0 B15R2.327 O=C1CC(S(=O)(=O)N1)C2=CC=CC=C2 MCULE-6572430184 [0,0,0,0,0,0|1,0,0]=1 1 B15R2.327 O=C1CN(S(=O)(=O)N1)C2=CC=CC=C2 MCULE-4539692409 [0,0,0,0,0,0|0,0,0]=0 2 B14R2.333 O=S1(=O)CCCN1C2=CC=CC=C2 MCULE-5942497922 [1,0,0,0,0,0|1,0,1]=3 3 B14R2.333 O=S1(=O)NCCC1C2=CC=CC=C2 MCULE-9307551250 [1,0,0,0,0,0|1,0,1]=3 4 B14R2.333 O=S1(=O)NCCN1C2=CC=CC=C2 MCULE-5729253328 [1,0,0,0,0,0|0,0,1]=2 5 B14R2.598 CC1NC(=O)CC1C2=CC=CC=C2 MCULE-4685085818 [1,0,0,0,0,0|3,0,0]=4 6 B14R2.598 O=C1C=C(C(=O)N1)C2=CC=CC=C2 MCULE-2828609657 [1,0,0,0,0,0|2,0,1]=4 7 B14R2.598 O=C1CC(=O)N(N1)C2=CC=CC=C2 MCULE-5848870096 [1,0,0,0,0,0|3,0,0]=4 8 B14R2.598 O=C1CC(C(=O)N1)C2=CC=CC=C2 MCULE-2407232261 [1,0,0,0,0,0|2,0,0]=3 9 B14R2.598 O=C1CC(C(=O)O1)C2=CC=CC=C2 MCULE-4137983641 [1,0,0,0,0,0|3,0,0]=4 10 B14R2.598 O=C1CN(C(=O)N1)C2=CC=CC=C2 MCULE-7775529135 [1,0,0,0,0,0|1,0,0]=2 11 B14R2.598 O=C1CN(C(=S)N1)C2=CC=CC=C2 MCULE-4695567195 [1,0,0,0,0,0|1,1,0]=3 12 B14R2.598 O=C1C[C@H](C(=O)O1)C2=CC=CC=C2 MCULE-1880064709 [1,0,0,0,0,0|3,0,0]=4 13 B14R2.598 O=C1C[C@H](C(=O)O1)C2=CC=CC=C2 MCULE-5423690820 [1,0,0,0,0,0|3,0,0]=4 14 B14R2.598 O=C1NC(=O)C(N1)C2=CC=CC=C2 MCULE-3804028511 [1,0,0,0,0,0|3,0,0]=4 15 B14R2.598 O=C1NC(=O)C(O1)C2=CC=CC=C2 MCULE-1448816070 [1,0,0,0,0,0|3,0,0]=4 16 B14R2.598 O=C1NC(=O)C(S1)C2=CC=CC=C2 MCULE-8914372547 [1,0,0,0,0,0|3,0,0]=4 17 B14R2.598 O=C1NC(=O)N(N1)C2=CC=CC=C2 MCULE-1387864974 [1,0,0,0,0,0|2,0,0]=3 18 B14R2.598 O=C1NC(=S)CN1C2=CC=CC=C2 MCULE-3980434339 [1,0,0,0,0,0|1,1,0]=3 19 B16R2.11795 CC1=C(S(=O)(=O)NC1=O)C2=CC=CC=C2 MCULE-2752308817 [0,1,0,0,0,0|1,0,1]=3 20 B16R2.33089 O=C1C=C(S(=O)(=O)N1)C2=CC=C(C=C2)Br MCULE-7050528882 [0,1,0,0,0,0|1,0,1]=3 21 B16R2.33089 O=C1C=C(S(=O)(=O)N1)C2=CC=C(C=C2)O MCULE-4837659698 [0,1,0,0,0,0|1,0,1]=3 22 B16R2.80679 O=C1C=C(S(=O)(=O)N1)C2=CC=CC(=C2)Br MCULE-1764751768 [0,1,0,0,0,0|1,0,1]=3 23 B14R1.1485 CC(C)NS(=O)(=O)CC1=CC=CC=C1 MCULE-5981270614 [0,0,1,0,0,0|2,0,1]=4 24 B14R1.1485 N=C(N)NS(=O)(=O)CC1=CC=CC=C1 MCULE-9183794558 [0,0,1,0,0,0|3,0,0]=4 25 B14R1.1485 O=C(O)CS(=O)(=O)CC1=CC=CC=C1 MCULE-4076515710 [0,0,1,0,0,0|3,0,0]=4 26 B14R1.1485 O=N(=O)NS(=O)(=O)CC1=CC=CC=C1 MCULE-4975411567 [0,0,1,0,0,0|3,0,0]=4 27 B14R1.6455 CC(=O)N(CC(=O)O)C1=CC=CC=C1 MCULE-8713782934 [0,0,1,0,0,0|3,0,0]=4 28 B14R1.6708 CN(C1=CC=CC=C1)S(=O)(=O)CCN MCULE-6798622391 [0,0,1,0,0,0|2,0,1]=4 29 B13R1.719 CCC(C1=CC=CC=C1)S(=O)(=O)N MCULE-1551013457 [1,0,1,0,0,0|1,0,1]=4 30 B13R1.719 CCN(C1=CC=CC=C1)S(=O)(=O)C MCULE-3193628843 [1,0,1,0,0,0|1,0,1]=4 31 B13R1.719 CCN(C1=CC=CC=C1)S(=O)(=O)N MCULE-8559872009 [1,0,1,0,0,0|0,0,1]=3 32 B13R1.348 CC(=O)CC(=O)NC1=CC=CC=C1 MCULE-8887978901 [1,0,1,0,0,0|2,0,0]=4 33 B13R1.348 CC(=O)NC(=O)NC1=CC=CC=C1 MCULE-4570583479 [1,0,1,0,0,0|1,0,0]=3 34 B13R1.348 CC(=O)NC(=S)NC1=CC=CC=C1 MCULE-8946412815 [1,0,1,0,0,0|1,1,0]=4 35 B13R1.1327 C=CCS(=O)(=O)NC1=CC=CC=C1 MCULE-9167227476 [1,0,1,0,0,0|1,0,1]=4 36 B13R1.1327 CCNS(=O)(=O)CC1=CC=CC=C1 MCULE-7163847462 [1,0,1,0,0,0|1,0,1]=4 37 B13R1.713 O=CN(CC(=O)O)C1=CC=CC=C1 MCULE-1669781512 [1,0,1,0,0,0|2,0,0]=4 38 B13R1.713 O=NN(CC(=O)O)C1=CC=CC=C1 MCULE-1919590167 [1,0,1,0,0,0|2,0,0]=4 39 B13R1.263 CNS(=O)(=O)C(C)C1=CC=CC=C1 MCULE-4436013205 [1,0,1,0,0,0|1,0,1]=4 40 B13R2.15 O=C1NC=CN1C2=CC=CC=C2 MCULE-2083663290 [2,0,0,0,0,0|1,0,1]=4 41 B13R2.15 O=C1NCCN1C2=CC=CC=C2 MCULE-9543086942 [2,0,0,0,0,0|1,0,1]=4 42 B13R2.10 O=C1CC(=NN1)C2=CC=CC=C2 MCULE-3865612893 [2,0,0,0,0,0|2,0,0]=4 43 B13R2.10 O=C1CC(CN1)C2=CC=CC=C2 MCULE-4630950069 [2,0,0,0,0,0|2,0,0]=4 44 B13R2.10 O=C1CC(NN1)C2=CC=CC=C2 MCULE-1041063156 [2,0,0,0,0,0|2,0,0]=4 45 B13R2.10 O=C1CCN(C1)C2=CC=CC=C2 MCULE-1860228698 [2,0,0,0,0,0|2,0,0]=4 46 B13R2.10 O=C1CCN(C1)C2=CC=CC=C2 MCULE-5037712945 [2,0,0,0,0,0|2,0,0]=4 47 B13R2.10 O=C1CN(C=N1)C2=CC=CC=C2 MCULE-2005045943 [2,0,0,0,0,0|1,0,1]=4 48 B13R2.10 O=C1CN(NO1)C2=CC=CC=C2 MCULE-9739403809 [2,0,0,0,0,0|2,0,0]=4 49 B13R2.10 O=C1C[C@@H](CN1)C2=CC=CC=C2 MCULE-4537200484 [2,0,0,0,0,0|2,0,0]=4 50 B13R2.10 O=C1C[C@H](CN1)C2=CC=CC=C2 MCULE-1458391237 [2,0,0,0,0,0|2,0,0]=4 51 B13R2.10 O=C1C[C@H](CN1)C2=CC=CC=C2 MCULE-4334775779 [2,0,0,0,0,0|2,0,0]=4 52 B15R1.9085 CS(=O)(=O)N(CC(=O)N)C1=CC=CC=C1 MCULE-1546355043 [0,1,1,0,0,0|1,0,0]=3 53 B15R1.9085 CS(=O)(=O)N(CC(=O)O)C1=CC=CC=C1 MCULE-6474523071 [0,1,1,0,0,0|1,0,0]=3 54 B15R1.3465 O=C(NS(=O)(=O)Cl)OCC1=CC=CC=C1 MCULE-8463666268 [0,1,1,0,0,0|2,0,0]=4 55 B15R1.11663 COC(=O)CS(=O)(=O)CC1=CC=CC=C1 MCULE-9977916315 [0,1,1,0,0,0|2,0,0]=4 56 B15R1.16622 CC(C)(C)NS(=O)(=O)NC1=CC=CC=C1 MCULE-3767496301 [0,1,1,0,0,0|1,0,1]=4 57 B15R2.306 NC1=CC=C(C=C1)N2CCCS2(=O)=O MCULE-5388522272 [1,1,0,0,0,0|1,0,1]=4 58 B15R2.306 NC1=CC=C(C=C1)N2CCCS2(=O)=O MCULE-6902563347 [1,1,0,0,0,0|1,0,1]=4 59 B15R2.306 NC1=CC=C(C=C1)N2CCNS2(=O)=O MCULE-9346318749 [1,1,0,0,0,0|0,0,1]=3 60 B15R2.306 O=S1(=O)CCCN1C2=CC=C(C=C2)Br MCULE-6107253470 [1,1,0,0,0,0|1,0,1]=4 61 B15R2.306 O=S1(=O)CCCN1C2=CC=C(C=C2)Cl MCULE-8910451383 [1,1,0,0,0,0|1,0,1]=4 62 B15R2.306 O=S1(=O)CCCN1C2=CC=C(C=C2)F MCULE-6817292680 [1,1,0,0,0,0|1,0,1]=4 63 B15R2.330 NC1=CC=CC(=C1)N2CCCS2(=O)=O MCULE-9374661343 [1,1,0,0,0,0|1,0,1]=4 64 B15R2.330 O=S1(=O)CCCN1C2=CC(=CC=C2)F MCULE-2655767020 [1,1,0,0,0,0|1,0,1]=4 65 B15R2.330 O=S1(=O)CCCN1C2=CC(=CC=C2)I MCULE-3763444746 [1,1,0,0,0,0|1,0,1]=4 66 B15R2.330 O=S1(=O)CCCN1C2=CC(=CC=C2)O MCULE-2624565291 [1,1,0,0,0,0|1,0,1]=4 67 B15R2.330 O=S1(=O)CCCN1C2=CC=CC(=C2)Br MCULE-2708533713 [1,1,0,0,0,0|1,0,1]=4 68 B15R2.330 O=S1(=O)CCCN1C2=CC=CC(=C2)Cl MCULE-5491268164 [1,1,0,0,0,0|1,0,1]=4 69 B15R2.330 O=S1(=O)NCCN1C2=CC(=CC=C2)Br MCULE-5077799814 [1,1,0,0,0,0|0,0,1]=3 70 B15R2.553 O=S1(=O)CCCN1C2=C(C=CC=C2)Br MCULE-8282188402 [1,1,0,0,0,0|1,0,1]=4 71 B15R2.553 O=S1(=O)CCCN1C2=C(C=CC=C2)Cl MCULE-5817275363 [1,1,0,0,0,0|1,0,1]=4 72 B15R2.553 O=S1(=O)CCCN1C2=C(C=CC=C2)F MCULE-1629486816 [1,1,0,0,0,0|1,0,1]=4 73 B15R2.309 CC1=CC=C(C=C1)C2CC(=O)NC2=O MCULE-6426344457 [1,1,0,0,0,0|2,0,0]=4 74 B15R2.309 CC1=CC=C(C=C1)N2CC(=O)NC2=O MCULE-7706271363 [1,1,0,0,0,0|1,0,0]=3 75 B15R2.309 NC1=CC=C(C=C1)C2CC(=O)NC2=O MCULE-7310985704 [1,1,0,0,0,0|2,0,0]=4 76 B15R2.309 O=C1CC(C(=O)N1)C2=CC=C(C=C2)Br MCULE-5300634578 [1,1,0,0,0,0|2,0,0]=4 77 B15R2.309 O=C1CC(C(=O)N1)C2=CC=C(C=C2)Cl MCULE-1347738736 [1,1,0,0,0,0|2,0,0]=4 78 B15R2.309 O=C1CC(C(=O)N1)C2=CC=C(C=C2)F MCULE-5416390662 [1,1,0,0,0,0|2,0,0]=4 79 B15R2.309 O=C1CC(C(=O)N1)C2=CC=C(C=C2)O MCULE-7549769072 [1,1,0,0,0,0|2,0,0]=4 80 B15R2.309 O=C1CN(C(=O)N1)C2=CC=C(C=C2)Br MCULE-6499261399 [1,1,0,0,0,0|1,0,0]=3 81 B15R2.309 O=C1CN(C(=O)N1)C2=CC=C(C=C2)Cl MCULE-1035183079 [1,1,0,0,0,0|1,0,0]=3 82 B15R2.309 O=C1CN(C(=O)N1)C2=CC=C(C=C2)F MCULE-1941836386 [1,1,0,0,0,0|1,0,0]=3 83 B15R2.309 O=C1CN(C(=O)N1)C2=CC=C(C=C2)O MCULE-9602428946 [1,1,0,0,0,0|1,0,0]=3 84 B15R2.321 CN1C(=O)CC(C1=O)C2=CC=CC=C2 MCULE-2027724790 [1,1,0,0,0,0|2,0,0]=4 85 B15R2.321 CN1C(=O)CN(C1=S)C2=CC=CC=C2 MCULE-7426559834 [1,1,0,0,0,0|1,1,0]=4 86 B15R2.321 CN1C(=O)ON(C1=O)C2=CC=CC=C2 MCULE-3229478205 [1,1,0,0,0,0|2,0,0]=4 87 B15R2.323 CC1C(=O)NC(=O)C1C2=CC=CC=C2 MCULE-8870100371 [1,1,0,0,0,0|2,0,0]=4 88 B15R2.323 CC1C(=O)NC(=O)N1C2=CC=CC=C2 MCULE-5115486021 [1,1,0,0,0,0|1,0,0]=3 89 B15R2.323 O=C1NC(=O)C(C1Cl)C2=CC=CC=C2 MCULE-4042075356 [1,1,0,0,0,0|2,0,0]=4 90 B15R2.323 O=C1NC(=O)N(C1=O)C2=CC=CC=C2 MCULE-8485359014 [1,1,0,0,0,0|1,0,1]=4 91 B15R2.324 CC1(CC(=O)NC1=O)C2=CC=CC=C2 MCULE-8692013785 [1,1,0,0,0,0|2,0,0]=4 92 B15R2.334 CC1=CC(=CC=C1)N2CC(=O)NC2=O MCULE-3053480339 [1,1,0,0,0,0|1,0,0]=3 93 B15R2.334 O=C1CC(=O)N(C1)C2=CC=CC(=C2)I MCULE-8139996610 [1,1,0,0,0,0|2,0,0]=4 94 B15R2.334 O=C1CC(C(=O)N1)C2=CC(=CC=C2)F MCULE-6811896162 [1,1,0,0,0,0|2,0,0]=4 95 B15R2.334 O=C1CC(C(=O)N1)C2=CC=CC(=C2)Br MCULE-8644488001 [1,1,0,0,0,0|2,0,0]=4 96 B15R2.334 O=C1CN(C(=O)N1)C2=CC=CC(=C2)Br MCULE-8738091071 [1,1,0,0,0,0|1,0,0]=3 97 B15R2.557 CC1=C(C=CC=C1)N2CC(=O)NC2=O MCULE-1683687537 [1,1,0,0,0,0|1,0,0]=3 98 B15R2.557 O=C1CC(C(=O)N1)C2=C(C=CC=C2)Cl MCULE-4876951895 [1,1,0,0,0,0|2,0,0]=4 99 B15R2.557 O=C1CC(C(=O)N1)C2=C(C=CC=C2)F MCULE-3715612496 [1,1,0,0,0,0|2,0,0]=4 100 B15R2.465 O=S1(=O)NCCCN1C2=CC=CC=C2 MCULE-3613642309 [0,0,1,1,0,0|1,0,1]=4 101 B15R2.728 NCCN1C2=C(C=CC=C2)NS1(=O)=O MCULE-2536903034 [0,0,1,1,0,0|1,0,1]=4 102 B15R2.728 NCCN1C2=C(C=CC=C2)NS1(=O)=O MCULE-3549627632 [0,0,1,1,0,0|1,0,1]=4 103 B15R2.109477 NS(=O)(=O)N1CCCC2=C1C=CC=C2 MCULE-8637379808 [0,0,1,1,0,0|1,0,1]=4 104 B15R2.27 O=C1CN(CC(=O)N1)C2=CC=CC=C2 MCULE-4190754575 [0,0,1,1,0,0|2,0,0]=4 105 B15R2.325 O=C1NC(=O)C(S1)NC2=CC=CC=C2 MCULE-3125752532 [0,0,1,1,0,0|1,1,0]=4 106 B15R2.988 CC(=O)N1CC(=O)NC2=CC=CC=C12 MCULE-5796308542 [0,0,1,1,0,0|2,0,0]=4 107 B15R2.993 NC(=O)CN1C(=O)CC2=C1C=CC=C2 MCULE-7587314961 [0,0,1,1,0,0|2,0,0]=4 108 B15R2.993 NC(=O)CN1C(=O)OC2=C1C=CC=C2 MCULE-9179622725 [0,0,1,1,0,0|1,0,1]=4 109 B15R2.993 NC(=O)CN1C(=O)SC2=C1C=CC=C2 MCULE-4045308105 [0,0,1,1,0,0|1,1,0]=4 110 B15R2.13861 CN1C2=C(C=CC=C2)C(=O)CS1(=O)=O MCULE-9884943182 [0,0,1,1,0,0|1,0,0]=3 111 B13R1.347 C=C(C)NS(=O)(=O)C1=CC=CC=C1 MCULE-1996812585 [0,0,1,0,1,0|1,0,0]=3 112 B13R1.347 CC(=O)CS(=O)(=O)C1=CC=CC=C1 MCULE-4502258369 [0,0,1,0,1,0|1,0,0]=3 113 B13R1.347 CC(=O)NS(=O)(=O)C1=CC=CC=C1 MCULE-3285961265 [0,0,1,0,1,0|0,0,0]=2 114 B13R1.347 CC(C)NS(=O)(=O)C1=CC=CC=C1 MCULE-8244535835 [0,0,1,0,1,0|1,0,1]=4 115 B13R1.347 N=C(N)NS(=O)(=O)C1=CC=CC=C1 MCULE-2204502196 [0,0,1,0,1,0|2,0,0]=4 116 B13R1.347 NC(=O)CS(=O)(=O)C1=CC=CC=C1 MCULE-2423738605 [0,0,1,0,1,0|2,0,0]=4 117 B13R1.347 O=C(O)CS(=O)(=O)C1=CC=CC=C1 MCULE-6144829532 [0,0,1,0,1,0|2,0,0]=4 118 B13R1.1073 CC(C)S(=O)(=O)NC1=CC=CC=C1 MCULE-9293401755 [0,0,1,0,1,0|1,0,1]=4 119 B13R1.1073 CN(C)S(=O)(=O)NC1=CC=CC=C1 MCULE-9990681132 [0,0,1,0,1,0|2,0,0]=4 120 B15R1.12243 O=C(O)CCS(=O)(=O)NC1=CC=CC=C1 MCULE-6236804001 [0,0,1,0,0,1|2,0,0]=4 121 B15R1.12243 O=C(O)CNS(=O)(=O)CC1=CC=CC=C1 MCULE-8784343720 [0,0,1,0,0,1|2,0,0]=4 122 B15R2.388 O=S1(=O)NCCN1CC2=CC=CC=C2 MCULE-6206582484 [1,0,0,0,0,1|0,0,1]=3 123 B15R2.388 O=S1(=O)OCCN1CC2=CC=CC=C2 MCULE-5647291884 [1,0,0,0,0,1|1,0,1]=4 124 B15R2.389 O=C1C=CN(C(=O)N1)C2=CC=CC=C2 MCULE-4795891731 [1,0,0,0,0,1|1,0,1]=4 125 B15R2.389 O=C1C=NN(C(=O)N1)C2=CC=CC=C2 MCULE-5167746752 [1,0,0,0,0,1|1,0,1]=4 126 B15R2.389 O=C1CCN(C(=O)C1)C2=CC=CC=C2 MCULE-6635412281 [1,0,0,0,0,1|2,0,0]=4 127 B15R2.389 O=C1CCN(C(=O)N1)C2=CC=CC=C2 MCULE-7759726448 [1,0,0,0,0,1|1,0,0]=3 128 B15R2.389 O=C1NCC(C(=O)N1)C2=CC=CC=C2 MCULE-4249875322 [1,0,0,0,0,1|2,0,0]=4