCULE-3146821655 [0,1,0,0,0,0|3,0,0]=4 212 B14R1.3302 CCC(C)OC1=C(C=CC=C1)C(=O)O MCULE-8336729442 [0,1,0,0,0,0|1,1,0]=3 213 B14R1.3302 CNC(=O)NC1=C(C=CC=C1)C(=O)O MCULE-8330757012 [0,1,0,0,0,0|3,0,0]=4 214 B14R1.3302 COC(=O)CC1=C(C=CC=C1)C(=O)O MCULE-2120753780 [0,1,0,0,0,0|3,0,0]=4 215 B14R1.3302 COC(=O)NC1=C(C=CC=C1)C(=O)O MCULE-2166405608 [0,1,0,0,0,0|3,0,0]=4 216 B14R1.3302 O=C(CCl)NC1=C(C=CC=C1)C(=O)O MCULE-5294955455 [0,1,0,0,0,0|3,0,0]=4 217 B14R1.4432 CCCOC1=CC=CC(=C1C(=O)O)C MCULE-5591155140 [0,1,0,0,0,0|1,1,0]=3 218 B14R1.4432 COCOC1=CC=CC(=C1C(=O)O)Cl MCULE-4890179099 [0,1,0,0,0,0|2,1,0]=4 219 B14R1.4522 C=C(C)CCC1=CC=CC=C1C(=O)O MCULE-5465546948 [0,1,0,0,0,0|2,0,1]=4 220 B14R1.4522 C=C(C)COC1=CC=CC=C1C(=O)O MCULE-4644369979 [0,1,0,0,0,0|1,1,1]=4 221 B14R1.4522 C=C(C)CSC1=CC=CC=C1C(=O)N MCULE-1499441520 [0,1,0,0,0,0|2,0,1]=4 222 B14R1.4522 CC(=O)C1=C(C=CC=C1)SCC(C)C MCULE-2050466004 [0,1,0,0,0,0|2,0,0]=3 223 B14R1.4522 CC(=O)C1=CC=CC=C1OCC(C)C MCULE-8993929345 [0,1,0,0,0,0|2,1,0]=4 224 B14R1.4522 CC(=O)CSC1=C(N=CC=C1)C(=O)O MCULE-6504247839 [0,1,0,0,0,0|2,0,1]=4 225 B14R1.4522 CC(=O)CSC1=CC=CC=C1C(=O)O MCULE-6104140904 [0,1,0,0,0,0|1,0,1]=3 226 B14R1.4522 CC(=O)CSC1=NC=CC=C1C(=O)O MCULE-4657182160 [0,1,0,0,0,0|2,0,1]=4 227 B14R1.4522 CC(C)CNC1=C(C=CC=N1)C(=O)O MCULE-3622154750 [0,1,0,0,0,0|3,0,0]=4 228 B14R1.4522 CC(C)CNC1=CC=CC=C1C(=O)O MCULE-7634559502 [0,1,0,0,0,0|2,0,0]=3 229 B14R1.4522 CC(C)COC1=C(C=CC=C1)C(=O)O MCULE-5005785928 [0,1,0,0,0,0|1,1,0]=3 230 B14R1.4522 CC(C)COC1=C(C=CC=N1)C(=O)O MCULE-3140132402 [0,1,0,0,0,0|2,1,0]=4 231 B14R1.4522 CC(C)COC1=C(C=CN=C1)C(=O)O MCULE-7657471911 [0,1,0,0,0,0|2,1,0]=4 232 B14R1.4522 CC(C)COC1=CC=CC=C1C(=O)Cl MCULE-1215392458 [0,1,0,0,0,0|2,1,0]=4 233 B14R1.4522 CC(C)COC1=CC=CC=C1C(=O)N MCULE-6365786250 [0,1,0,0,0,0|2,1,0]=4 234 B14R1.4522 CC(C)CSC1=C(C=CC=C1)C(C)O MCULE-3210999655 [0,1,0,0,0,0|2,0,1]=4 235 B14R1.4522 CC(C)CSC1=CC=CC=C1B(O)O MCULE-6650814573 [0,1,0,0,0,0|2,0,1]=4 236 B14R1.4522 CC(C)CSC1=CC=CC=C1C(=O)Cl MCULE-2175762884 [0,1,0,0,0,0|2,0,0]=3 237 B14R1.4522 CC(C)CSC1=CC=CC=C1C(=O)O MCULE-1036927752 [0,1,0,0,0,0|1,0,0]=2 238 B14R1.4522 CC(C)OCC1=CC=CC=C1C(=O)O MCULE-7047399214 [0,1,0,0,0,0|2,0,0]=3 239 B14R1.4522 CN(C)CCC1=C(C=CC=C1)C(=O)O MCULE-8810500745 [0,1,0,0,0,0|3,0,0]=4 240 B14R1.4522 CN(C)CCC1=C(C=CC=C1)C(=O)O MCULE-9463655612 [0,1,0,0,0,0|3,0,0]=4 241 B14R1.4522 CN(C)N=NC1=C(C=CC=C1)C(=O)O MCULE-5928016371 [0,1,0,0,0,0|3,0,0]=4 242 B14R1.4522 NC(=O)CSC1=CC=CC=C1C(=O)O MCULE-9086395929 [0,1,0,0,0,0|2,0,1]=4 243 B14R1.4522 O=C(O)CSC1=C(C=CC=C1)C(=O)O MCULE-5082048769 [0,1,0,0,0,0|2,0,1]=4 244 B14R1.7480 CCCOC1=C(C=CC=C1C(=O)C)Br MCULE-6810252961 [0,1,0,0,0,0|2,1,0]=4 245 B14R1.7480 CCCOC1=C(C=CC=C1C(=O)C)C MCULE-5877623569 [0,1,0,0,0,0|2,1,0]=4 246 B14R1.7480 CCCOC1=C(C=CC=C1C(=O)C)Cl MCULE-6394006721 [0,1,0,0,0,0|2,1,0]=4 247 B14R1.7480 CCCOC1=C(C=CC=C1C(=O)N)N MCULE-6152849684 [0,1,0,0,0,0|2,1,0]=4 248 B14R1.7480 CCCOC1=C(C=CC=C1C(=O)O)Br MCULE-1467108344 [0,1,0,0,0,0|1,1,0]=3 249 B14R1.7480 CCCOC1=C(C=CC=C1C(=O)O)C MCULE-4499944250 [0,1,0,0,0,0|1,1,0]=3 250 B14R1.7480 NCCNC1=C(C=CC=C1N)C(=O)O MCULE-3408616904 [0,1,0,0,0,0|3,0,0]=4 251 B14R2.4 CC1=NNC2=C1C=CC=C2C(=O)O MCULE-2432260781 [0,0,0,1,0,0|2,0,1]=4 252 B14R2.4 CC1COC2=C(C=CC=C12)C(=O)O MCULE-6554150259 [0,0,0,1,0,0|1,1,0]=3 253 B14R2.4 CN1C=CC2=C(C=CC=C12)C(=O)O MCULE-5747277612 [0,0,0,1,0,0|3,0,0]=4 254 B14R2.4 CN1C=NC2=C(C=CC=C12)C(=O)O MCULE-4219859404 [0,0,0,1,0,0|3,0,0]=4 255 B14R2.4 CN1CCC2=C1C=CC=C2C(=O)O MCULE-9593648302 [0,0,0,1,0,0|3,0,0]=4 256 B14R2.4 CN1N=CC2=C1C=CC=C2C(=O)O MCULE-6249639899 [0,0,0,1,0,0|3,0,0]=4 257 B14R2.4 CN1N=NC2=C(C=CC=C12)C(=O)O MCULE-5532838985 [0,0,0,1,0,0|3,0,0]=4 258 B14R2.4 NC1CCC2=C1C=CC=C2C(=O)O MCULE-2728766138 [0,0,0,1,0,0|3,0,0]=4 259 B14R2.4 N[C@@H]1CCC2=C1C=CC=C2C(=O)O MCULE-1321735158 [0,0,0,1,0,0|3,0,0]=4 260 B14R2.4 N[C@H]1CCC2=C1C=CC=C2C(=O)O MCULE-1702614918 [0,0,0,1,0,0|3,0,0]=4 261 B14R2.52 CC1CNC2=C(C=CC=C2)C(=O)N1 MCULE-8576877264 [0,0,0,1,0,0|3,0,0]=4 262 B14R2.510 CC/C=C/1\OC(=O)C2=CC=CC=C12 MCULE-5752639722 [0,0,0,1,0,0|2,0,0]=3 263 B14R2.510 CCC=C1OC(=O)C2=CC=CC=C12 MCULE-5371579510 [0,0,0,1,0,0|2,0,0]=3 264 B14R2.510 CCOC1NC(=O)C2=C1C=CC=C2 MCULE-4227738306 [0,0,0,1,0,0|3,0,0]=4 265 B14R2.510 CCOC1OC(=O)C2=C1C=CC=C2 MCULE-7262983965 [0,0,0,1,0,0|2,0,0]=3 266 B14R2.510 CCOC1OC(=O)C2=C1C=CN=C2 MCULE-9059617587 [0,0,0,1,0,0|3,0,0]=4 267 B14R2.510 CCOC1OC(=O)C2=NC=CC=C12 MCULE-8102734686 [0,0,0,1,0,0|3,0,0]=4 268 B14R2.1019 CCC1=CC(=O)C2=C(N1)C=CC=C2 MCULE-4334421068 [0,0,0,1,0,0|3,0,0]=4 269 B14R2.1019 CCC1=CC(=O)C2=C(O1)C=CC=C2 MCULE-6362192628 [0,0,0,1,0,0|2,1,0]=4 270 B14R2.1019 CCC1=NC2=CC=CC=C2C(=O)N1 MCULE-5880921845 [0,0,0,1,0,0|3,0,0]=4 271 B14R2.1019 CCC1=NC2=CC=CC=C2C(=O)O1 MCULE-8407230744 [0,0,0,1,0,0|2,0,0]=3 272 B14R2.1019 CSC1=CC(=O)C2=C(S1)C=CC=C2 MCULE-5216832596 [0,0,0,1,0,0|3,0,0]=4 273 B14R2.9513 O=C(O)C1=C(C=CC=C1)OC2CC2 MCULE-8191871580 [0,0,0,1,0,0|1,1,0]=3 274 B14R2.9513 O=C(O)C1=CC=CN=C1NC2CC2 MCULE-1986707849 [0,0,0,1,0,0|3,0,0]=4 275 B14R2.9532 O=C(O)C1=C(C=CC=C1)C2CCC2 MCULE-3257208461 [0,0,0,1,0,0|2,0,0]=3 276 B14R2.9532 O=C(O)C1=C(C=CN=C1)C2CCC2 MCULE-7172383365 [0,0,0,1,0,0|3,0,0]=4 277 B14R2.9532 O=C(O)C1=C(C=NC=C1)C2CCC2 MCULE-8123381882 [0,0,0,1,0,0|3,0,0]=4 278 B14R2.9532 O=C(O)C1=CC=CC=C1[C@@H]2CCN2 MCULE-3952037000 [0,0,0,1,0,0|2,0,0]=3 279 B14R2.9532 O=C(O)C1=CC=CC=C1[C@@H]2CCN2 MCULE-5258949414 [0,0,0,1,0,0|2,0,0]=3 280 B14R2.9532 O=C(O)C1=CC=CC=C1[C@H]2CCN2 MCULE-3165212604 [0,0,0,1,0,0|2,0,0]=3 281 B14R2.9532 O=C(O)C1=CC=CC=C1[C@H]2CCN2 MCULE-6731634185 [0,0,0,1,0,0|2,0,0]=3 282 B14R2.9532 O=C(O)C1=CC=CN=C1C2CCC2 MCULE-1464309823 [0,0,0,1,0,0|3,0,0]=4 283 B14R2.9532 O=C(O)C1=NC=CC=C1C2CCC2 MCULE-8065594769 [0,0,0,1,0,0|3,0,0]=4 284 B14R2.31359 CC(=O)C1=C2CCCCC2=CC=C1 MCULE-8639543648 [0,0,0,1,0,0|3,0,0]=4 285 B14R2.31359 CC(=O)C1=C2NCCCC2=CC=C1 MCULE-7190836096 [0,0,0,1,0,0|3,0,0]=4 286 B14R2.31359 NC(=O)C1=C2CCCCC2=CC=C1 MCULE-6208798025 [0,0,0,1,0,0|3,0,0]=4 287 B14R2.31359 NC(=O)C1=C2NCCCC2=CC=C1 MCULE-9714945253 [0,0,0,1,0,0|3,0,0]=4 288 B14R2.31359 NC(=O)C1=CC=CC2=C1OCCC2 MCULE-3286540297 [0,0,0,1,0,0|2,1,0]=4 289 B14R2.31359 O=C(Cl)C1=CC=CC2=C1CCCC2 MCULE-1645758183 [0,0,0,1,0,0|3,0,0]=4 290 B14R2.31359 O=C(Cl)C1=CC=CC2=C1OCCC2 MCULE-7534537294 [0,0,0,1,0,0|2,1,0]=4 291 B14R2.31359 O=C(O)C1=C2CCCCC2=CN=C1 MCULE-4469925975 [0,0,0,1,0,0|3,0,0]=4 292 B14R2.31359 O=C(O)C1=C2CCCCC2=NC=C1 MCULE-1919719845 [0,0,0,1,0,0|3,0,0]=4 293 B14R2.31359 O=C(O)C1=C2CCCNC2=CC=C1 MCULE-6324304358 [0,0,0,1,0,0|3,0,0]=4 294 B14R2.31359 O=C(O)C1=C2CCCOC2=CC=C1 MCULE-6653429678 [0,0,0,1,0,0|3,0,0]=4 295 B14R2.31359 O=C(O)C1=C2CCNCC2=CC=C1 MCULE-4569144829 [0,0,0,1,0,0|3,0,0]=4 296 B14R2.31359 O=C(O)C1=C2CCNCC2=CC=C1 MCULE-7040539614 [0,0,0,1,0,0|3,0,0]=4 297 B14R2.31359 O=C(O)C1=C2CCOCC2=CC=C1 MCULE-9757163310 [0,0,0,1,0,0|3,0,0]=4 298 B14R2.31359 O=C(O)C1=C2CNCCC2=CC=C1 MCULE-2432080897 [0,0,0,1,0,0|2,0,0]=3 299 B14R2.31359 O=C(O)C1=C2CNCCC2=CC=C1 MCULE-4374209661 [0,0,0,1,0,0|2,0,0]=3 300 B14R2.31359 O=C(O)C1=C2CNCCC2=NC=C1 MCULE-2165620754 [0,0,0,1,0,0|3,0,0]=4 301 B14R2.31359 O=C(O)C1=C2CNCCC2=NC=C1 MCULE-9502394494 [0,0,0,1,0,0|3,0,0]=4 302 B14R2.31359 O=C(O)C1=C2COCCC2=CC=C1 MCULE-3468966814 [0,0,0,1,0,0|2,0,0]=3 303 B14R2.31359 O=C(O)C1=C2NCCCC2=CC=C1 MCULE-6067026324 [0,0,0,1,0,0|2,0,0]=3 304 B14R2.31359 O=C(O)C1=C2NCCNC2=CC=C1 MCULE-3203558605 [0,0,0,1,0,0|3,0,0]=4 305 B14R2.31359 O=C(O)C1=C2NCCOC2=CC=C1 MCULE-6426554981 [0,0,0,1,0,0|3,0,0]=4 306 B14R2.31359 O=C(O)C1=C2OCCCC2=NC=C1 MCULE-6053295991 [0,0,0,1,0,0|2,1,0]=4 307 B14R2.31359 O=C(O)C1=C2OCCNC2=CC=C1 MCULE-2103835236 [0,0,0,1,0,0|2,1,0]=4 308 B14R2.31359 O=C(O)C1=CC=CC2=C1CCCC2 MCULE-2530356789 [0,0,0,1,0,0|2,0,0]=3 309 B14R2.31359 O=C(O)C1=CC=CC2=C1OCCC2 MCULE-6025907532 [0,0,0,1,0,0|1,1,0]=3 310 B14R2.31359 O=C(O)C1=CC=CC2=C1OCCO2 MCULE-2003895122 [0,0,0,1,0,0|2,1,0]=4 311 B14R2.31359 O=C(O)C1=CC=NC2=C1CCCC2 MCULE-5707150281 [0,0,0,1,0,0|3,0,0]=4 312 B14R2.31359 O=C(O)C1=CN=CC2=C1CNCC2 MCULE-1038947586 [0,0,0,1,0,0|3,0,0]=4 313 B14R2.31359 O=C(O)C1=CN=CC2=C1CNCC2 MCULE-4648062949 [0,0,0,1,0,0|3,0,0]=4 314 B14R2.31359 O=C(O)C1=CN=CC2=C1NCCC2 MCULE-5921110175 [0,0,0,1,0,0|3,0,0]=4 315 B12R1.386 CCCCC1=C(C=CS1)C(=O)O MCULE-3567761110 [0,0,0,0,1,0|3,0,0]=4 316 B11R1.17 CCCCC1=C(C=CC=C1)O MCULE-2002461761 [2,0,0,0,0,0|2,0,0]=4 317 B11R1.17 CCCOC1=C(C=CC=C1)O MCULE-6553096611 [2,0,0,0,0,0|1,1,0]=4 318 B11R1.17 CCCSC1=C(C=CC=C1)Br MCULE-5618725688 [2,0,0,0,0,0|2,0,0]=4 319 B11R1.17 CCCSC1=C(C=CC=C1)S MCULE-7976606156 [2,0,0,0,0,0|1,1,0]=4 320 B11R1.17 CCCSC1=CC=CC=C1Cl MCULE-3167206112 [2,0,0,0,0,0|2,0,0]=4 321 B11R1.17 CCCSC1=CC=CC=C1N MCULE-1237490683 [2,0,0,0,0,0|2,0,0]=4 322 B11R1.17 CCCSC1=CC=CC=C1N MCULE-5502649108 [2,0,0,0,0,0|2,0,0]=4 323 B11R1.17 CCNCC1=CC=CC=C1O MCULE-5562910390 [2,0,0,0,0,0|2,0,0]=4 324 B11R1.41 CCCC1=C(C=CC=C1)CO MCULE-1383263398 [2,0,0,0,0,0|1,0,1]=4 325 B11R1.41 CCNC1=C(C=CC=C1)C=O MCULE-8648734006 [2,0,0,0,0,0|1,0,0]=3 326 B11R1.41 CCOC1=C(C=CC=N1)C=O MCULE-5269915909 [2,0,0,0,0,0|1,1,0]=4 327 B11R1.41 CCOC1=CC=CC=C1C=O MCULE-2364462479 [2,0,0,0,0,0|0,1,0]=3 328 B11R1.41 CCOC1=CC=CC=C1CO MCULE-8083516503 [2,0,0,0,0,0|0,1,1]=4 329 B11R1.41 CCOC1=CC=CN=C1C=O MCULE-7217501109 [2,0,0,0,0,0|1,1,0]=4 330 B11R1.41 CCOC1=CC=NC=C1C=O MCULE-1872540499 [2,0,0,0,0,0|1,1,0]=4 331 B11R1.41 CCSC1=C(C=CC=C1)C#N MCULE-5657681825 [2,0,0,0,0,0|1,0,1]=4 332 B11R1.41 CCSC1=C(C=CC=C1)CC MCULE-8989190690 [2,0,0,0,0,0|1,0,1]=4 333 B11R1.41 CCSC1=C(C=CC=C1)CCl MCULE-3025869199 [2,0,0,0,0,0|1,0,1]=4 334 B11R1.41 CCSC1=C(C=CC=C1)OC MCULE-3608057446 [2,0,0,0,0,0|2,0,0]=4 335 B11R1.41 CCSC1=CC=CC=C1C=O MCULE-4191120123 [2,0,0,0,0,0|0,0,0]=2 336 B11R1.41 COCC1=CC=CC=C1C=O MCULE-3692457492 [2,0,0,0,0,0|2,0,0]=4 337 B11R1.41 N#CSC1=C(C=CC=C1)C=O MCULE-3259559561 [2,0,0,0,0,0|1,0,1]=4 338 B11R1.41 O=CC1=CC=CC=C1CCBr MCULE-5684229179 [2,0,0,0,0,0|2,0,0]=4 339 B11R1.53 C#CC1=CC=CC=C1C(=O)O MCULE-2225406631 [2,0,0,0,0,0|0,0,2]=4 340 B11R1.53 C=CC1=CC=CC=C1C(=O)O MCULE-7536191019 [2,0,0,0,0,0|0,0,2]=4 341 B11R1.53 CCC1=C(C=CC=C1)B(O)O MCULE-4962553262 [2,0,0,0,0,0|1,0,1]=4 342 B11R1.53 CCC1=C(C=CC=C1)C(=O)C MCULE-2609725301 [2,0,0,0,0,0|1,0,0]=3 343 B11R1.53 CCC1=C(C=CC=C1)C(=O)N MCULE-2003552914 [2,0,0,0,0,0|1,0,0]=3 344 B11R1.53 CCC1=C(C=CC=C1)N(=O)=O MCULE-7725356985 [2,0,0,0,0,0|1,0,1]=4 345 B11R1.53 CCC1=C(C=CC=N1)C(=O)O MCULE-1816858431 [2,0,0,0,0,0|1,0,0]=3 346 B11R1.53 CCC1=C(C=CN=C1)C(=O)C MCULE-6050468430 [2,0,0,0,0,0|2,0,0]=4 347 B11R1.53 CCC1=C(C=CN=C1)C(=O)O MCULE-2556387316 [2,0,0,0,0,0|1,0,0]=3 348 B11R1.53 CCC1=C(C=CN=C1)C(=O)O MCULE-8380645094 [2,0,0,0,0,0|1,0,0]=3 349 B11R1.53 CCC1=C(C=NC=N1)C(=O)O MCULE-6327334228 [2,0,0,0,0,0|2,0,0]=4 350 B11R1.53 CCC1=CC=CC=C1C(=O)Cl MCULE-7919259179 [2,0,0,0,0,0|1,0,0]=3 351 B11R1.53 CCC1=CC=CC=C1C(=O)O MCULE-5345503463 [2,0,0,0,0,0|0,0,0]=2 352 B11R1.53 CCC1=CC=CC=C1C(=S)N MCULE-7202693939 [2,0,0,0,0,0|1,1,0]=4 353 B11R1.53 CCC1=CC=CC=C1C(C)O MCULE-5140391983 [2,0,0,0,0,0|1,0,1]=4 354 B11R1.53 CCC1=CC=CC=C1S(=O)C MCULE-9408364147 [2,0,0,0,0,0|2,0,0]=4 355 B11R1.53 CCC1=CC=CN=C1C(=O)C MCULE-4052051937 [2,0,0,0,0,0|2,0,0]=4 356 B11R1.53 CCC1=CC=NC=C1C(=O)O MCULE-5770920295 [2,0,0,0,0,0|1,0,0]=3 357 B11R1.53 CNC1=C(C=CC=C1)C(=O)N MCULE-1088460584 [2,0,0,0,0,0|2,0,0]=4 358 B11R1.53 CNC1=C(C=CN=C1)C(=O)O MCULE-9089889870 [2,0,0,0,0,0|2,0,0]=4 359 B11R1.53 CNC1=CC=CC=C1C(=O)C MCULE-8366543105 [2,0,0,0,0,0|2,0,0]=4 360 B11R1.53 CNC1=CC=CC=C1C(=O)O MCULE-5834002880 [2,0,0,0,0,0|1,0,0]=3 361 B11R1.53 CNC1=NC=CC=C1C(=O)O MCULE-6289599546 [2,0,0,0,0,0|2,0,0]=4 362 B11R1.53 COC1=C(C=CC=C1)C(=O)C MCULE-4229015136 [2,0,0,0,0,0|1,1,0]=4 363 B11R1.53 COC1=C(C=CC=C1)C(=O)O MCULE-8358316345 [2,0,0,0,0,0|0,1,0]=3 364 B11R1.53 COC1=C(C=CC=C1)C(=O)[O-] MCULE-2998755053 [2,0,0,0,0,0|0,1,1]=4 365 B11R1.53 COC1=C(C=CC=C1)S(=O)O MCULE-9927511433 [2,0,0,0,0,0|1,1,0]=4 366 B11R1.53 COC1=CC=CC=C1C(=O)Cl MCULE-5853878323 [2,0,0,0,0,0|1,1,0]=4 367 B11R1.53 COC1=CC=CC=C1C(=O)N MCULE-5017344990 [2,0,0,0,0,0|1,1,0]=4 368 B11R1.53 COC1=CC=CN=C1C(=O)O MCULE-9430488708 [2,0,0,0,0,0|1,1,0]=4 369 B11R1.53 COC1=CC=NC=C1C(=O)O MCULE-3496808749 [2,0,0,0,0,0|1,1,0]=4 370 B11R1.53 COC1=CN=CC=C1C(=O)O MCULE-4176544219 [2,0,0,0,0,0|1,1,0]=4 371 B11R1.53 COC1=NC=CC=C1C(=O)O MCULE-5244916926 [2,0,0,0,0,0|1,1,0]=4 372 B11R1.53 CSC1=C(C=CC=C1)C(=O)C MCULE-3015343743 [2,0,0,0,0,0|1,0,0]=3 373 B11R1.53 CSC1=C(C=CC=C1)C(=O)N MCULE-8440684791 [2,0,0,0,0,0|1,0,0]=3 374 B11R1.53 CSC1=C(C=CC=C1)C(=O)O MCULE-9467769240 [2,0,0,0,0,0|0,0,0]=2 375 B11R1.53 CSC1=C(C=CC=C1)C(C)O MCULE-6685649855 [2,0,0,0,0,0|1,0,1]=4 376 B11R1.53 CSC1=C(C=CC=C1)N(=O)=O MCULE-3654731519 [2,0,0,0,0,0|1,0,1]=4 377 B11R1.53 CSC1=C(C=CC=C1)[C@@H](C)O MCULE-6554664750 [2,0,0,0,0,0|1,0,1]=4 378 B11R1.53 CSC1=C(C=CC=C1)[C@H](C)O MCULE-3360841317 [2,0,0,0,0,0|1,0,1]=4 379 B11R1.53 CSC1=C(C=CC=N1)C(=O)Cl MCULE-3334120611 [2,0,0,0,0,0|2,0,0]=4 380 B11R1.53 CSC1=C(N=CC=C1)C(=O)O MCULE-7916550623 [2,0,0,0,0,0|1,0,0]=3 381 B11R1.53 CSC1=C(N=CC=N1)C(=O)O MCULE-3453041755 [2,0,0,0,0,0|2,0,0]=4 382 B11R1.53 CSC1=CC=CC=C1B(O)O MCULE-9344913922 [2,0,0,0,0,0|1,0,1]=4 383 B11R1.53 CSC1=CC=CC=C1C(=O)Cl MCULE-1833321818 [2,0,0,0,0,0|1,0,0]=3 384 B11R1.53 CSC1=NC=CC=C1C(=O)N MCULE-1123850413 [2,0,0,0,0,0|2,0,0]=4 385 B11R1.53 CSC1=NC=CC=C1C(=O)O MCULE-6789292284 [2,0,0,0,0,0|1,0,0]=3 386 B11R1.53 N#CC1=C(C=CC=C1)C(=O)O MCULE-8028564477 [2,0,0,0,0,0|1,0,1]=4 387 B11R1.53 NC(=O)C1=C(C=CC=C1)CBr MCULE-2953769743 [2,0,0,0,0,0|2,0,0]=4 388 B11R1.53 NC(=O)C1=C(C=CC=C1)CO MCULE-6667845071 [2,0,0,0,0,0|2,0,0]=4 389 B11R1.53 NCC1=C(C=CC=N1)C(=O)O MCULE-6336117316 [2,0,0,0,0,0|2,0,0]=4 390 B11R1.53 NCC1=C(C=CC=N1)C(=O)O MCULE-8956287762 [2,0,0,0,0,0|2,0,0]=4 391 B11R1.53 NCC1=CC=CC=C1C(=O)N MCULE-4740530376 [2,0,0,0,0,0|2,0,0]=4 392 B11R1.53 NCC1=CC=CC=C1C(=O)N MCULE-6077105754 [2,0,0,0,0,0|2,0,0]=4 393 B11R1.53 NCC1=CC=CC=C1C(=O)O MCULE-3951040853 [2,0,0,0,0,0|1,0,0]=3 394 B11R1.53 NCC1=CC=CC=C1C(=O)O MCULE-7214993753 [2,0,0,0,0,0|1,0,0]=3 395 B11R1.53 NNC1=C(C=CC=C1)C(=O)O MCULE-6710058167 [2,0,0,0,0,0|2,0,0]=4 396 B11R1.53 NNC1=CC=CC=C1C(=O)O MCULE-9681705772 [2,0,0,0,0,0|2,0,0]=4 397 B11R1.53 O=C(Br)C1=C(C=CC=C1)CBr MCULE-9152786716 [2,0,0,0,0,0|2,0,0]=4 398 B11R1.53 O=C(Cl)C1=CC=CC=C1CBr MCULE-4859473805 [2,0,0,0,0,0|2,0,0]=4 399 B11R1.53 O=C(Cl)C1=CC=CC=C1CCl MCULE-2103928099 [2,0,0,0,0,0|2,0,0]=4 400 B11R1.53 O=C(O)C1=C(C=CC=C1)CBr MCULE-3916838805 [2,0,0,0,0,0|1,0,0]=3 401 B11R1.53 O=C(O)C1=C(C=CC=C1)CCl MCULE-9961828053 [2,0,0,0,0,0|1,0,0]=3 402 B11R1.53 O=C(O)C1=C(C=CC=C1)CO MCULE-4795775601 [2,0,0,0,0,0|1,0,0]=3 403 B11R1.53 O=C(O)C1=C(C=CC=C1)NO MCULE-6356954782 [2,0,0,0,0,0|2,0,0]=4 404 B11R1.53 O=C(O)C1=C(C=CC=C1)OI MCULE-3097266245 [2,0,0,0,0,0|1,1,0]=4 405 B11R1.53 O=C(O)C1=C(N=CC=C1)CO MCULE-1065539051 [2,0,0,0,0,0|2,0,0]=4 406 B11R1.53 O=C(O)C1=CN=CC=C1CO MCULE-7496519749 [2,0,0,0,0,0|2,0,0]=4 407 B11R1.53 O=CC1=CC=CC=C1C(=O)O MCULE-7642820980 [2,0,0,0,0,0|1,0,1]=4 408 B11R1.53 O=NC1=CC=CC=C1C(=O)O MCULE-4180896401 [2,0,0,0,0,0|2,0,0]=4 409 B11R1.53 O=[IH2]C1=C(C=CC=C1)C(=O)O MCULE-9514632532 [2,0,0,0,0,0|2,0,0]=4 410 B13R1.73 CCCOC1=CC=C(C=C1C=O)Br MCULE-9786644419 [1,1,0,0,0,0|1,1,0]=4 411 B13R1.73 CCCOC1=CC=C(C=C1C=O)C MCULE-8622052776 [1,1,0,0,0,0|1,1,0]=4 412 B13R1.73 CCCOC1=CC=C(C=C1C=O)Cl MCULE-1563060860 [1,1,0,0,0,0|1,1,0]=4 413 B13R1.73 CCCOC1=CC=C(C=C1C=O)F MCULE-2051067107 [1,1,0,0,0,0|1,1,0]=4 414 B13R1.84 CCCCOC1=CC=CC=C1C=O MCULE-9404869631 [1,1,0,0,0,0|1,1,0]=4 415 B13R1.84 CCCCSC1=C(C=CC=C1)C=O MCULE-4620642412 [1,1,0,0,0,0|1,0,0]=3 416 B13R1.84 CCCCSC1=C(C=CC=C1)CO MCULE-3400938360 [1,1,0,0,0,0|1,0,1]=4 417 B13R1.84 CCCOCC1=C(C=CC=C1)C=O MCULE-3457133591 [1,1,0,0,0,0|1,1,0]=4 418 B13R1.84 COCCOC1=C(C=CC=C1)C=O MCULE-1042449082 [1,1,0,0,0,0|1,1,0]=4 419 B13R1.90 CC(C)COC1=C(C=CC=C1)C=O MCULE-9883174584 [1,1,0,0,0,0|1,1,0]=4 420 B13R1.90 CC(C)CSC1=C(C=CC=C1)C=O MCULE-6334276891 [1,1,0,0,0,0|1,0,0]=3 421 B13R1.90 CC(C)CSC1=C(C=CC=C1)CO MCULE-2118226645 [1,1,0,0,0,0|1,0,1]=4 422 B13R1.90 CC(C)OCC1=C(C=CC=C1)C=O MCULE-1239750679 [1,1,0,0,0,0|2,0,0]=4 423 B13R1.91 CCC(C)OC1=CC=CC=C1C=O MCULE-6610849663 [1,1,0,0,0,0|1,1,0]=4 424 B13R1.464 CCNC(=O)C1=C(C=CC=C1)C=O MCULE-2748975646 [1,1,0,0,0,0|2,0,0]=4 425 B13R1.464 CCOC(=O)C1=CC=CC=C1C=O MCULE-9362289485 [1,1,0,0,0,0|2,0,0]=4 426 B13R1.485 C=CCC1=CC=CC=C1SCCC MCULE-3172044534 [1,1,0,0,0,0|2,0,0]=4 427 B13R1.485 CCCSC1=C(C=CC=C1)CCO MCULE-8027832339 [1,1,0,0,0,0|1,0,1]=4 428 B13R1.556 CCCOC1=CC(=CC=C1C=O)Br MCULE-2447996245 [1,1,0,0,0,0|1,1,0]=4 429 B13R1.556 CCCOC1=CC(=CC=C1C=O)F MCULE-5930472910 [1,1,0,0,0,0|1,1,0]=4 430 B13R1.1619 CCCOC1=C(C=CC=C1C=O)Br MCULE-8464180211 [1,1,0,0,0,0|1,1,0]=4 431 B13R1.141 CCNC1=C(C=C(C=C1)C)C(=O)O MCULE-2383425921 [1,1,0,0,0,0|1,0,0]=3 432 B13R1.141 CCNC1=C(C=C(C=C1)Cl)C(=O)N MCULE-1786127951 [1,1,0,0,0,0|2,0,0]=4 433 B13R1.141 CCNC1=C(C=C(C=C1)F)C(=O)O MCULE-5847642812 [1,1,0,0,0,0|1,0,0]=3 434 B13R1.141 CCNC1=CC=C(C=C1C(=O)N)F MCULE-7534426509 [1,1,0,0,0,0|2,0,0]=4 435 B13R1.141 CCNC1=CC=C(C=C1C(=O)O)Br MCULE-8700327725 [1,1,0,0,0,0|1,0,0]=3 436 B13R1.141 CCNC1=CC=C(C=C1C(=O)O)Cl MCULE-1524937815 [1,1,0,0,0,0|1,0,0]=3 437 B13R1.141 CCNC1=NC=C(C=C1C(=O)O)Br MCULE-1118393480 [1,1,0,0,0,0|2,0,0]=4 438 B13R1.141 CCOC1=C(C=C(C=C1)F)C(=O)C MCULE-7608819275 [1,1,0,0,0,0|1,1,0]=4 439 B13R1.141 CCOC1=C(C=C(C=C1)F)C(=O)Cl MCULE-1547059414 [1,1,0,0,0,0|1,1,0]=4 440 B13R1.141 CCOC1=C(C=C(C=C1)F)C(=O)O MCULE-5926893057 [1,1,0,0,0,0|0,1,0]=3 441 B13R1.141 CCOC1=CC=C(C=C1C(=O)C)Br MCULE-4925660858 [1,1,0,0,0,0|1,1,0]=4 442 B13R1.141 CCOC1=CC=C(C=C1C(=O)C)C MCULE-9887907753 [1,1,0,0,0,0|1,1,0]=4 443 B13R1.141 CCOC1=CC=C(C=C1C(=O)C)Cl MCULE-1767458317 [1,1,0,0,0,0|1,1,0]=4 444 B13R1.141 CCOC1=CC=C(C=C1C(=O)Cl)Br MCULE-3128388103 [1,1,0,0,0,0|1,1,0]=4 445 B13R1.141 CCOC1=CC=C(C=C1C(=O)Cl)C MCULE-7883153756 [1,1,0,0,0,0|1,1,0]=4 446 B13R1.141 CCOC1=CC=C(C=C1C(=O)Cl)Cl MCULE-1462264322 [1,1,0,0,0,0|1,1,0]=4 447 B13R1.141 CCOC1=CC=C(C=C1C(=O)N)Br MCULE-6901588416 [1,1,0,0,0,0|1,1,0]=4 448 B13R1.141 CCOC1=CC=C(C=C1C(=O)N)N MCULE-2960631444 [1,1,0,0,0,0|1,1,0]=4 449 B13R1.141 CCOC1=CC=C(C=C1C(=O)O)Br MCULE-8071302040 [1,1,0,0,0,0|0,1,0]=3 450 B13R1.141 CCOC1=CC=C(C=C1C(=O)O)C MCULE-5536565558 [1,1,0,0,0,0|0,1,0]=3 451 B13R1.141 CCOC1=CC=C(C=C1C(=O)O)Cl MCULE-4086792290 [1,1,0,0,0,0|0,1,0]=3 452 B13R1.141 CCOC1=CC=C(C=C1C(=O)O)N MCULE-1156472481 [1,1,0,0,0,0|0,1,0]=3 453 B13R1.141 CCOC1=CC=C(C=C1C(=O)O)N MCULE-2145350496 [1,1,0,0,0,0|0,1,0]=3 454 B13R1.141 CCOC1=CC=C(C=C1C(=O)O)O MCULE-4305194110 [1,1,0,0,0,0|0,1,0]=3 455 B13R1.141 CCOC1=CC=C(N=C1C(=O)O)Br MCULE-6578795778 [1,1,0,0,0,0|1,1,0]=4 456 B13R1.141 CCOC1=NC=C(C=C1C(=O)O)Br MCULE-6523686123 [1,1,0,0,0,0|1,1,0]=4 457 B13R1.141 CCOC1=NC=C(C=C1C(=O)O)Cl MCULE-3307315662 [1,1,0,0,0,0|1,1,0]=4 458 B13R1.141 CCOC1=NC=C(C=C1C(=O)O)I MCULE-8994737374 [1,1,0,0,0,0|1,1,0]=4 459 B13R1.141 CCSC1=C(C=C(C=C1)Cl)C(=O)O MCULE-7828619472 [1,1,0,0,0,0|0,0,0]=2 460 B13R1.141 CCSC1=C(C=C(C=C1)Cl)N(=O)=O MCULE-9838976852 [1,1,0,0,0,0|1,0,1]=4 461 B13R1.141 CCSC1=CC=C(C=C1C(=O)C)Cl MCULE-5830902164 [1,1,0,0,0,0|1,0,0]=3 462 B13R1.141 CCSC1=CC=C(N=C1C(=O)O)F MCULE-8411266603 [1,1,0,0,0,0|1,0,0]=3 463 B13R1.356 CCCC1=CC(=CC=C1C(=O)[O-])O MCULE-2896611650 [1,1,0,0,0,0|1,0,1]=4 464 B13R1.356 CCCC1=CC(=CC=C1C(=O)[O-])O MCULE-3662535461 [1,1,0,0,0,0|1,0,1]=4 465 B13R1.356 CCNC1=C(C=CC(=C1)Cl)C(=O)O MCULE-9482346050 [1,1,0,0,0,0|1,0,0]=3 466 B13R1.356 CCNC1=C(C=CC(=C1)F)C(=O)N MCULE-2446870304 [1,1,0,0,0,0|2,0,0]=4 467 B13R1.356 CCNC1=C(C=CC(=N1)Cl)C(=O)O MCULE-7122952542 [1,1,0,0,0,0|2,0,0]=4 468 B13R1.356 CCNC1=CC(=CC=C1C(=O)O)Br MCULE-8895539111 [1,1,0,0,0,0|1,0,0]=3 469 B13R1.356 CCNC1=CC(=CC=C1C(=O)O)C MCULE-1203422405 [1,1,0,0,0,0|1,0,0]=3 470 B13R1.356 CCNC1=CC(=CC=C1C(=O)O)F MCULE-3778959420 [1,1,0,0,0,0|1,0,0]=3 471 B13R1.356 CCOC1=C(C=CC(=C1)Br)C(=O)C MCULE-3039354973 [1,1,0,0,0,0|1,1,0]=4 472 B13R1.356 CCOC1=C(C=CC(=C1)Cl)C(=O)O MCULE-2338871901 [1,1,0,0,0,0|0,1,0]=3 473 B13R1.356 CCOC1=C(C=CC(=C1)F)C(=O)Cl MCULE-8884757388 [1,1,0,0,0,0|1,1,0]=4 474 B13R1.356 CCOC1=C(C=CC(=C1)N)C(=O)N MCULE-1678899586 [1,1,0,0,0,0|1,1,0]=4 475 B13R1.356 CCOC1=C(C=CC(=N1)C)C(=O)O MCULE-9395780971 [1,1,0,0,0,0|1,1,0]=4 476 B13R1.356 CCOC1=C(C=CC(=N1)Cl)C(=O)O MCULE-9380775053 [1,1,0,0,0,0|1,1,0]=4 477 B13R1.356 CCOC1=C(C=NC(=C1)Cl)C(=O)O MCULE-9582523427 [1,1,0,0,0,0|1,1,0]=4 478 B13R1.356 CCOC1=CC(=CC=C1C(=O)C)Cl MCULE-1041227445 [1,1,0,0,0,0|1,1,0]=4 479 B13R1.356 CCOC1=CC(=CC=C1C(=O)C)F MCULE-1536452635 [1,1,0,0,0,0|1,1,0]=4 480 B13R1.356 CCOC1=CC(=CC=C1C(=O)N)Br MCULE-1119494555 [1,1,0,0,0,0|1,1,0]=4 481 B13R1.356 CCOC1=CC(=CC=C1C(=O)O)Br MCULE-3576989226 [1,1,0,0,0,0|0,1,0]=3 482 B13R1.356 CCOC1=CC(=CC=C1C(=O)O)F MCULE-4670163209 [1,1,0,0,0,0|0,1,0]=3 483 B13R1.356 CCSC1=C(C=CC(=C1)Cl)C(=O)O MCULE-3440241654 [1,1,0,0,0,0|0,0,0]=2 484 B13R1.356 CCSC1=C(N=CC(=C1)Cl)C(=O)O MCULE-7059890652 [1,1,0,0,0,0|1,0,0]=3 485 B13R1.356 CCSC1=CC(=CC=C1C(=O)N)N MCULE-6827871916 [1,1,0,0,0,0|1,0,0]=3 486 B13R1.381 CCOC1=CC=CC=C1P(=O)(O)O MCULE-5905874313 [1,1,0,0,0,0|1,1,0]=4 487 B13R1.382 CCNC1=C(C=CC=C1)C(=O)OC MCULE-5583994939 [1,1,0,0,0,0|1,0,0]=3 488 B13R1.382 CCOC1=C(C=CC=C1)/C(=N/O)/N MCULE-3667329545 [1,1,0,0,0,0|1,1,0]=4 489 B13R1.382 CCOC1=C(C=CC=C1)/C(=N\O)/C MCULE-8714902440 [1,1,0,0,0,0|1,1,0]=4 490 B13R1.382 CCOC1=C(C=CC=C1)C(=NO)C MCULE-4293341793 [1,1,0,0,0,0|1,1,0]=4 491 B13R1.382 CCOC1=C(C=CC=C1)C(=O)NN MCULE-9463279013 [1,1,0,0,0,0|1,1,0]=4 492 B13R1.382 CCOC1=CC=CC=C1C(=O)CBr MCULE-1610911785 [1,1,0,0,0,0|1,1,0]=4 493 B13R1.382 CCOC1=CC=CC=C1C(=O)CC MCULE-4353037826 [1,1,0,0,0,0|1,1,0]=4 494 B13R1.382 CCOC1=CC=CC=C1C(=O)NC MCULE-6123733784 [1,1,0,0,0,0|1,1,0]=4 495 B13R1.382 CCOC1=CC=CC=C1C(=O)OC MCULE-8620529786 [1,1,0,0,0,0|0,1,0]=3 496 B13R1.382 CCOC1=NC=CC=C1C(=O)OC MCULE-6879220346 [1,1,0,0,0,0|1,1,0]=4 497 B13R1.382 CCSC1=C(C=CC=C1)C(=O)NC MCULE-6616045218 [1,1,0,0,0,0|1,0,0]=3 498 B13R1.382 CNCC1=C(C=CC=C1)C(=O)OC MCULE-5895939490 [1,1,0,0,0,0|2,0,0]=4 499 B13R1.382 CNCC1=C(C=CC=C1)C(=O)OC MCULE-6680663632 [1,1,0,0,0,0|2,0,0]=4 500 B13R1.382 COC(=O)C1=C(C=CC=C1)CCCl MCULE-7847917583 [1,1,0,0,0,0|2,0,0]=4 501 B13R1.382 COC(=O)C1=C(C=CC=C1)CCN MCULE-2819590391 [1,1,0,0,0,0|2,0,0]=4 502 B13R1.382 COC(=O)C1=C(C=CC=C1)CCN MCULE-8591467686 [1,1,0,0,0,0|2,0,0]=4 503 B13R1.382 COC(=O)C1=C(C=CC=C1)SC#N MCULE-9278663246 [1,1,0,0,0,0|1,0,1]=4 504 B13R1.382 COC(=O)C1=CC=CC=C1CCBr MCULE-1421319291 [1,1,0,0,0,0|2,0,0]=4 505 B13R1.382 COC(=O)C1=CC=CC=C1CCO MCULE-8292693627 [1,1,0,0,0,0|2,0,0]=4 506 B13R1.382 COCC1=CC=CC=C1C(=O)OC MCULE-6895368420 [1,1,0,0,0,0|2,0,0]=4 507 B13R1.547 CCC(=O)C1=CC=CC=C1C(=O)O MCULE-8857715556 [1,1,0,0,0,0|1,0,0]=3 508 B13R1.547 CCS(=O)C1=C(C=CC=C1)C(=O)O MCULE-9408058966 [1,1,0,0,0,0|0,0,1]=3 509 B13R1.547 CC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-9008393501 [1,1,0,0,0,0|1,0,0]=3 510 B13R1.547 CC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-9574810428 [1,1,0,0,0,0|1,0,0]=3 511 B13R1.547 CC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-5100687880 [1,1,0,0,0,0|1,0,0]=3 512 B13R1.547 CC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-8276676399 [1,1,0,0,0,0|1,0,0]=3 513 B13R1.547 COC(=O)C1=CC=CC=C1C(=O)O MCULE-2559625268 [1,1,0,0,0,0|2,0,0]=4 514 B13R1.547 NC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-1352554914 [1,1,0,0,0,0|2,0,0]=4 515 B13R1.547 NC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-4669578884 [1,1,0,0,0,0|2,0,0]=4 516 B13R1.547 NC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-7466303887 [1,1,0,0,0,0|2,0,0]=4 517 B13R1.547 NC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-9918620005 [1,1,0,0,0,0|2,0,0]=4 518 B13R1.547 N[C@@H](CF)C1=CC=CC=C1C(=O)O MCULE-1542893430 [1,1,0,0,0,0|2,0,0]=4 519 B13R1.547 N[C@@H](CF)C1=CC=CC=C1C(=O)O MCULE-6848929765 [1,1,0,0,0,0|2,0,0]=4 520 B13R1.547 N[C@@H](CO)C1=C(C=CC=C1)C(=O)O MCULE-1955749189 [1,1,0,0,0,0|2,0,0]=4 521 B13R1.547 N[C@@H](CO)C1=CC=CC=C1C(=O)O MCULE-5022798616 [1,1,0,0,0,0|2,0,0]=4 522 B13R1.547 N[C@H](CF)C1=CC=CC=C1C(=O)O MCULE-3814281072 [1,1,0,0,0,0|2,0,0]=4 523 B13R1.547 N[C@H](CF)C1=CC=CC=C1C(=O)O MCULE-3832753154 [1,1,0,0,0,0|2,0,0]=4 524 B13R1.547 N[C@H](CO)C1=C(C=CC=C1)C(=O)O MCULE-8482127173 [1,1,0,0,0,0|2,0,0]=4 525 B13R1.547 N[C@H](CO)C1=CC=CC=C1C(=O)O MCULE-6982607666 [1,1,0,0,0,0|2,0,0]=4 526 B13R1.547 O=C(O)C1=CC=CC=C1C(=O)CBr MCULE-4728185281 [1,1,0,0,0,0|2,0,0]=4 527 B13R1.589 C=C(C)CC1=C(C=CC=C1)C(=O)O MCULE-9204819801 [1,1,0,0,0,0|1,0,1]=4 528 B13R1.589 CC(=O)C1=CC=CC=C1NC(C)C MCULE-7029410641 [1,1,0,0,0,0|2,0,0]=4 529 B13R1.589 CC(=O)C1=CC=CC=C1NC(C)C MCULE-9670103462 [1,1,0,0,0,0|2,0,0]=4 530 B13R1.589 CC(=O)C1=CC=CC=C1OC(C)C MCULE-2596469981 [1,1,0,0,0,0|1,1,0]=4 531 B13R1.589 CC(=O)CC1=CC=CC=C1C(=O)O MCULE-9138117669 [1,1,0,0,0,0|1,0,1]=4 532 B13R1.589 CC(=O)NC1=CC=CC=C1C(=O)O MCULE-5493843354 [1,1,0,0,0,0|1,0,1]=4 533 B13R1.589 CC(=O)OC1=C(C=CC=C1)C(=O)O MCULE-3199019536 [1,1,0,0,0,0|0,1,1]=4 534 B13R1.589 CC(=O)SC1=CC=CC=C1C(=O)O MCULE-5814875567 [1,1,0,0,0,0|0,0,1]=3 535 B13R1.589 CC(C)CC1=C(C=CC=C1)C(=O)O MCULE-4167889243 [1,1,0,0,0,0|1,0,0]=3 536 B13R1.589 CC(C)NC1=C(C=CC=N1)C(=O)O MCULE-3244169290 [1,1,0,0,0,0|2,0,0]=4 537 B13R1.589 CC(C)NC1=C(C=NC=C1)C(=O)O MCULE-9200943649 [1,1,0,0,0,0|2,0,0]=4 538 B13R1.589 CC(C)NC1=CC=CC=C1C(=O)O MCULE-9316373608 [1,1,0,0,0,0|1,0,0]=3 539 B13R1.589 CC(C)OC1=C(C=CN=C1)C(=O)O MCULE-9749293188 [1,1,0,0,0,0|1,1,0]=4 540 B13R1.589 CC(C)OC1=C(C=NC=C1)C(=O)O MCULE-3897169366 [1,1,0,0,0,0|1,1,0]=4 541 B13R1.589 CC(C)OC1=C(N=CC=C1)C(=O)O MCULE-7672788869 [1,1,0,0,0,0|1,1,0]=4 542 B13R1.589 CC(C)OC1=CC=CC=C1C(=O)Cl MCULE-6680571747 [1,1,0,0,0,0|1,1,0]=4 543 B13R1.589 CC(C)OC1=CC=CC=C1C(=O)N MCULE-2735240047 [1,1,0,0,0,0|1,1,0]=4 544 B13R1.589 CC(C)OC1=CC=CC=C1C(=O)O MCULE-3438290382 [1,1,0,0,0,0|0,1,0]=3 545 B13R1.589 CC(C)OC1=NC=CC=C1C(=O)O MCULE-9770301427 [1,1,0,0,0,0|1,1,0]=4 546 B13R1.589 CC(C)SC1=C(C=CC=C1)C(=O)O MCULE-5467128629 [1,1,0,0,0,0|0,0,0]=2 547 B13R1.589 CC(C)SC1=CC=CC=C1C(=O)N MCULE-3558797624 [1,1,0,0,0,0|1,0,0]=3 548 B13R1.589 CC(C)SC1=CC=CC=C1N(=O)=O MCULE-8208287485 [1,1,0,0,0,0|1,0,1]=4 549 B13R1.589 CN(C)CC1=C(C=CC=C1)C(=O)O MCULE-8960151808 [1,1,0,0,0,0|2,0,0]=4 550 B13R1.589 CN(C)CC1=C(C=CC=C1)C(=O)O MCULE-9158550136 [1,1,0,0,0,0|2,0,0]=4 551 B13R1.589 C[C@@H](N)CC1=CC=CC=C1C(=O)O MCULE-2756717856 [1,1,0,0,0,0|1,0,0]=3 552 B13R1.589 NC(=O)C1=C(C=CC=C1)SC(F)F MCULE-4826402479 [1,1,0,0,0,0|2,0,0]=4 553 B13R1.589 O=C(Cl)C1=CC=CC=C1SC(F)F MCULE-9773070283 [1,1,0,0,0,0|2,0,0]=4 554 B13R1.589 O=C(O)C1=C(C=CC=C1)OC(F)F MCULE-3732956431 [1,1,0,0,0,0|1,1,0]=4 555 B13R1.589 O=C(O)C1=C(C=CC=C1)SC(F)F MCULE-3000258347 [1,1,0,0,0,0|1,0,0]=3 556 B13R1.589 O=C(O)C1=C(N=CC=C1)SC(F)F MCULE-9433258443 [1,1,0,0,0,0|2,0,0]=4 557 B13R1.2897 CCNC1=C(C(=CC=C1)Br)C(=O)O MCULE-4915103590 [1,1,0,0,0,0|1,0,0]=3 558 B13R1.2897 CCNC1=C(C(=CC=C1)Cl)C(=O)O MCULE-9169336430 [1,1,0,0,0,0|1,0,0]=3 559 B13R1.2897 CCNC1=CC=CC(=C1C(=O)O)C MCULE-8599246721 [1,1,0,0,0,0|1,0,0]=3 560 B13R1.2897 CCNC1=CC=CC(=C1C(=O)O)F MCULE-3067552911 [1,1,0,0,0,0|1,0,0]=3 561 B13R1.2897 CCOC1=C(C(=CC=C1)Cl)C(=O)O MCULE-4900397693 [1,1,0,0,0,0|0,1,0]=3 562 B13R1.2897 CCOC1=C(C(=CC=C1)F)C(=O)O MCULE-2681082799 [1,1,0,0,0,0|0,1,0]=3 563 B13R1.2897 CCOC1=C(C(=CC=N1)C)C(=O)O MCULE-9422100797 [1,1,0,0,0,0|1,1,0]=4 564 B13R1.2897 CCOC1=CC=CC(=C1C(=O)C)O MCULE-5047679961 [1,1,0,0,0,0|1,1,0]=4 565 B13R1.2897 CCOC1=CC=CC(=C1C(=O)O)C MCULE-4323660831 [1,1,0,0,0,0|0,1,0]=3 566 B13R1.2897 COCC1=CC=CC(=C1C(=O)O)N MCULE-6355333323 [1,1,0,0,0,0|2,0,0]=4 567 B13R1.2897 COCC1=CC=CC(=C1C(=O)O)N MCULE-8477971033 [1,1,0,0,0,0|2,0,0]=4 568 B13R1.4012 CCCC1=C(C=CC=C1C(=O)O)Br MCULE-5761831931 [1,1,0,0,0,0|1,0,0]=3 569 B13R1.4012 CCNC1=C(C=CC=C1C(=O)O)Br MCULE-4104918553 [1,1,0,0,0,0|1,0,0]=3 570 B13R1.4012 CCNC1=C(C=CC=C1C(=O)O)F MCULE-3964078977 [1,1,0,0,0,0|1,0,0]=3 571 B13R1.4012 CCNC1=C(C=CC=C1C)C(=O)O MCULE-5475779470 [1,1,0,0,0,0|1,0,0]=3 572 B13R1.4012 CCNC1=C(C=CC=C1Cl)C(=O)O MCULE-9523026469 [1,1,0,0,0,0|1,0,0]=3 573 B13R1.4012 CCOC1=C(C=CC=C1C(=O)C)Br MCULE-4195027460 [1,1,0,0,0,0|1,1,0]=4 574 B13R1.4012 CCOC1=C(C=CC=C1C(=O)C)C MCULE-7372161266 [1,1,0,0,0,0|1,1,0]=4 575 B13R1.4012 CCOC1=C(C=CC=C1C(=O)C)Cl MCULE-2182999929 [1,1,0,0,0,0|1,1,0]=4 576 B13R1.4012 CCOC1=C(C=CC=C1C(=O)O)N MCULE-1306410500 [1,1,0,0,0,0|0,1,0]=3 577 B13R1.4012 CCOC1=C(C=CC=C1F)C(=O)O MCULE-4619065805 [1,1,0,0,0,0|0,1,0]=3 578 B13R1.4012 CCSC1=C(C=CC=C1Br)N(=O)=O MCULE-5972812591 [1,1,0,0,0,0|1,0,1]=4 579 B15R1.810 CCOC(=O)C1=C(C=CC=C1)CC(=O)O MCULE-7841382118 [0,1,0,0,0,1|2,0,0]=4 580 B15R1.1050 CCCOC1=C(C=CC=C1)C(N)C(=O)O MCULE-8272517216 [0,1,0,0,0,1|1,1,0]=4 581 B15R1.1188 CCCCOC1=CC=CC=C1CC(=O)O MCULE-7110121925 [0,1,0,0,0,1|1,1,0]=4 582 B15R1.12062 CCCOC1=C(C=C(C=C1)Br)CC(=O)O MCULE-1543738638 [0,1,0,0,0,1|1,1,0]=4 583 B15R1.559 CCCCNC1=CC=C(C=C1C(=O)O)Br MCULE-8252283426 [0,2,0,0,0,0|2,0,0]=4 584 B15R1.559 CCCCOC1=C(C=C(C=C1)F)C(=O)O MCULE-1372018063 [0,2,0,0,0,0|1,1,0]=4 585 B15R1.559 CCCCOC1=CC=C(C=C1C(=O)O)Br MCULE-3434837975 [0,2,0,0,0,0|1,1,0]=4 586 B15R1.559 CCCCOC1=CC=C(C=C1C(=O)O)C MCULE-9295686716 [0,2,0,0,0,0|1,1,0]=4 587 B15R1.559 CCCCOC1=CC=C(C=C1C(=O)O)Cl MCULE-9305419848 [0,2,0,0,0,0|1,1,0]=4 588 B15R1.559 CCCCOC1=CC=C(C=C1C(=O)O)N MCULE-5607116364 [0,2,0,0,0,0|1,1,0]=4 589 B15R1.559 CCCCSC1=C(C=C(C=C1)Cl)C(=O)O MCULE-2220749220 [0,2,0,0,0,0|1,0,0]=3 590 B15R1.559 COCCOC1=C(C=C(C=C1)Cl)C(=O)O MCULE-2074172106 [0,2,0,0,0,0|1,1,0]=4 591 B15R1.559 COCCOC1=CC=C(C=C1C(=O)O)Br MCULE-2854066185 [0,2,0,0,0,0|1,1,0]=4 592 B15R1.559 COCCOC1=CC=C(C=C1C(=O)O)I MCULE-5336153624 [0,2,0,0,0,0|1,1,0]=4 593 B15R1.2996 CCC(=O)NC1=C(C=C(C=C1)Cl)C(=O)O MCULE-7431689600 [0,2,0,0,0,0|2,0,0]=4 594 B15R1.2996 CCC(=O)NC1=CC=C(C=C1C(=O)O)Br MCULE-3906150536 [0,2,0,0,0,0|2,0,0]=4 595 B15R1.2996 CCC(=O)NC1=CC=C(C=C1C(=O)O)C MCULE-6429068848 [0,2,0,0,0,0|2,0,0]=4 596 B15R1.2996 CCC(=O)NC1=CC=C(C=C1C(=O)O)O MCULE-5714579433 [0,2,0,0,0,0|2,0,0]=4 597 B15R1.8415 CC(C)COC1=C(C=C(C=C1)Br)C(=O)O MCULE-4518960605 [0,2,0,0,0,0|1,1,0]=4 598 B15R1.8415 CC(C)COC1=C(C=C(C=C1)F)C(=O)O MCULE-4237534379 [0,2,0,0,0,0|1,1,0]=4 599 B15R1.8415 CC(C)COC1=CC=C(C=C1C(=O)O)Cl MCULE-1967099634 [0,2,0,0,0,0|1,1,0]=4 600 B15R1.8415 CC(C)COC1=CC=C(C=C1C(=O)O)I MCULE-3667119594 [0,2,0,0,0,0|1,1,0]=4 601 B15R1.8415 CC(C)COC1=CC=C(C=C1C(=O)O)N MCULE-6728460276 [0,2,0,0,0,0|1,1,0]=4 602 B15R1.8415 CC1=CC=C(C(=C1)C(=O)O)OCC(C)C MCULE-6956621469 [0,2,0,0,0,0|1,1,0]=4 603 B15R1.10856 CCCOC1=C(C(=C(C=C1)Br)F)C(=O)O MCULE-9359862758 [0,2,0,0,0,0|1,1,0]=4 604 B15R1.10885 CCCOC1=C(C=C(C=C1)C)C(=O)OC MCULE-9334129014 [0,2,0,0,0,0|1,1,0]=4 605 B15R1.10885 CCCOC1=C(C=C(C=C1)Cl)C(=O)OC MCULE-7091812333 [0,2,0,0,0,0|1,1,0]=4 606 B15R1.10885 CCCOC1=CC=C(C=C1C(=O)OC)Br MCULE-7790248602 [0,2,0,0,0,0|1,1,0]=4 607 B15R1.37929 CCCOC1=C(C=C(C=C1C(=O)O)F)F MCULE-7686264780 [0,2,0,0,0,0|1,1,0]=4 608 B15R1.812 CCCC(=O)C1=CC=CC=C1C(=O)OC MCULE-8737467019 [0,2,0,0,0,0|2,0,0]=4 609 B15R1.812 CCC[C@@H](N)C1=C(C=CC=C1)C(=O)OC MCULE-2221640927 [0,2,0,0,0,0|2,0,0]=4 610 B15R1.812 CCC[C@@H](N)C1=C(C=CC=C1)C(=O)OC MCULE-5023496577 [0,2,0,0,0,0|2,0,0]=4 611 B15R1.812 CCC[C@H](N)C1=C(C=CC=C1)C(=O)OC MCULE-1307630087 [0,2,0,0,0,0|2,0,0]=4 612 B15R1.812 CCC[C@H](N)C1=C(C=CC=C1)C(=O)OC MCULE-8249721656 [0,2,0,0,0,0|2,0,0]=4 613 B15R1.1239 CCCCC(O)C1=CC=CC=C1C(=O)O MCULE-5284879134 [0,2,0,0,0,0|2,0,0]=4 614 B15R1.1239 CCCC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-3628294302 [0,2,0,0,0,0|2,0,0]=4 615 B15R1.1239 CCCC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-5807804563 [0,2,0,0,0,0|2,0,0]=4 616 B15R1.1239 CCCC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-5534457558 [0,2,0,0,0,0|2,0,0]=4 617 B15R1.1239 CCCC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-7990598653 [0,2,0,0,0,0|2,0,0]=4 618 B15R1.1239 NCCC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-5848264146 [0,2,0,0,0,0|2,0,0]=4 619 B15R1.1239 NCCC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-7588246958 [0,2,0,0,0,0|2,0,0]=4 620 B15R1.1239 NCCC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-3727056179 [0,2,0,0,0,0|2,0,0]=4 621 B15R1.1239 NCCC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-4595793345 [0,2,0,0,0,0|2,0,0]=4 622 B15R1.1239 N[C@@H](CCCO)C1=CC=CC=C1C(=O)O MCULE-4094023274 [0,2,0,0,0,0|2,0,0]=4 623 B15R1.1239 N[C@@H](CCCO)C1=CC=CC=C1C(=O)O MCULE-5476358371 [0,2,0,0,0,0|2,0,0]=4 624 B15R1.1239 N[C@H](CCCO)C1=CC=CC=C1C(=O)O MCULE-4815289925 [0,2,0,0,0,0|2,0,0]=4 625 B15R1.1239 N[C@H](CCCO)C1=CC=CC=C1C(=O)O MCULE-6265157443 [0,2,0,0,0,0|2,0,0]=4 626 B15R1.1239 O=C(O)C1=C(C=CC=C1)C(=O)NCCO MCULE-9013972677 [0,2,0,0,0,0|2,0,0]=4 627 B15R1.1239 O=C(O)C1=C(C=CC=C1)C(=O)OCCO MCULE-7534953084 [0,2,0,0,0,0|2,0,0]=4 628 B15R1.1343 CCC(=O)N(C)C1=C(C=CC=C1)C(=O)O MCULE-4208328868 [0,2,0,0,0,0|2,0,0]=4 629 B15R1.1343 CCC(C)[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-5075123513 [0,2,0,0,0,0|2,0,0]=4 630 B15R1.1343 CCC(C)[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-8226217287 [0,2,0,0,0,0|2,0,0]=4 631 B15R1.1343 CCC(C)[C@H](N)C1=CC=CC=C1C(=O)O MCULE-1233512471 [0,2,0,0,0,0|2,0,0]=4 632 B15R1.1343 CCC(C)[C@H](N)C1=CC=CC=C1C(=O)O MCULE-2828147883 [0,2,0,0,0,0|2,0,0]=4 633 B15R1.3598 CCCS(=O)(=O)C1=C(C=CC=C1)C(=O)O MCULE-7952969367 [0,2,0,0,0,0|1,0,1]=4 634 B15R1.5509 CC(C)C[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-3202354481 [0,2,0,0,0,0|2,0,0]=4 635 B15R1.5509 CC(C)C[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-9681961278 [0,2,0,0,0,0|2,0,0]=4 636 B15R1.5509 CC(C)C[C@H](N)C1=CC=CC=C1C(=O)O MCULE-3396342887 [0,2,0,0,0,0|2,0,0]=4 637 B15R1.5509 CC(C)C[C@H](N)C1=CC=CC=C1C(=O)O MCULE-9280326145 [0,2,0,0,0,0|2,0,0]=4 638 B15R1.5509 CC(C)OC(=O)C1=CC=CC=C1C(=O)O MCULE-4101157933 [0,2,0,0,0,0|2,0,0]=4 639 B15R1.1159 CCCCOC1=C(C=CC(=C1)Br)C(=O)O MCULE-7782439971 [0,2,0,0,0,0|1,1,0]=4 640 B15R1.1159 CCCCOC1=CC(=CC=C1C(=O)O)F MCULE-4457597368 [0,2,0,0,0,0|1,1,0]=4 641 B15R1.1159 CCCCSC1=CC(=CC=C1C(=O)N)N MCULE-2583106460 [0,2,0,0,0,0|2,0,0]=4 642 B15R1.3825 CCC(=O)NC1=CC(=CC=C1C(=O)O)Cl MCULE-7352124582 [0,2,0,0,0,0|2,0,0]=4 643 B15R1.8435 CC(C)COC1=C(C=CC(=C1)Cl)C(=O)O MCULE-3023489118 [0,2,0,0,0,0|1,1,0]=4 644 B15R1.8435 CC(C)COC1=CC(=CC=C1C(=O)O)Br MCULE-9698706481 [0,2,0,0,0,0|1,1,0]=4 645 B15R1.8435 CC(C)COC1=CC(=CC=C1C(=O)O)F MCULE-6368048131 [0,2,0,0,0,0|1,1,0]=4 646 B15R1.8435 CC(C)COC1=CC(=CC=C1C(=O)O)I MCULE-3302953714 [0,2,0,0,0,0|1,1,0]=4 647 B15R1.8435 CC(C)COC1=CC(=CC=C1C(=O)O)N MCULE-2841357092 [0,2,0,0,0,0|1,1,0]=4 648 B15R1.10755 CCCOC1=C(C=CC(=C1)OC)C(=O)O MCULE-5650619610 [0,2,0,0,0,0|1,1,0]=4 649 B15R1.10756 CCCOC1=CC(=CC=C1C(=O)OC)O MCULE-8599729393 [0,2,0,0,0,0|1,1,0]=4 650 B15R1.10756 CCCSC1=CC(=CC=C1C(=O)NC)N MCULE-7619633222 [0,2,0,0,0,0|2,0,0]=4 651 B15R1.10973 CCCCC1=C(C(=CC(=C1)O)O)C(=O)O MCULE-2530058952 [0,2,0,0,0,0|2,0,0]=4 652 B15R1.843 CCCOC1=C(C=CC=C1)C(=O)OCC MCULE-2342704819 [0,2,0,0,0,0|1,1,0]=4 653 B15R1.985 COC(=O)C1=C(C=CC=C1)SCC(F)F MCULE-3656098920 [0,2,0,0,0,0|2,0,0]=4 654 B15R1.985 COC(=O)C1=CC=CC=C1SCC(=O)C MCULE-8769122843 [0,2,0,0,0,0|1,0,1]=4 655 B15R1.1191 CCCCNC1=C(C=CC=C1)C(=O)OC MCULE-6061641264 [0,2,0,0,0,0|2,0,0]=4 656 B15R1.1191 COC(=O)C1=C(C=CC=C1)OCCCBr MCULE-4922018691 [0,2,0,0,0,0|1,1,0]=4 657 B15R1.1191 COC(=O)C1=C(C=CC=C1)OCCCN MCULE-3058946098 [0,2,0,0,0,0|1,1,0]=4 658 B15R1.1191 COCCOC1=C(C=CC=C1)C(=O)OC MCULE-1198282297 [0,2,0,0,0,0|1,1,0]=4 659 B15R1.3847 CCC(=O)NC1=CC=CC=C1C(=O)OC MCULE-2487186352 [0,2,0,0,0,0|2,0,0]=4 660 B15R1.3847 CCC(=O)OC1=C(C=CC=C1)C(=O)OC MCULE-6249040161 [0,2,0,0,0,0|1,1,0]=4 661 B15R1.241 CCCCCNC1=CC=CC=C1C(=O)O MCULE-2600087812 [0,2,0,0,0,0|2,0,0]=4 662 B15R1.241 CCCCCOC1=CC=CC=C1C(=O)O MCULE-6863253946 [0,2,0,0,0,0|1,1,0]=4 663 B15R1.241 CCCCCSC1=C(C=CC=C1)C(=O)C MCULE-9085658651 [0,2,0,0,0,0|2,0,0]=4 664 B15R1.241 CCCCCSC1=C(C=CC=C1)C(=O)Cl MCULE-8604539852 [0,2,0,0,0,0|2,0,0]=4 665 B15R1.241 CCCCCSC1=C(C=CC=C1)C(=O)O MCULE-1834743853 [0,2,0,0,0,0|1,0,0]=3 666 B15R1.241 CCCCCSC1=C(C=CC=N1)C(=O)O MCULE-8980215626 [0,2,0,0,0,0|2,0,0]=4 667 B15R1.241 CCOCCOC1=C(C=CC=C1)C(=O)O MCULE-9602431739 [0,2,0,0,0,0|1,1,0]=4 668 B15R1.241 N#CCCCSC1=NC=CC=C1C(=O)O MCULE-1412222282 [0,2,0,0,0,0|2,0,0]=4 669 B15R1.1274 CCCC(=O)NC1=CC=CC=C1C(=O)O MCULE-4925716561 [0,2,0,0,0,0|2,0,0]=4 670 B15R1.1274 CCNC(=O)NC1=C(C=CC=C1)C(=O)O MCULE-5873673343 [0,2,0,0,0,0|2,0,0]=4 671 B15R1.1274 CCOC(=O)NC1=CC=CC=C1C(=O)O MCULE-2925362014 [0,2,0,0,0,0|2,0,0]=4 672 B15R1.1274 CNCC(=O)NC1=C(C=CC=C1)C(=O)O MCULE-5565425641 [0,2,0,0,0,0|2,0,0]=4 673 B15R1.1274 CNCC(=O)NC1=C(C=CC=C1)C(=O)O MCULE-6813730476 [0,2,0,0,0,0|2,0,0]=4 674 B15R1.1274 COCC(=O)NC1=CC=CC=C1C(=O)O MCULE-8711383028 [0,2,0,0,0,0|2,0,0]=4 675 B15R1.1274 O=C(CCCl)NC1=C(C=CC=C1)C(=O)O MCULE-6436435769 [0,2,0,0,0,0|2,0,0]=4 676 B15R1.3990 CC1=C(C(=CC=C1)C(=O)O)OCCCO MCULE-6266124313 [0,2,0,0,0,0|1,1,0]=4 677 B15R1.3990 COCCOC1=C(C=CC=C1C(=O)O)C MCULE-2530949671 [0,2,0,0,0,0|1,1,0]=4 678 B15R1.4455 CCCCOC1=CC=CC(=C1C(=O)O)F MCULE-9509621142 [0,2,0,0,0,0|1,1,0]=4 679 B15R1.4455 COCCOC1=C(C(=CC=C1)F)C(=O)O MCULE-6922753132 [0,2,0,0,0,0|1,1,0]=4 680 B15R1.4455 COCCOC1=CC=CC(=C1C(=O)O)C MCULE-9266753735 [0,2,0,0,0,0|1,1,0]=4 681 B15R1.8882 CC(=CCSC1=C(C=CC=C1)C(=O)O)C MCULE-9531562651 [0,2,0,0,0,0|1,0,1]=4 682 B15R1.8882 CC(=O)C1=C(C=CC=C1)SCCC(C)C MCULE-9091134324 [0,2,0,0,0,0|2,0,0]=4 683 B15R1.8882 CC(C)CCOC1=C(C=CC=C1)C(=O)O MCULE-5114160061 [0,2,0,0,0,0|1,1,0]=4 684 B15R1.8882 CC(C)CCSC1=C(C=CC=C1)C(=O)O MCULE-7006318672 [0,2,0,0,0,0|1,0,0]=3 685 B15R1.8882 CC(C)CCSC1=CC=CC=C1C(=O)Cl MCULE-9858617853 [0,2,0,0,0,0|2,0,0]=4 686 B15R1.8882 CN(C)CCOC1=C(C=CC=C1)C(=O)O MCULE-4407462070 [0,2,0,0,0,0|1,1,0]=4 687 B15R1.8882 CN(C)CCOC1=C(C=CC=C1)C(=O)O MCULE-6269200916 [0,2,0,0,0,0|1,1,0]=4 688 B15R1.8882 CN(C)CCSC1=NC=CC=C1C(=O)O MCULE-6626974862 [0,2,0,0,0,0|2,0,0]=4 689 B15R1.8882 O=C(O)CCSC1=C(C=CC=C1)C(=O)O MCULE-5392426794 [0,2,0,0,0,0|1,0,1]=4 690 B15R1.7707 CCS(=O)(=O)NC1=CC=CC=C1C(=O)O MCULE-5200643629 [0,2,0,0,0,0|2,0,0]=4 691 B15R1.8875 CC(Br)C(=O)NC1=C(C=CC=C1)C(=O)O MCULE-5406950481 [0,2,0,0,0,0|2,0,0]=4 692 B15R1.8875 CC(C)C(=O)NC1=CC=CC=C1C(=O)O MCULE-1896580979 [0,2,0,0,0,0|2,0,0]=4 693 B15R1.8875 CC(Cl)C(=O)NC1=CC=CC=C1C(=O)O MCULE-4012271008 [0,2,0,0,0,0|2,0,0]=4 694 B15R1.40363 CCC(=O)NC1=C(C=CC=C1C)C(=O)O MCULE-9345643873 [0,2,0,0,0,0|2,0,0]=4 695 B15R1.40363 CCC(=O)NC1=C(C=CC=C1Cl)C(=O)O MCULE-5914752952 [0,2,0,0,0,0|2,0,0]=4 696 B15R1.8265 CC(C)COC1=C(C(=CC=C1)F)C(=O)O MCULE-4206421072 [0,2,0,0,0,0|1,1,0]=4 697 B15R1.8265 CC1=C(C(=CC=C1)OCC(C)C)C(=O)O MCULE-3217337127 [0,2,0,0,0,0|1,1,0]=4 698 B15R1.10770 CCCOC1=C(C(=CC=C1F)C)C(=O)O MCULE-2971115168 [0,2,0,0,0,0|1,1,0]=4 699 B15R1.508 CC(C)(C)OCC1=C(C=CC=C1)C(=O)O MCULE-2892754496 [0,2,0,0,0,0|2,0,0]=4 700 B15R1.508 O=C(O)C1=C(C=CC=C1)SCC(F)(F)F MCULE-5084287389 [0,2,0,0,0,0|2,0,0]=4 701 B15R1.6620 CC(C)COC1=C(C=CC=C1C(=O)O)N MCULE-2142451819 [0,2,0,0,0,0|1,1,0]=4 702 B15R1.6620 CC(C)COC1=C(C=CC=C1Cl)C(=O)O MCULE-1339222914 [0,2,0,0,0,0|1,1,0]=4 703 B15R1.6620 CC1=C(C(=CC=C1)C(=O)O)OCC(C)C MCULE-7655083636 [0,2,0,0,0,0|1,1,0]=4 704 B15R1.5343 CCCOC1=C(C=CC=C1C(=O)O)OC MCULE-1347973603 [0,2,0,0,0,0|1,1,0]=4 705 B13R2.32 CC1C=NC2=C(C1=O)C=CC=C2 MCULE-2263660391 [1,0,0,1,0,0|2,0,0]=4 706 B13R2.32 CC1CCC2=C(C1=O)C=CC=C2 MCULE-2306893485 [1,0,0,1,0,0|2,0,0]=4 707 B13R2.32 CC1COC2=C(C1=O)C=CC=C2 MCULE-2941474566 [1,0,0,1,0,0|1,1,0]=4 708 B13R2.32 CC1CSC2=C(C1=O)C=CC=C2 MCULE-1204600064 [1,0,0,1,0,0|1,0,0]=3 709 B13R2.32 O=C1C2=C(C=CC=C2)SCC1Br MCULE-9960973472 [1,0,0,1,0,0|2,0,0]=4 710 B13R2.45 CCC1CC2=CC=CC=C2C1=O MCULE-6009415708 [1,0,0,1,0,0|2,0,0]=4 711 B13R2.1613 O=CC1=C2COCCC2=CC=C1 MCULE-5042097307 [1,0,0,1,0,0|2,0,0]=4 712 B13R2.1613 O=CC1=C2NCCCC2=CC=C1 MCULE-6504940058 [1,0,0,1,0,0|2,0,0]=4 713 B13R2.1613 O=CC1=C2NCCCC2=CC=C1 MCULE-6870034162 [1,0,0,1,0,0|2,0,0]=4 714 B13R2.1613 O=CC1=CC=CC2=C1CCCC2 MCULE-2847784526 [1,0,0,1,0,0|2,0,0]=4 715 B13R2.1613 O=CC1=CC=CC2=C1OCCC2 MCULE-4992092010 [1,0,0,1,0,0|1,1,0]=4 716 B13R2.2528 O=CC1=C(C=CC=C1)C2CCC2 MCULE-6540940792 [1,0,0,1,0,0|2,0,0]=4 717 B13R2.5252 O=C1CCCCC2=C1C=CC=C2 MCULE-8354770318 [1,0,0,1,0,0|2,0,0]=4 718 B13R2.5252 O=C1CCCNC2=C1C=CC=C2 MCULE-3995060336 [1,0,0,1,0,0|2,0,0]=4 719 B13R2.5252 O=C1CCCNC2=CC=CC=C12 MCULE-9607357138 [1,0,0,1,0,0|2,0,0]=4 720 B13R2.5252 O=C1CCCOC2=C1C=CC=C2 MCULE-7113486032 [1,0,0,1,0,0|1,1,0]=4 721 B13R2.5252 O=C1CCCSC2=C1C=CC=C2 MCULE-7559368965 [1,0,0,1,0,0|1,0,0]=3 722 B13R2.5252 O=C1CCNCC2=CC=CC=C12 MCULE-6972709177 [1,0,0,1,0,0|2,0,0]=4 723 B13R2.5252 O=C1CCNCC2=CC=CC=C12 MCULE-7759702701 [1,0,0,1,0,0|2,0,0]=4 724 B13R2.5252 O=C1NCCSC2=C1C=CC=C2 MCULE-5378037418 [1,0,0,1,0,0|2,0,0]=4 725 B13R2.5252 OC1CCCSC2=C1C=CC=C2 MCULE-6399281369 [1,0,0,1,0,0|1,0,1]=4 726 B13R2.5252 O[C@H]1CCCSC2=C1C=CC=C2 MCULE-3664372287 [1,0,0,1,0,0|1,0,1]=4 727 B13R2.328 CC1=CC(=O)C2=C(S1)C=CC=C2 MCULE-8712710754 [1,0,0,1,0,0|1,0,1]=4 728 B13R2.328 CC1=NC2=CC=CC=C2C(=O)O1 MCULE-4681569877 [1,0,0,1,0,0|1,0,1]=4 729 B13R2.328 CC1CC(=O)C2=C(N1)C=CC=C2 MCULE-6378661616 [1,0,0,1,0,0|2,0,0]=4 730 B13R2.328 CC1CC(=O)C2=C(S1)C=CC=C2 MCULE-9509635384 [1,0,0,1,0,0|1,0,0]=3 731 B13R2.328 CC1CC(=O)C2=CC=CC=C2C1 MCULE-4123227699 [1,0,0,1,0,0|2,0,0]=4 732 B13R2.328 CC1CC2=C(C=CC=C2)C(=O)N1 MCULE-4477259052 [1,0,0,1,0,0|2,0,0]=4 733 B13R2.2931 CC=C1OC(=O)C2=C1C=CC=C2 MCULE-2357843157 [1,0,0,1,0,0|1,0,1]=4 734 B13R2.2931 CCC1OC(=O)C2=CC=CC=C12 MCULE-1312406335 [1,0,0,1,0,0|1,0,0]=3 735 B13R2.2931 CC[N+]1=C2C=CC=CC2=C(O1)C MCULE-8858196930 [1,0,0,1,0,0|2,0,0]=4 736 B13R2.2931 CC[N+]1=C2C=CC=CC2=C(O1)C MCULE-8872399397 [1,0,0,1,0,0|2,0,0]=4 737 B13R2.2931 COC1OC(=O)C2=CC=CC=C12 MCULE-9023770050 [1,0,0,1,0,0|2,0,0]=4 738 B13R2.2931 CO[IH2]1OC(=O)C2=CC=CC=C12 MCULE-2735362379 [1,0,0,1,0,0|2,0,0]=4 739 B13R2.2931 NCC1OC(=O)C2=CC=CC=C12 MCULE-2945986135 [1,0,0,1,0,0|2,0,0]=4 740 B13R2.2931 NCC1OC(=O)C2=CC=CC=C12 MCULE-5686972056 [1,0,0,1,0,0|2,0,0]=4 741 B13R2.5514 CC(=O)C1=C(C=CC=C1)C2CC2 MCULE-4665553948 [1,0,0,1,0,0|2,0,0]=4 742 B13R2.5514 NC(=O)C1=C(C=CC=C1)C2CC2 MCULE-3706183757 [1,0,0,1,0,0|2,0,0]=4 743 B13R2.5514 O=C(O)C1=C(C=CC=C1)C2CC2 MCULE-9832471398 [1,0,0,1,0,0|1,0,0]=3 744 B13R2.5514 O=C(O)C1=C(C=CN=C1)C2CC2 MCULE-6058613179 [1,0,0,1,0,0|2,0,0]=4 745 B13R2.5514 O=C(O)C1=C(N=CC=C1)C2CC2 MCULE-9693069433 [1,0,0,1,0,0|2,0,0]=4 746 B13R2.5514 O=C(O)C1=CC=NC=C1C2CC2 MCULE-8604492411 [1,0,0,1,0,0|2,0,0]=4 747 B13R2.5514 O=C(O)C1=NC=CC=C1C2CC2 MCULE-6914517117 [1,0,0,1,0,0|2,0,0]=4 748 B13R2.5569 CC(=O)C1=C2OCCC2=CC=C1 MCULE-2462770649 [1,0,0,1,0,0|1,1,0]=4 749 B13R2.5569 CC(=O)C1=CC=CC2=C1CCC2 MCULE-1634437857 [1,0,0,1,0,0|2,0,0]=4 750 B13R2.5569 CC(=O)C1=CC=CC2=C1NCC2 MCULE-7948902171 [1,0,0,1,0,0|2,0,0]=4 751 B13R2.5569 CC(=O)C1=CC=CC2=C1NCC2 MCULE-9149488481 [1,0,0,1,0,0|2,0,0]=4 752 B13R2.5569 O=C(Cl)C1=CC=CC2=C1OCC2 MCULE-9989864098 [1,0,0,1,0,0|1,1,0]=4 753 B13R2.5569 O=C(O)C1=C2CCCC2=CC=C1 MCULE-3087339991 [1,0,0,1,0,0|1,0,0]=3 754 B13R2.5569 O=C(O)C1=C2CCCC2=NC=C1 MCULE-8480725375 [1,0,0,1,0,0|2,0,0]=4 755 B13R2.5569 O=C(O)C1=C2CCNC2=CC=C1 MCULE-4698173821 [1,0,0,1,0,0|2,0,0]=4 756 B13R2.5569 O=C(O)C1=C2CCNC2=CC=C1 MCULE-7392078101 [1,0,0,1,0,0|2,0,0]=4 757 B13R2.5569 O=C(O)C1=C2CCOC2=CC=C1 MCULE-6654146115 [1,0,0,1,0,0|2,0,0]=4 758 B13R2.5569 O=C(O)C1=C2NCCC2=CC=C1 MCULE-7860180700 [1,0,0,1,0,0|1,0,0]=3 759 B13R2.5569 O=C(O)C1=C2OCCC2=CC=C1 MCULE-7757472811 [1,0,0,1,0,0|0,1,0]=3 760 B13R2.5569 O=C(O)C1=C2SC=CC2=CC=C1 MCULE-6934406879 [1,0,0,1,0,0|0,0,2]=4 761 B13R2.5569 O=C(O)C1=C2SN=CC2=CC=C1 MCULE-6685601083 [1,0,0,1,0,0|1,0,1]=4 762 B13R2.5569 O=C(O)C1=C2SN=NC2=CC=C1 MCULE-4653775499 [1,0,0,1,0,0|2,0,0]=4 763 B13R2.5569 O=C(O)C1=CC=CC2=C1CNC2 MCULE-4644102100 [1,0,0,1,0,0|2,0,0]=4 764 B13R2.5569 O=C(O)C1=CC=CC2=C1CNC2 MCULE-7594340338 [1,0,0,1,0,0|2,0,0]=4 765 B13R2.5569 O=C(O)C1=CC=CC2=C1COC2 MCULE-3573850565 [1,0,0,1,0,0|2,0,0]=4 766 B13R2.5569 O=C(O)C1=CC=CC2=C1OCO2 MCULE-3744823889 [1,0,0,1,0,0|1,1,0]=4 767 B13R2.5569 O=C(O)C1=CC=CC2=C1SC=N2 MCULE-9780843806 [1,0,0,1,0,0|1,0,1]=4 768 B13R2.5569 O=C(O)C1=CN=CC2=C1CCC2 MCULE-2490189795 [1,0,0,1,0,0|2,0,0]=4 769 B15R2.1853 CCC1=C(C2=C(O1)C=CC=C2)C(=O)O MCULE-7251402735 [0,0,0,1,0,1|1,1,0]=4 770 B15R2.988 O=C(O)C1=C2CNCCC2=CC(=C1)F MCULE-4292851024 [0,1,0,1,0,0|2,0,0]=4 771 B15R2.988 O=C(O)C1=C2CNCCC2=CC(=C1)F MCULE-6629490900 [0,1,0,1,0,0|2,0,0]=4 772 B15R2.988 O=C(O)C1=C2NCCCC2=CC(=C1)F MCULE-3804052734 [0,1,0,1,0,0|2,0,0]=4 773 B15R2.988 O=C(O)C1=CC(=CC2=C1NCCC2)Cl MCULE-4719594892 [0,1,0,1,0,0|2,0,0]=4 774 B15R2.65880 CC1=CC(=C(C=C1)NC2CC2)C(=O)O MCULE-5623467449 [0,1,0,1,0,0|2,0,0]=4 775 B15R2.65880 O=C(O)C1=C(C=CC(=C1)Br)NC2CC2 MCULE-6556556129 [0,1,0,1,0,0|2,0,0]=4 776 B15R2.65880 O=C(O)C1=CC(=CC=C1NC2CC2)Cl MCULE-1369523876 [0,1,0,1,0,0|2,0,0]=4 777 B15R2.65880 O=C(O)C1=CC(=CC=C1NC2CC2)F MCULE-2343892059 [0,1,0,1,0,0|2,0,0]=4 778 B15R2.65881 O=C(O)C1=C(C=CC(=C1)Cl)N2CCC2 MCULE-7192439494 [0,1,0,1,0,0|2,0,0]=4 779 B15R2.1221 O=C(O)C1=C(C=CC=C1)C2CCCC2 MCULE-8868400492 [0,1,0,1,0,0|2,0,0]=4 780 B15R2.1221 O=C(O)C1=C(C=CC=C1)N2CCCC2 MCULE-2140132698 [0,1,0,1,0,0|2,0,0]=4 781 B15R2.1221 O=C(O)C1=C(C=CC=C1)N2CCCC2 MCULE-7087265896 [0,1,0,1,0,0|2,0,0]=4 782 B15R2.1221 O=C(O)C1=C(C=CC=C1)[C@@H]2CCCN2 MCULE-2389408596 [0,1,0,1,0,0|2,0,0]=4 783 B15R2.1221 O=C(O)C1=C(C=CC=C1)[C@H]2CCCN2 MCULE-9694972759 [0,1,0,1,0,0|2,0,0]=4 784 B15R2.1221 O=C(O)C1=CC=CC=C1C2=CCCC2 MCULE-5169829895 [0,1,0,1,0,0|2,0,0]=4 785 B15R2.1221 O=C(O)C1=CC=CC=C1[C@@H]2CCCN2 MCULE-4044853758 [0,1,0,1,0,0|2,0,0]=4 786 B15R2.1221 O=C(O)C1=CC=CC=C1[C@H]2CCCN2 MCULE-8812174099 [0,1,0,1,0,0|2,0,0]=4 787 B15R2.16318 N[C@@H](C1=CC=CC=C1C(=O)O)C2CC2 MCULE-1045706675 [0,1,0,1,0,0|2,0,0]=4 788 B15R2.16318 N[C@@H](C1=CC=CC=C1C(=O)O)C2CC2 MCULE-8090273221 [0,1,0,1,0,0|2,0,0]=4 789 B15R2.16318 N[C@H](C1=CC=CC=C1C(=O)O)C2CC2 MCULE-5644764097 [0,1,0,1,0,0|2,0,0]=4 790 B15R2.16318 N[C@H](C1=CC=CC=C1C(=O)O)C2CC2 MCULE-8140435516 [0,1,0,1,0,0|2,0,0]=4 791 B15R2.61345 CN1CCCC2=CC=CC(=C12)C(=O)O MCULE-8940242938 [0,1,0,1,0,0|2,0,0]=4 792 B15R2.61345 O=C(O)C1=C2B(OCCC2=CC=C1)O MCULE-7262238691 [0,1,0,1,0,0|2,0,0]=4 793 B15R2.61345 O=C(O)C1=C2C(=O)CCCC2=CC=C1 MCULE-4297552128 [0,1,0,1,0,0|2,0,0]=4 794 B15R2.7569 O=C(O)C1=C(C=C(C=C1)Br)NC2CC2 MCULE-3597182588 [0,1,0,1,0,0|2,0,0]=4 795 B15R2.7569 O=C(O)C1=C(C=C(C=C1)Cl)NC2CC2 MCULE-9927801349 [0,1,0,1,0,0|2,0,0]=4 796 B15R2.7569 O=C(O)C1=CC=C(C=C1NC2CC2)F MCULE-4322366193 [0,1,0,1,0,0|2,0,0]=4 797 B15R2.14628 NC1=C2CCCCC2=C(C=C1)C(=O)O MCULE-6595279907 [0,1,0,1,0,0|2,0,0]=4 798 B15R2.14628 O=C(O)C1=C2CNCCC2=C(C=C1)F MCULE-1793253112 [0,1,0,1,0,0|2,0,0]=4 799 B15R2.14628 O=C(O)C1=C2CNCCC2=C(C=C1)F MCULE-3426447818 [0,1,0,1,0,0|2,0,0]=4 800 B15R2.14628 O=C(O)C1=C2OCCCC2=C(C=C1)Br MCULE-9722983873 [0,1,0,1,0,0|1,1,0]=4 801 B15R2.19399 COC(=O)C1=C(C=CC=C1)[C@@H]2CCN2 MCULE-1079075702 [0,1,0,1,0,0|2,0,0]=4 802 B15R2.19399 COC(=O)C1=C(C=CC=C1)[C@@H]2CCN2 MCULE-7892342846 [0,1,0,1,0,0|2,0,0]=4 803 B15R2.19399 COC(=O)C1=C(C=CC=C1)[C@H]2CCN2 MCULE-2378603860 [0,1,0,1,0,0|2,0,0]=4 804 B15R2.19399 COC(=O)C1=C(C=CC=C1)[C@H]2CCN2 MCULE-6252262047 [0,1,0,1,0,0|2,0,0]=4 805 B15R2.79765 COC(=O)C1=C2CCCCC2=CC=C1 MCULE-6493751547 [0,1,0,1,0,0|2,0,0]=4 806 B15R2.79765 COC(=O)C1=C2NCCCC2=CC=C1 MCULE-2717613044 [0,1,0,1,0,0|2,0,0]=4 807 B15R2.79765 COC(=O)C1=C2NCCCC2=CC=C1 MCULE-9830976634 [0,1,0,1,0,0|2,0,0]=4 808 B15R2.79765 COC(=O)C1=CC=CC2=C1CNCC2 MCULE-4698683679 [0,1,0,1,0,0|2,0,0]=4 809 B15R2.79765 COC(=O)C1=CC=CC2=C1CNCC2 MCULE-5546938836 [0,1,0,1,0,0|2,0,0]=4 810 B15R2.24 CCN1C=CC2=C1C=CC=C2C(=O)O MCULE-8420656732 [0,1,0,1,0,0|2,0,0]=4 811 B15R2.24 CCN1C=NC2=C1C=CC=C2C(=O)O MCULE-4732318333 [0,1,0,1,0,0|2,0,0]=4 812 B15R2.886 CCCC1=NC2=C(C=CC=C2)C(=O)O1 MCULE-7435970583 [0,1,0,1,0,0|2,0,0]=4 813 B15R2.1428 CCC/C=C/1\OC(=O)C2=CC=CC=C12 MCULE-8062597919 [0,1,0,1,0,0|2,0,0]=4 814 B15R2.1428 CCCC=C1OC(=O)C2=C1C=CC=C2 MCULE-6613339699 [0,1,0,1,0,0|2,0,0]=4 815 B15R2.1428 CCCCC1OC(=O)C2=C1C=CC=C2 MCULE-8188120065 [0,1,0,1,0,0|2,0,0]=4 816 B15R2.1428 CCCC[C@@H]1OC(=O)C2=C1C=CC=C2 MCULE-9593712244 [0,1,0,1,0,0|2,0,0]=4 817 B15R2.1428 CCCC[C@@H]1OC(=O)C2=CC=CC=C12 MCULE-7144582199 [0,1,0,1,0,0|2,0,0]=4 818 B15R2.1428 CCCOC1OC(=O)C2=C1C=CC=C2 MCULE-5925421279 [0,1,0,1,0,0|1,1,0]=4 819 B15R2.13611 CC1CCNC2=C(C=CC=C12)C(=O)O MCULE-4591193991 [0,1,0,1,0,0|2,0,0]=4 820 B15R2.13611 CN1CCOC2=C(C=CC=C12)C(=O)O MCULE-5176013472 [0,1,0,1,0,0|1,1,0]=4 821 B15R2.13611 NC1CCOC2=C(C=CC=C12)C(=O)O MCULE-3866531375 [0,1,0,1,0,0|1,1,0]=4 822 B15R2.13611 N[C@@H]1CCOC2=C1C=CC=C2C(=O)O MCULE-7601018436 [0,1,0,1,0,0|1,1,0]=4 823 B15R2.13611 N[C@H]1CCOC2=C1C=CC=C2C(=O)O MCULE-7048414495 [0,1,0,1,0,0|1,1,0]=4 824 B15R2.13611 O=C(O)C1=C2SCCC(=O)C2=CC=C1 MCULE-3306237727 [0,1,0,1,0,0|1,0,1]=4 825 B15R2.16319 O=C(O)C1=C(C=CC=C1)C#CC2CC2 MCULE-1723101524 [0,1,0,1,0,0|2,0,0]=4 826 B15R2.16319 O=C(O)C1=C(C=CC=C1)OCC2CC2 MCULE-2893095125 [0,1,0,1,0,0|1,1,0]=4 827 B15R2.16320 O=C(O)C1=C(C=CC=C1)OC2CCC2 MCULE-2786499033 [0,1,0,1,0,0|1,1,0]=4 828 B15R2.16320 O=C(O)C1=C(C=CC=C1)OC2CNC2 MCULE-4247986564 [0,1,0,1,0,0|1,1,0]=4 829 B15R2.16320 O=C(O)C1=CC=CC=C1OC2CNC2 MCULE-3144229294 [0,1,0,1,0,0|1,1,0]=4 830 B15R2.69020 O=C(O)C1=C2CCCCCC2=CC=C1 MCULE-6538865388 [0,1,0,1,0,0|2,0,0]=4 831 B15R2.69020 O=C(O)C1=C2OCCCOC2=CC=C1 MCULE-2467620540 [0,1,0,1,0,0|1,1,0]=4 832 B15R2.69020 O=C(O)C1=C2OCCNCC2=CC=C1 MCULE-4451011440 [0,1,0,1,0,0|1,1,0]=4 833 B15R2.69020 O=C(O)C1=C2OCCNCC2=CC=C1 MCULE-8732167630 [0,1,0,1,0,0|1,1,0]=4 834 B15R2.7268 CC1CCC2=CC=CC(=C2N1)C(=O)O MCULE-8232944952 [0,1,0,1,0,0|2,0,0]=4 835 B15R2.7268 O=C1CCC2=C(N1)C(=CC=C2)C(=O)O MCULE-8719652766 [0,1,0,1,0,0|2,0,0]=4 836 B15R2.45730 CC1OC2=C(C=CC=C2C1C)C(=O)O MCULE-5897611290 [0,1,0,1,0,0|1,1,0]=4 837 B15R2.48037 O=C(O)C1=C(C=CC=C1Br)NC2CC2 MCULE-5434356955 [0,1,0,1,0,0|2,0,0]=4 838 B15R2.48037 O=C(O)C1=C(C=CC=C1Cl)NC2CC2 MCULE-5382250748 [0,1,0,1,0,0|2,0,0]=4 839 B15R2.48037 O=C(O)C1=C(C=CC=C1NC2CC2)F MCULE-8573313715 [0,1,0,1,0,0|2,0,0]=4 840 B15R2.14951 CC(Br)C1=NC2=CC=CC=C2C(=O)O1 MCULE-9872745683 [0,1,0,1,0,0|2,0,0]=4 841 B15R2.14951 CC(C)C1=NC2=CC=CC=C2C(=O)O1 MCULE-8002793834 [0,1,0,1,0,0|2,0,0]=4 842 B15R2.53147 CC(C)OC1OC(=O)C2=C1C=CC=C2 MCULE-2202341092 [0,1,0,1,0,0|2,0,0]=4 843 B15R2.69035 CC1(COC2=C(C=CC=C12)C(=O)O)C MCULE-1406608167 [0,1,0,1,0,0|1,1,0]=4 844 B15R2.15373 O=C(O)C1=C(C(=CC=C1)Br)NC2CC2 MCULE-3929529077 [0,1,0,1,0,0|2,0,0]=4 845 B15R2.15373 O=C(O)C1=C(C(=CC=C1)Cl)NC2CC2 MCULE-7433174082 [0,1,0,1,0,0|2,0,0]=4 846 B15R2.15373 O=C(O)C1=C(C(=CC=C1)F)NC2CC2 MCULE-5764609315 [0,1,0,1,0,0|2,0,0]=4 847 B11R1.193 CCCC1=C(C=CN1)C(=O)O MCULE-9782763884 [1,0,0,0,1,0|2,0,0]=4 848 B11R1.193 CCCC1=C(C=CO1)C(=O)O MCULE-2361345479 [1,0,0,0,1,0|2,0,0]=4 849 B11R1.193 CCCN1C=CC=C1C(=O)O MCULE-6023275179 [1,0,0,0,1,0|2,0,0]=4 850 B11R1.193 CCOC1=C(SC=C1)C(=O)O MCULE-7138231478 [1,0,0,0,1,0|1,1,0]=4 851 B11R1.193 CCSC1=C(N=CS1)C(=O)O MCULE-6599169676 [1,0,0,0,1,0|2,0,0]=4 852 B13R1.568 CCCCC1=CC(=CC=C1)C(=O)O MCULE-1983223337 [0,0,0,0,1,1|2,0,0]=4 853 B13R1.568 CCCOC1=CC(=CC=C1)C(=O)O MCULE-4816574520 [0,0,0,0,1,1|1,1,0]=4 854 B13R1.568 CCCSC1=CC=CC(=C1)C(=O)C MCULE-4175570456 [0,0,0,0,1,1|2,0,0]=4 855 B13R1.568 CCCSC1=CC=CC(=C1)C(=O)Cl MCULE-7714774486 [0,0,0,0,1,1|2,0,0]=4 856 B13R1.568 CCCSC1=CC=CC(=C1)C(=O)O MCULE-7673138074 [0,0,0,0,1,1|1,0,0]=3 857 B13R1.568 CCOCC1=CC(=CC=C1)C(=O)O MCULE-6038449364 [0,0,0,0,1,1|2,0,0]=4 858 B13R1.568 O=C(O)C1=CC(=CC=C1)SCCO MCULE-7974621910 [0,0,0,0,1,1|2,0,0]=4 859 B15R1.1051 CCCOC1=C(C=CC=C1)OCC(=O)O MCULE-4817393559 [0,0,0,0,0,2|1,1,0]=4 860 B15R1.1051 CCCOC1=CC=CC=C1C=CC(=O)O MCULE-5715516094 [0,0,0,0,0,2|1,1,0]=4