0 B19R2.121587 CCOC1=CC(=C(C=C1)C=C2NC(=S)NC2=O)O MCULE-5072540193 [0,0,0,0,0,0|2,0,0]=2 1 B19R2.121587 CCOC1=CC=C(C(=C1)O)C=C2SC(=N)NC2=O MCULE-2401750487 [0,0,0,0,0,0|0,0,0]=0 2 B19R2.121587 CCOC1=CC=C(C(=C1)O)C=C2SC(=O)NC2=O MCULE-1447258858 [0,0,0,0,0,0|1,0,0]=1 3 B19R2.121587 CCOC1=CC=C(C(=C1)O)C=C2SC(=S)NC2=O MCULE-4553498818 [0,0,0,0,0,0|1,0,0]=1 4 B18R2.30607 CCOC1=CC=C(C=C1)/C=C\2/SC(=NC2=O)S MCULE-8837871146 [1,0,0,0,0,0|1,0,1]=3 5 B18R2.30607 CCOC1=CC=C(C=C1)C=C2NC(=O)NC2=O MCULE-8284261371 [1,0,0,0,0,0|2,0,0]=3 6 B18R2.30607 CCOC1=CC=C(C=C1)C=C2NC(=S)NC2=O MCULE-8115418596 [1,0,0,0,0,0|2,0,0]=3 7 B18R2.30607 CCOC1=CC=C(C=C1)C=C2SC(=N)N=C2O MCULE-8491314186 [1,0,0,0,0,0|0,0,2]=3 8 B18R2.30607 CCOC1=CC=C(C=C1)C=C2SC(=NC2=O)S MCULE-2666852639 [1,0,0,0,0,0|1,0,1]=3 9 B18R2.30607 CCOC1=CC=C(C=C1)C=C2SC(=O)N=C2O MCULE-8949117582 [1,0,0,0,0,0|1,0,2]=4 10 B18R2.30607 CCOC1=CC=C(C=C1)C=C2SC(=O)NC2=S MCULE-3603457516 [1,0,0,0,0,0|1,1,0]=3 11 B18R2.30607 CCOC1=CC=C(C=C1)CC2SC(=N)NC2=O MCULE-8790878288 [1,0,0,0,0,0|0,0,2]=3 12 B18R2.30607 CCOC1=CC=C(C=C1)NC2SC(=O)NC2=O MCULE-9526660957 [1,0,0,0,0,0|2,0,1]=4 13 B18R2.121176 COC1=CC(=C(C=C1)C=C2NC(=O)NC2=O)C MCULE-8795341274 [1,0,0,0,0,0|3,0,0]=4 14 B20R2.188208 CCOC1=CC(=C(C=C1)C=C2SC(=S)N(C2=O)C)O MCULE-6260050910 [0,1,0,0,0,0|1,0,0]=2 15 B20R3.2780664 N=C1NC(=O)C(=CC2=C(C=C3OCOC3=C2)Cl)S1 MCULE-4187392414 [0,0,0,1,0,0|2,0,0]=3 16 B20R3.2780664 N=C1NC(=O)C(=CC2=CC3=C(C=C2Br)OCO3)S1 MCULE-2102907349 [0,0,0,1,0,0|2,0,0]=3 17 B20R3.2780664 O=C1NC(=O)C(=CC2=C(C=C3OCOC3=C2)Br)S1 MCULE-9071893080 [0,0,0,1,0,0|3,0,0]=4 18 B20R3.2780664 O=C1NC(=O)C(=CC2=C(C=C3OCOC3=C2)Cl)S1 MCULE-4736426597 [0,0,0,1,0,0|3,0,0]=4 19 B20R3.2780664 O=C1NC(=S)SC1=CC2=CC3=C(C=C2Cl)OCO3 MCULE-6364569303 [0,0,0,1,0,0|3,0,0]=4 20 B20R3.2780664 O=C\1NC(=S)S/C1=C/C2=C(C=C3OCOC3=C2)Br MCULE-5988650629 [0,0,0,1,0,0|3,0,0]=4 21 B17R2.3630 CCC1=CC=C(C=C1)/C=C\2/SC(=S)NC2=O MCULE-1318779619 [2,0,0,0,0,0|1,0,0]=3 22 B17R2.3630 CCC1=CC=C(C=C1)C=C2NC(=O)NC2=O MCULE-4985774210 [2,0,0,0,0,0|2,0,0]=4 23 B17R2.3630 CCC1=CC=C(C=C1)C=C2NC(=S)NC2=O MCULE-8025795641 [2,0,0,0,0,0|2,0,0]=4 24 B17R2.3630 CCC1=CC=C(C=C1)C=C2SC(=N)NC2=O MCULE-1287509889 [2,0,0,0,0,0|0,0,0]=2 25 B17R2.3630 CCC1=CC=C(C=C1)C=C2SC(=NC2=O)S MCULE-4145716650 [2,0,0,0,0,0|1,0,1]=4 26 B17R2.3630 CCC1=CC=C(C=C1)C=C2SC(=O)NC2=O MCULE-7387059782 [2,0,0,0,0,0|1,0,0]=3 27 B17R2.3630 COC1=CC=C(C=C1)/C=C/2\SC(=NC2=O)S MCULE-8525616303 [2,0,0,0,0,0|1,0,1]=4 28 B17R2.3630 COC1=CC=C(C=C1)/C=C/2\SC(=O)NC2=O MCULE-7717607908 [2,0,0,0,0,0|1,0,0]=3 29 B17R2.3630 COC1=CC=C(C=C1)/C=C\2/SC(=NC2=O)S MCULE-9808745705 [2,0,0,0,0,0|1,0,1]=4 30 B17R2.3630 COC1=CC=C(C=C1)/C=C\2/SC(=O)NC2=O MCULE-6913904614 [2,0,0,0,0,0|1,0,0]=3 31 B17R2.3630 COC1=CC=C(C=C1)C=C2NC(=O)NC2=O MCULE-9090338409 [2,0,0,0,0,0|2,0,0]=4 32 B17R2.3630 COC1=CC=C(C=C1)C=C2NC(=S)NC2=O MCULE-5185321157 [2,0,0,0,0,0|2,0,0]=4 33 B17R2.3630 COC1=CC=C(C=C1)C=C2SC(=N)N=C2O MCULE-6809511574 [2,0,0,0,0,0|0,0,2]=4 34 B17R2.3630 COC1=CC=C(C=C1)C=C2SC(=N)NC2=O MCULE-7216243368 [2,0,0,0,0,0|0,0,0]=2 35 B17R2.3630 COC1=CC=C(C=C1)C=C2SC(=NC2=O)S MCULE-3674984644 [2,0,0,0,0,0|1,0,1]=4 36 B17R2.3630 COC1=CC=C(C=C1)C=C2SC(=O)NC2=O MCULE-5915271029 [2,0,0,0,0,0|1,0,0]=3 37 B17R2.3630 COC1=CC=C(C=C1)C=C2SC(=O)NC2=S MCULE-1082236639 [2,0,0,0,0,0|1,1,0]=4 38 B17R2.3630 COC1=CC=C(C=C1)CC2SC(=N)NC2=O MCULE-4084237059 [2,0,0,0,0,0|0,0,2]=4 39 B17R2.3630 CSC1=CC=C(C=C1)/C=C\2/SC(=S)NC2=O MCULE-7839834354 [2,0,0,0,0,0|1,1,0]=4 40 B17R2.3630 CSC1=CC=C(C=C1)C=C2SC(=N)NC2=O MCULE-1913975495 [2,0,0,0,0,0|0,1,0]=3 41 B17R2.3630 CSC1=CC=C(C=C1)C=C2SC(=O)NC2=O MCULE-6542689184 [2,0,0,0,0,0|1,1,0]=4 42 B17R2.3630 CSC1=CC=C(C=C1)C=C2SC(=S)NC2=O MCULE-7296229469 [2,0,0,0,0,0|1,1,0]=4 43 B17R2.3630 N#CC1=CC=C(C=C1)C=C2SC(=N)NC2=O MCULE-4488208690 [2,0,0,0,0,0|1,0,1]=4 44 B17R2.3630 N=C1NC(=O)C(=CC2=CC=C(C=C2)C=O)S1 MCULE-6182959641 [2,0,0,0,0,0|1,0,1]=4 45 B17R2.42572 CC1=CC(=C(C=C1)C=C2SC(=N)NC2=O)C MCULE-6170391226 [2,0,0,0,0,0|1,0,0]=3 46 B17R2.42572 CC1=CC(=C(C=C1)C=C2SC(=O)NC2=O)C MCULE-7766528204 [2,0,0,0,0,0|2,0,0]=4 47 B17R2.42572 N=C1NC(=O)C(=CC2=C(C=C(C=C2)Cl)Cl)S1 MCULE-9089982410 [2,0,0,0,0,0|2,0,0]=4 48 B17R2.42572 N=C1NC(=O)C(=CC2=CC=C(C=C2O)O)S1 MCULE-3968803906 [2,0,0,0,0,0|0,0,0]=2 49 B17R2.42572 O=C1NC(=S)SC1=CC2=C(C=C(C=C2)O)O MCULE-4663739056 [2,0,0,0,0,0|1,0,0]=3 50 B19R2.16855 CCOC1=CC=C(C=C1)C=C2C(=O)NC(=N)N2C MCULE-4585140040 [1,1,0,0,0,0|1,0,0]=3 51 B19R2.24539 C=CCOC1=CC=C(C=C1)C=C2SC(=O)NC2=O MCULE-2433622792 [1,1,0,0,0,0|1,0,1]=4 52 B19R2.24539 CCCOC1=CC=C(C=C1)/C=C/2\SC(=O)NC2=O MCULE-4437498636 [1,1,0,0,0,0|1,0,0]=3 53 B19R2.24539 CCCOC1=CC=C(C=C1)/C=C\2/SC(=O)NC2=O MCULE-3426820757 [1,1,0,0,0,0|1,0,0]=3 54 B19R2.24539 CCCOC1=CC=C(C=C1)C=C2NC(=S)NC2=O MCULE-2987680961 [1,1,0,0,0,0|2,0,0]=4 55 B19R2.24539 CCCOC1=CC=C(C=C1)C=C2SC(=O)NC2=O MCULE-4938789839 [1,1,0,0,0,0|1,0,0]=3 56 B19R2.24539 CCCOC1=CC=C(C=C1)C=C2SC(=S)NC2=O MCULE-7678364480 [1,1,0,0,0,0|1,0,0]=3 57 B19R2.46846 CCOC1=C(C=C(C=C1)C=C2NC(=O)NC2=O)I MCULE-1163368666 [1,1,0,0,0,0|2,0,0]=4 58 B19R2.46846 CCOC1=C(C=C(C=C1)C=C2NC(=S)NC2=O)I MCULE-2786222848 [1,1,0,0,0,0|2,0,0]=4 59 B19R2.46846 CCOC1=C(C=C(C=C1)C=C2SC(=O)NC2=O)Cl MCULE-5465507425 [1,1,0,0,0,0|1,0,0]=3 60 B19R2.46846 CCOC1=C(C=C(C=C1)C=C2SC(=O)NC2=O)I MCULE-7478516543 [1,1,0,0,0,0|1,0,0]=3 61 B19R2.46846 CCOC1=CC=C(C=C1Br)C=C2NC(=O)NC2=O MCULE-7074259620 [1,1,0,0,0,0|2,0,0]=4 62 B19R2.46846 CCOC1=CC=C(C=C1Br)C=C2SC(=N)NC2=O MCULE-5130438029 [1,1,0,0,0,0|0,0,0]=2 63 B19R2.46846 CCOC1=CC=C(C=C1Br)C=C2SC(=S)NC2=O MCULE-7046025291 [1,1,0,0,0,0|1,0,0]=3 64 B19R2.46846 CCOC1=CC=C(C=C1Cl)C=C2NC(=O)NC2=O MCULE-6213970994 [1,1,0,0,0,0|2,0,0]=4 65 B19R2.46846 CCOC1=CC=C(C=C1Cl)C=C2NC(=S)NC2=O MCULE-6226911469 [1,1,0,0,0,0|2,0,0]=4 66 B19R2.46846 CCOC1=CC=C(C=C1Cl)C=C2SC(=N)NC2=O MCULE-2281158847 [1,1,0,0,0,0|0,0,0]=2 67 B19R2.46846 CCOC1=CC=C(C=C1Cl)C=C2SC(=S)NC2=O MCULE-8962803758 [1,1,0,0,0,0|1,0,0]=3 68 B19R2.47086 CCOC1=CC=C(C=C1)C=C2SC(=O)N(C2=O)C MCULE-1827975690 [1,1,0,0,0,0|1,0,0]=3 69 B19R2.47086 CCOC1=CC=C(C=C1)C=C2SC(=S)N(C2=O)C MCULE-2159058270 [1,1,0,0,0,0|1,0,0]=3 70 B19R2.47086 CCOC1=CC=C(C=C1)C=C2SC(=S)N(C2=O)N MCULE-7274203309 [1,1,0,0,0,0|1,0,0]=3 71 B19R2.91903 CC(=O)NC1=CC=C(C=C1)C=C2SC(=N)NC2=O MCULE-7583795015 [1,1,0,0,0,0|1,0,1]=4 72 B19R2.91903 CC(=O)OC1=CC=C(C=C1)/C=C/2\SC(=S)NC2=O MCULE-6254359691 [1,1,0,0,0,0|1,0,1]=4 73 B19R2.91903 CC(=O)OC1=CC=C(C=C1)C=C2SC(=O)NC2=O MCULE-8345829475 [1,1,0,0,0,0|1,0,1]=4 74 B19R2.91903 CC(=O)OC1=CC=C(C=C1)C=C2SC(=S)NC2=O MCULE-6844909536 [1,1,0,0,0,0|1,0,1]=4 75 B19R2.91903 CC(C)OC1=CC=C(C=C1)/C=C\2/SC(=NC2=O)S MCULE-8504588518 [1,1,0,0,0,0|1,0,1]=4 76 B19R2.91903 CC(C)OC1=CC=C(C=C1)C=C2NC(=O)NC2=O MCULE-7679378863 [1,1,0,0,0,0|2,0,0]=4 77 B19R2.91903 CC(C)OC1=CC=C(C=C1)C=C2SC(=N)NC2=O MCULE-7125964109 [1,1,0,0,0,0|0,0,0]=2 78 B19R2.91903 CC(C)OC1=CC=C(C=C1)C=C2SC(=NC2=O)S MCULE-5889729406 [1,1,0,0,0,0|1,0,1]=4 79 B19R2.154476 CCN(C)C1=CC=C(C=C1)C=C2SC(=S)NC2=O MCULE-1212109853 [1,1,0,0,0,0|2,0,0]=4 80 B19R2.154476 COC(=O)C1=CC=C(C=C1)/C=C/2\SC(=N)NC2=O MCULE-5978512467 [1,1,0,0,0,0|2,0,0]=4 81 B19R2.154476 COC(=O)C1=CC=C(C=C1)C=C2SC(=N)NC2=O MCULE-3060947838 [1,1,0,0,0,0|2,0,0]=4 82 B19R2.30482 COC1=CC(=C(C=C1)C=C2NC(=S)NC2=O)OC MCULE-1027549205 [1,1,0,0,0,0|2,0,0]=4 83 B19R2.30482 COC1=CC(=C(C=C1)C=C2SC(=N)NC2=O)OC MCULE-8142012321 [1,1,0,0,0,0|0,0,0]=2 84 B19R2.30482 COC1=CC=C(C(=C1)OC)C=C2NC(=O)NC2=O MCULE-8514222634 [1,1,0,0,0,0|2,0,0]=4 85 B19R2.30482 COC1=CC=C(C(=C1)OC)C=C2SC(=O)NC2=O MCULE-4895415987 [1,1,0,0,0,0|1,0,0]=3 86 B19R2.30482 COC1=CC=C(C(=C1)OC)C=C2SC(=S)NC2=O MCULE-5227434977 [1,1,0,0,0,0|1,0,0]=3 87 B21R2.5049283 CCOC1=CC=C(C(=C1)O)C=C2C(=O)NC(=O)NC2=O MCULE-4837074946 [0,1,0,0,0,1|2,0,0]=4 88 B21R2.5044583 CCOC1=CC(=C(C=C1)C=C2NC(=S)NC2=O)OCC MCULE-7813707030 [0,2,0,0,0,0|2,0,0]=4 89 B21R2.5044583 CCOC1=CC(=C(C=C1)C=C2SC(=N)NC2=O)OCC MCULE-6544822980 [0,2,0,0,0,0|0,0,0]=2 90 B21R2.5044583 CCOC1=CC(=C(C=C1)C=C2SC(=S)NC2=O)OCC MCULE-5162466163 [0,2,0,0,0,0|1,0,0]=3 91 B21R2.5044583 CCOC1=CC=C(C(=C1)OCC)C=C2NC(=O)NC2=O MCULE-2105290789 [0,2,0,0,0,0|2,0,0]=4 92 B21R2.5044583 CCOC1=CC=C(C(=C1)OCC)C=C2SC(=O)NC2=O MCULE-4204723347 [0,2,0,0,0,0|1,0,0]=3 93 B21R2.250892 CCN(CC)C1=CC=C(C(=C1)O)C=C2SC(=N)NC2=O MCULE-5758095834 [0,2,0,0,0,0|1,0,0]=3 94 B21R2.250892 CCN(CC)C1=CC=C(C(=C1)O)C=C2SC(=O)NC2=O MCULE-3550235458 [0,2,0,0,0,0|2,0,0]=4 95 B21R2.250892 CCN(CC)C1=CC=C(C(=C1)O)C=C2SC(=S)NC2=O MCULE-4520516293 [0,2,0,0,0,0|2,0,0]=4 96 B21R2.2517765 CCOC1=C(C=C(C(=C1)Br)C=C2SC(=O)NC2=O)OC MCULE-8084850864 [0,2,0,0,0,0|2,0,0]=4 97 B19R3.2143136 N=C1NC(=O)C(=CC2=CC3=C(C=C2)OCO3)S1 MCULE-1890892864 [1,0,0,1,0,0|1,0,0]=3 98 B19R3.2143136 O=C1NC(=O)/C(=C/C2=CC=C3OCOC3=C2)/S1 MCULE-6600333613 [1,0,0,1,0,0|2,0,0]=4 99 B19R3.2143136 O=C1NC(=O)/C(=C\C2=CC=C3OCOC3=C2)/S1 MCULE-6019718648 [1,0,0,1,0,0|2,0,0]=4 100 B19R3.2143136 O=C1NC(=O)C(=CC2=CC3=C(C=C2)OCO3)S1 MCULE-7153710267 [1,0,0,1,0,0|2,0,0]=4 101 B19R3.2143136 O=C1NC(=S)SC1=CC2=CC3=C(C=C2)CCC3 MCULE-1009578789 [1,0,0,1,0,0|2,0,0]=4 102 B19R3.2143136 O=C1NC(=S)SC1=CC2=CC=C3OCOC3=C2 MCULE-9900357653 [1,0,0,1,0,0|2,0,0]=4 103 B19R3.2143136 O=C\1NC(=S)S/C1=C/C2=CC3=C(C=C2)OCO3 MCULE-9193943993 [1,0,0,1,0,0|2,0,0]=4 104 B21R3.746297 COC1=C(C=C2CCCC2=C1)C=C3SC(=O)NC3=O MCULE-1486964615 [0,1,0,1,0,0|2,0,0]=4 105 B21R3.746297 COC1=CC2=C(C=C1/C=C/3\SC(=S)NC3=O)OCO2 MCULE-5475585364 [0,1,0,1,0,0|2,0,0]=4 106 B21R3.746297 COC1=CC2=C(C=C1C=C3SC(=O)NC3=O)OCO2 MCULE-1969346581 [0,1,0,1,0,0|2,0,0]=4 107 B21R3.746297 COC1=CC2=C(C=C1C=C3SC(=S)NC3=O)OCO2 MCULE-8672331693 [0,1,0,1,0,0|2,0,0]=4 108 B19R2.118107 CCOC1=C(C(=CC=C1)/C=C\2/SC(=NC2=O)S)O MCULE-8573707141 [0,0,0,0,1,1|1,0,1]=4 109 B19R2.118107 CCOC1=C(C(=CC=C1)C=C2NC(=O)NC2=O)O MCULE-6798748270 [0,0,0,0,1,1|2,0,0]=4 110 B19R2.118107 CCOC1=CC=CC(=C1O)C=C2NC(=S)NC2=O MCULE-8500616554 [0,0,0,0,1,1|2,0,0]=4 111 B19R2.118107 CCOC1=CC=CC(=C1O)C=C2SC(=N)NC2=O MCULE-8138656550 [0,0,0,0,1,1|0,0,0]=2 112 B19R2.118107 CCOC1=CC=CC(=C1O)C=C2SC(=NC2=O)S MCULE-4372245207 [0,0,0,0,1,1|1,0,1]=4 113 B19R2.118107 CCOC1=CC=CC(=C1O)C=C2SC(=O)NC2=O MCULE-9314675500 [0,0,0,0,1,1|1,0,0]=3 114 B19R2.121381 CCOC1=CC(=C(C=C1)Br)/C=C/2\SC(=N)NC2=O MCULE-7935414632 [0,0,0,0,1,1|1,0,0]=3 115 B19R2.121381 CCOC1=CC(=C(C=C1)Br)C=C2SC(=S)NC2=O MCULE-7613921399 [0,0,0,0,1,1|2,0,0]=4 116 B19R2.121381 CCOC1=CC=C(C(=C1)C=C2SC(=N)NC2=O)Br MCULE-3392148463 [0,0,0,0,1,1|1,0,0]=3