0 B18R3.11 C1=CC2=C(C=C1)C(=CC=C2)NC3=NCCS3 MCULE-8533561538 [0,0,0,0,0,0|2,0,0]=2 1 B18R3.11 C1=CC2=CC=CC(=C2C=C1)CC3CCCN3 MCULE-5163958118 [0,0,0,0,0,0|1,0,1]=2 2 B18R3.11 C1=CC2=CC=CC(=C2C=C1)CC3CCCN3 MCULE-9327263122 [0,0,0,0,0,0|1,0,1]=2 3 B18R3.11 C1=CC2=CC=CC(=C2C=C1)CN3CCCC3 MCULE-3599630643 [0,0,0,0,0,0|3,0,0]=3 4 B18R3.11 C1=CC=C2C(=C1)C=CC=C2CC3=NCCN3 MCULE-9097339235 [0,0,0,0,0,0|0,0,0]=0 5 B18R3.11 C1=CC=C2C(=C1)C=CC=C2CC3=NNN=N3 MCULE-8403154323 [0,0,0,0,0,0|2,0,1]=3 6 B18R3.11 C1=CC=C2C(=C1)C=CC=C2CC3=[NH+]CCN3 MCULE-8346078401 [0,0,0,0,0,0|0,0,1]=1 7 B18R3.11 C1=CC=C2C(=C1)C=CC=C2CC3NC=CN3 MCULE-2292993356 [0,0,0,0,0,0|0,0,4]=4 8 B18R3.11 C1=CC=C2C(=C1)C=CC=C2CC3NC=CN3 MCULE-9809661731 [0,0,0,0,0,0|0,0,4]=4 9 B18R3.11 C1=CC=C2C(=C1)C=CC=C2CN3CCCC3 MCULE-8545409706 [0,0,0,0,0,0|3,0,0]=3 10 B19R3.83 CC1CN=C(S1)NC2=C3C=CC=CC3=CC=C2 MCULE-5291347080 [0,1,0,0,0,0|2,0,0]=3 11 B19R3.83 CC1CSC(=N1)NC2=C3C=CC=CC3=CC=C2 MCULE-9319680108 [0,1,0,0,0,0|2,0,0]=3 12 B19R3.83 ClC1=NC(=NN1)CC2=C3C=CC=CC3=CC=C2 MCULE-7999837010 [0,1,0,0,0,0|1,0,2]=4 13 B19R3.83 ClC1=NC(=NS1)CC2=C3C=CC=CC3=CC=C2 MCULE-7330750839 [0,1,0,0,0,0|1,0,2]=4 14 B19R3.83 NC1=NN=C(O1)CC2=C3C=CC=CC3=CC=C2 MCULE-8670175635 [0,1,0,0,0,0|2,0,1]=4 15 B19R3.83 NC1=NN=C(S1)CC2=CC=CC3=CC=CC=C23 MCULE-2605798224 [0,1,0,0,0,0|2,0,1]=4 16 B19R3.83 O=C1CSC(=N1)NC2=C3C=CC=CC3=CC=C2 MCULE-3157034431 [0,1,0,0,0,0|2,0,1]=4 17 B19R3.83 SC1=NN=C(N1)CC2=C3C=CC=CC3=CC=C2 MCULE-2009828861 [0,1,0,0,0,0|1,0,1]=3 18 B19R3.83 SC1=NN=C(O1)CC2=CC=CC3=C2C=CC=C3 MCULE-4052350081 [0,1,0,0,0,0|2,0,1]=4 19 B19R3.163 NN1N=NN=C1NC2=CC=CC3=CC=CC=C23 MCULE-6276533371 [0,1,0,0,0,0|3,0,0]=4 20 B19R3.5644 CC1(CCCN1)CC2=C3C=CC=CC3=CC=C2 MCULE-3068379338 [0,1,0,0,0,0|1,0,1]=3 21 B19R3.5644 CC1(CCCN1)CC2=C3C=CC=CC3=CC=C2 MCULE-8935075911 [0,1,0,0,0,0|1,0,1]=3 22 B19R3.10080 OC1=C(C2=CC=CC=C2C=C1)CN3CCCC3 MCULE-4082798953 [0,1,0,0,0,0|3,0,0]=4 23 B19R3.22126 N[C@@H](C1=CC=CC2=C1C=CC=C2)C3CCCC3 MCULE-6610464492 [0,1,0,0,0,0|2,0,1]=4 24 B19R3.22126 N[C@@H](C1=CC=CC2=C1C=CC=C2)C3CCCC3 MCULE-7289739038 [0,1,0,0,0,0|2,0,1]=4 25 B19R3.22126 N[C@H](C1=CC=CC2=C1C=CC=C2)C3CCCC3 MCULE-7414552096 [0,1,0,0,0,0|2,0,1]=4 26 B19R3.22126 N[C@H](C1=CC=CC2=C1C=CC=C2)C3CCCC3 MCULE-8787603987 [0,1,0,0,0,0|2,0,1]=4 27 B17R2.148072 OCCCNCC1=C2C=CC=CC2=CC=C1 MCULE-8332117796 [0,0,1,0,0,0|3,0,0]=4 28 B17R2.148072 OCCCNCC1=CC=CC2=CC=CC=C12 MCULE-3025450427 [0,0,1,0,0,0|3,0,0]=4 29 B17R2.322318 CCCC(=O)NC1=C2C=CC=CC2=CC=C1 MCULE-2966379064 [0,0,1,0,0,0|3,0,0]=4 30 B17R2.322318 CCCC(=O)OC1=CC=CC2=C1C=CC=C2 MCULE-3370760087 [0,0,1,0,0,0|3,0,0]=4 31 B17R2.322318 CCNC(=O)CC1=C2C=CC=CC2=CC=C1 MCULE-3900786558 [0,0,1,0,0,0|1,0,0]=2 32 B17R2.322318 CCNC(=S)NC1=C2C=CC=CC2=CC=C1 MCULE-8767482066 [0,0,1,0,0,0|2,0,0]=3 33 B17R2.322318 CCNC(=S)NC1=C2C=CC=NC2=CC=C1 MCULE-6255214283 [0,0,1,0,0,0|3,0,0]=4 34 B17R2.322318 CCOC(=N)CC1=CC=CC2=CC=CC=C12 MCULE-5645878061 [0,0,1,0,0,0|1,0,0]=2 35 B17R2.322318 CCOC(=N)CC1=CC=CC2=CC=CC=C12 MCULE-7161699507 [0,0,1,0,0,0|1,0,0]=2 36 B17R2.322318 CCOC(=O)CC1=CC=CC2=C1C=CC=C2 MCULE-1471706008 [0,0,1,0,0,0|2,0,0]=3 37 B17R2.322318 CCOC(=O)CC1=CC=NC2=CC=CC=C12 MCULE-2255365837 [0,0,1,0,0,0|3,0,0]=4 38 B17R2.322318 CCOC(=O)CC1=CN=CC2=C1C=CC=C2 MCULE-7997937273 [0,0,1,0,0,0|3,0,0]=4 39 B17R2.322318 CCOC(=O)NC1=C2C=CC=CC2=CC=C1 MCULE-5206214451 [0,0,1,0,0,0|3,0,0]=4 40 B17R2.322318 CCOC(=S)NC1=C2C=CC=CC2=CC=C1 MCULE-2609281674 [0,0,1,0,0,0|3,0,0]=4 41 B17R2.322318 CONC(=O)NC1=CC=CC2=CC=CC=C12 MCULE-1339327888 [0,0,1,0,0,0|3,0,0]=4 42 B17R3.2679 C1=CC2=C(C=C1)C(=CC=C2)C3=NNN=N3 MCULE-5533888615 [0,0,0,0,1,0|2,0,1]=4 43 B17R3.2679 C1=CC2=C(C=C1)C(=CC=C2)[C@@H]3CCCN3 MCULE-1543559009 [0,0,0,0,1,0|1,0,1]=3 44 B17R3.2679 C1=CC2=C(C=C1)C(=CC=C2)[C@H]3CCCN3 MCULE-7386076738 [0,0,0,0,1,0|1,0,1]=3 45 B17R3.2679 C1=CC2=C(C=C1)C(=CC=N2)[C@@H]3CCCN3 MCULE-7045236655 [0,0,0,0,1,0|2,0,1]=4 46 B17R3.2679 C1=CC2=C(C=C1)C(=CC=N2)[C@@H]3CCCN3 MCULE-9865260895 [0,0,0,0,1,0|2,0,1]=4 47 B17R3.2679 C1=CC2=C(C=C1)C(=CC=N2)[C@H]3CCCN3 MCULE-1023686041 [0,0,0,0,1,0|2,0,1]=4 48 B17R3.2679 C1=CC2=C(C=C1)C(=CC=N2)[C@H]3CCCN3 MCULE-8714835339 [0,0,0,0,1,0|2,0,1]=4 49 B17R3.2679 C1=CC2=C(C=C1)C(=NC=C2)C3=NN=NN3 MCULE-3787344725 [0,0,0,0,1,0|3,0,0]=4 50 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)C3=CC=NN3 MCULE-7286800987 [0,0,0,0,1,0|2,0,1]=4 51 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)C3=NC=CN3 MCULE-4778994258 [0,0,0,0,1,0|0,0,2]=3 52 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)C3=NCCN3 MCULE-9853143567 [0,0,0,0,1,0|0,0,0]=1 53 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)C3=NCC[NH2+]3 MCULE-5902898793 [0,0,0,0,1,0|0,0,1]=2 54 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)C3=NNC=C3 MCULE-3979460666 [0,0,0,0,1,0|2,0,1]=4 55 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)C3CCCN3 MCULE-6006234638 [0,0,0,0,1,0|1,0,1]=3 56 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)C3CCCN3 MCULE-9141175340 [0,0,0,0,1,0|1,0,1]=3 57 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)N3CCCC3 MCULE-2429583137 [0,0,0,0,1,0|3,0,0]=4 58 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)[C@@H]3CCCN3 MCULE-1494780348 [0,0,0,0,1,0|1,0,1]=3 59 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)[C@H]3CCCN3 MCULE-3138468905 [0,0,0,0,1,0|1,0,1]=3 60 B17R3.2679 C1=CC2=CC=CC(=C2N=C1)C3=NC=CN3 MCULE-7145486670 [0,0,0,0,1,0|1,0,2]=4 61 B17R3.2679 C1=CC=C2C(=C1)C=CC=C2C3NCCS3 MCULE-1410800545 [0,0,0,0,1,0|1,0,1]=3 62 B17R3.2679 C1=CC=C2C(=C1)C=CC=C2C3NCCS3 MCULE-4964774111 [0,0,0,0,1,0|1,0,1]=3 63 B17R3.2679 C1=CC=C2C(=C1)N=CC=C2C3=NC=CN3 MCULE-6620557685 [0,0,0,0,1,0|1,0,2]=4 64 B17R3.2679 C1=CNC(=C1)C2=C3C=CC=CC3=CC=C2 MCULE-9675642358 [0,0,0,0,1,0|1,0,2]=4 65 B17R3.2681 C1=CC2=C(C=C1)C(=CN2)CC3=NN=NN3 MCULE-9618951334 [0,0,0,0,1,0|3,0,0]=4 66 B19R3.28 C1=CC2=C(C=C1)C(=CC=C2)CN3CCOCC3 MCULE-2227029940 [0,0,0,0,0,1|3,0,0]=4 67 B19R3.28 C1=CC2=C(C=C1)C(=CC=C2)CN3CCSCC3 MCULE-3186084710 [0,0,0,0,0,1|3,0,0]=4 68 B19R3.28 C1=CC2=CC=CC(=C2C=C1)CC3CCCCN3 MCULE-5038815370 [0,0,0,0,0,1|1,0,1]=3 69 B19R3.28 C1=CC2=CC=CC(=C2C=C1)CC3COCCN3 MCULE-2629325527 [0,0,0,0,0,1|1,0,1]=3 70 B19R3.28 C1=CC2=CC=CC(=C2C=C1)CC3COCCN3 MCULE-6652583018 [0,0,0,0,0,1|1,0,1]=3 71 B19R3.28 C1=CC2=CC=CC(=C2C=C1)CN3CCNCC3 MCULE-2330821475 [0,0,0,0,0,1|3,0,0]=4 72 B19R3.28 C1=CC2=CC=CC(=C2C=C1)CN3CCNCC3 MCULE-8874365290 [0,0,0,0,0,1|3,0,0]=4 73 B19R3.28 C1=CC2=CC=CC(=C2C=C1)OC3CCCNC3 MCULE-4219539347 [0,0,0,0,0,1|2,0,1]=4 74 B19R3.28 C1=CC2=NC=CC(=C2C=C1)CC3CCCNC3 MCULE-1703019918 [0,0,0,0,0,1|2,0,1]=4 75 B19R3.28 C1=CC=C2C(=C1)C=CC=C2CC3CCCCN3 MCULE-5079788258 [0,0,0,0,0,1|1,0,1]=3 76 B19R3.28 C1=CC=C2C(=C1)C=NC=C2CC3CCCNC3 MCULE-6310408684 [0,0,0,0,0,1|2,0,1]=4 77 B19R3.28 C1=CN=C2C=CC=C(C2=C1)CC3CCCNC3 MCULE-9684977686 [0,0,0,0,0,1|2,0,1]=4 78 B19R3.4444 C1=CC2=CC=CC(=C2C=C1)CNC3CCCC3 MCULE-3114127716 [0,0,0,0,0,1|2,0,1]=4 79 B19R3.4444 C1=CC2=CC=CC(=C2C=C1)CSC3=NC=NN3 MCULE-5838210029 [0,0,0,0,0,1|1,0,1]=3 80 B19R3.4444 C1=CC2=NC=CC(=C2C=C1)OCC3CCCN3 MCULE-6639334096 [0,0,0,0,0,1|2,0,1]=4 81 B19R3.4444 C1=CC=C2C(=C1)C=CC=C2CNC3=NN=NN3 MCULE-7194328041 [0,0,0,0,0,1|2,0,0]=3 82 B19R3.4444 C1=CC=C2C(=C1)C=CC=C2CNC3=NNC=N3 MCULE-5609163327 [0,0,0,0,0,1|1,0,2]=4 83 B19R3.4444 C1=CC=C2C(=C1)C=CC=C2CSC3=NCCN3 MCULE-1521550147 [0,0,0,0,0,1|0,0,0]=1 84 B19R3.4444 C1=CC=C2C(=C1)C=CC=C2CSC3=NCCN3 MCULE-3963844041 [0,0,0,0,0,1|0,0,0]=1 85 B19R3.4444 C1=CC=C2C(=C1)C=CC=C2NCC3CCCN3 MCULE-8611059889 [0,0,0,0,0,1|1,0,1]=3 86 B19R3.4444 C1=CC=C2C(=C1)C=CC=C2NCC3CCCN3 MCULE-8836726430 [0,0,0,0,0,1|1,0,1]=3 87 B19R3.4444 C1=CC=C2C(=C1)C=CC=C2OCC3=NN=NN3 MCULE-3225964569 [0,0,0,0,0,1|2,0,0]=3 88 B19R3.4444 N(CC1=CC=CC2=CC=CC=C12)C3CCCC3 MCULE-5193276663 [0,0,0,0,0,1|2,0,1]=4 89 B16R2.50359 CCCNCC1=C2C=CC=CC2=NC=C1 MCULE-4850295247 [1,0,1,0,0,0|2,0,0]=4 90 B16R2.50359 N(CCO)CC1=CC=CC2=CC=CC=C12 MCULE-1556770476 [1,0,1,0,0,0|1,0,0]=3 91 B16R2.50359 NCCCOC1=C2C=CC=CC2=CC=C1 MCULE-3260091406 [1,0,1,0,0,0|1,0,1]=4 92 B16R2.50359 NCCCOC1=C2C=CC=CC2=CC=C1 MCULE-7241126328 [1,0,1,0,0,0|1,0,1]=4 93 B16R2.50359 NCCSCC1=C2C=CC=CC2=CC=C1 MCULE-3899526970 [1,0,1,0,0,0|1,0,0]=3 94 B16R2.50359 OCCNCC1=CC=CC2=CC=CC=C12 MCULE-1068854356 [1,0,1,0,0,0|1,0,0]=3 95 B16R2.50359 OCCNCC1=CC=CC2=CC=CC=C12 MCULE-4068351373 [1,0,1,0,0,0|1,0,0]=3 96 B16R2.50359 OCCNCC1=NC=CC2=C1C=CC=C2 MCULE-1266299306 [1,0,1,0,0,0|2,0,0]=4 97 B16R2.170412 CCC(=O)CC1=C2C=CC=CC2=CC=C1 MCULE-8407980606 [1,0,1,0,0,0|1,0,0]=3 98 B16R2.170412 CCC(=O)NC1=CC=CC2=C1C=CC=C2 MCULE-2461330856 [1,0,1,0,0,0|2,0,0]=4 99 B16R2.170412 CCC(=O)OC1=CC=CC2=CC=CC=C12 MCULE-9835195678 [1,0,1,0,0,0|2,0,0]=4 100 B16R2.170412 CNC(=O)NC1=C2C=CC=CC2=CC=C1 MCULE-1800286325 [1,0,1,0,0,0|2,0,0]=4 101 B16R2.170412 CNC(=O)OC1=C2C=CC=CC2=CC=C1 MCULE-7779321694 [1,0,1,0,0,0|2,0,0]=4 102 B16R2.170412 CNC(=S)NC1=CC=CC2=C1C=CC=C2 MCULE-7765385345 [1,0,1,0,0,0|2,0,0]=4 103 B16R2.170412 COC(=O)CC1=C2C=CC=CC2=CC=C1 MCULE-6528586657 [1,0,1,0,0,0|2,0,0]=4 104 B16R2.170412 N/C(=N\O)/CC1=CC=CC2=CC=CC=C12 MCULE-2782743976 [1,0,1,0,0,0|1,0,0]=3 105 B16R2.170412 NNC(=O)CC1=CC=CC2=CC=CC=C12 MCULE-1159690001 [1,0,1,0,0,0|2,0,0]=4 106 B16R2.170412 O=C(CC1=C2C=CC=CC2=CC=C1)NO MCULE-4696425449 [1,0,1,0,0,0|2,0,0]=4 107 B16R2.170412 O=C(CCl)CC1=C2C=CC=CC2=CC=C1 MCULE-3006967928 [1,0,1,0,0,0|2,0,0]=4 108 B18R2.165811 CNCCCNCC1=CC=CC2=CC=CC=C12 MCULE-3534872542 [0,1,1,0,0,0|2,0,0]=4 109 B18R2.165811 CNCCCNCC1=CC=CC2=CC=CC=C12 MCULE-7947458883 [0,1,1,0,0,0|2,0,0]=4 110 B18R2.165811 COCCNCCC1=C2C=CC=CC2=CC=C1 MCULE-3110816912 [0,1,1,0,0,0|1,0,1]=4 111 B18R2.165811 OCCNCCOC1=C2C=CC=CC2=CC=C1 MCULE-1510193437 [0,1,1,0,0,0|1,0,1]=4 112 B18R2.165811 OCCNCCOC1=C2C=CC=CC2=CC=C1 MCULE-2437562518 [0,1,1,0,0,0|1,0,1]=4 113 B18R2.556536 CC(C)CNNCC1=C2C=CC=CC2=CC=C1 MCULE-9515685100 [0,1,1,0,0,0|2,0,0]=4 114 B18R2.883208 CCCNC(=O)OC1=CC=CC2=C1C=CC=C2 MCULE-1712251264 [0,1,1,0,0,0|2,0,0]=4 115 B18R2.883208 NCCNC(=O)CC1=C2C=CC=CC2=CC=C1 MCULE-1117008617 [0,1,1,0,0,0|0,0,1]=3 116 B18R2.883208 NCCNC(=O)CC1=C2C=CC=CC2=CC=C1 MCULE-6493327818 [0,1,1,0,0,0|0,0,1]=3 117 B18R2.883208 O=C(CC1=CC=CC2=CC=CC=C12)NCCO MCULE-7168789913 [0,1,1,0,0,0|1,0,0]=3 118 B18R2.883208 O=C(NCCBr)NC1=CC=CC2=CC=CC=C12 MCULE-7577274483 [0,1,1,0,0,0|2,0,0]=4 119 B18R2.883208 O=C(NCCO)NC1=C2C=CC=CC2=CC=C1 MCULE-9884592104 [0,1,1,0,0,0|2,0,0]=4 120 B18R2.924133 NCCCC[C@@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-1341580127 [0,1,1,0,0,0|1,0,1]=4 121 B18R2.924133 NCCCC[C@@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-6466724695 [0,1,1,0,0,0|1,0,1]=4 122 B18R2.924133 NCCCC[C@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-1676762493 [0,1,1,0,0,0|1,0,1]=4 123 B18R2.924133 NCCCC[C@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-1819660725 [0,1,1,0,0,0|1,0,1]=4 124 B18R2.124776 CCOC(=O)CC1=C2C=CC=CC2=C(C=C1)N MCULE-5885158381 [0,1,1,0,0,0|2,0,0]=4 125 B18R2.124776 CCOC(=O)CC1=CC=C(C2=C1C=CC=C2)C MCULE-2803783176 [0,1,1,0,0,0|2,0,0]=4 126 B18R2.124776 CCOC(=O)CC1=CC=C(C2=CC=CC=C12)Br MCULE-6465377016 [0,1,1,0,0,0|2,0,0]=4 127 B18R2.124867 CCOC(=O)CC1=C(C=CC2=CC=CC=C12)C MCULE-5215313784 [0,1,1,0,0,0|2,0,0]=4 128 B18R2.904449 CON(C)C(=O)CC1=C2C=CC=CC2=CC=C1 MCULE-5392546925 [0,1,1,0,0,0|2,0,0]=4 129 B18R2.2462422 CCOC(=O)C(N)C1=C2C=CC=CC2=CC=C1 MCULE-1568018993 [0,1,1,0,0,0|2,0,0]=4 130 B18R2.2462422 CCOC(=O)C(N)C1=C2C=CC=CC2=CC=C1 MCULE-8904631324 [0,1,1,0,0,0|2,0,0]=4 131 B18R2.2880857 CC(C)NC(=S)NC1=CC=CC2=CC=CC=C12 MCULE-7050796966 [0,1,1,0,0,0|2,0,0]=4 132 B18R2.2880857 CC(C)NC(C)CC1=CC=CC2=CC=CC=C12 MCULE-2004256835 [0,1,1,0,0,0|1,0,1]=4 133 B18R2.2880857 CC(C)NC(C)CC1=CC=CC2=CC=CC=C12 MCULE-9875380504 [0,1,1,0,0,0|1,0,1]=4 134 B18R3.31633 N[C@@H](C1=CC=CC2=C1C=CC=C2)C3CCC3 MCULE-1072886153 [0,1,0,0,1,0|1,0,1]=4 135 B18R3.31633 N[C@@H](C1=CC=CC2=C1C=CC=C2)C3CCC3 MCULE-5614380794 [0,1,0,0,1,0|1,0,1]=4 136 B18R3.31633 N[C@H](C1=CC=CC2=C1C=CC=C2)C3CCC3 MCULE-4834812222 [0,1,0,0,1,0|1,0,1]=4 137 B18R3.31633 N[C@H](C1=CC=CC2=C1C=CC=C2)C3CCC3 MCULE-8392507425 [0,1,0,0,1,0|1,0,1]=4 138 B18R3.221 OC1=C(C2=C(C=CC=C2)C=C1)[C@@H]3CCCN3 MCULE-7316328504 [0,1,0,0,1,0|1,0,1]=4 139 B18R3.221 OC1=C(C2=C(C=CC=C2)C=C1)[C@@H]3CCCN3 MCULE-7839267130 [0,1,0,0,1,0|1,0,1]=4 140 B18R3.221 OC1=C(C2=C(C=CC=C2)C=C1)[C@H]3CCCN3 MCULE-7329777260 [0,1,0,0,1,0|1,0,1]=4 141 B18R3.221 OC1=C(C2=C(C=CC=C2)C=C1)[C@H]3CCCN3 MCULE-8268654797 [0,1,0,0,1,0|1,0,1]=4 142 B18R3.2910 NC1=NN=C(N1)C2=C3C=CC=CC3=CC=C2 MCULE-9545031106 [0,1,0,0,1,0|1,0,1]=4 143 B18R3.6430 CC1=C2C=CC=CC2=C(C=C1)[C@@H]3CCCN3 MCULE-5755868469 [0,1,0,0,1,0|1,0,1]=4 144 B18R3.6430 CC1=C2C=CC=CC2=C(C=C1)[C@H]3CCCN3 MCULE-3127712915 [0,1,0,0,1,0|1,0,1]=4 145 B18R3.6430 CC1=CC=C(C2=C1C=CC=C2)C3=NC=NN3 MCULE-4835518676 [0,1,0,0,1,0|1,0,1]=4 146 B18R3.6430 OC1=C2C=CC=CC2=C(C=C1)[C@@H]3CCCN3 MCULE-8968097686 [0,1,0,0,1,0|1,0,1]=4 147 B18R3.6430 OC1=C2C=CC=CC2=C(C=C1)[C@H]3CCCN3 MCULE-5265700145 [0,1,0,0,1,0|1,0,1]=4 148 B18R3.6430 [C@@H]1(CCCN1)C2=C3C=CC=CC3=C(C=C2)O MCULE-9988263736 [0,1,0,0,1,0|1,0,1]=4 149 B18R3.6430 [C@@H]1(CCCN1)C2=CC=C(C3=C2C=CC=C3)C MCULE-6249089516 [0,1,0,0,1,0|1,0,1]=4 150 B18R3.6430 [C@H]1(CCCN1)C2=C3C=CC=CC3=C(C=C2)O MCULE-3666058849 [0,1,0,0,1,0|1,0,1]=4 151 B18R3.6430 [C@H]1(CCCN1)C2=CC=C(C3=C2C=CC=C3)C MCULE-9166449893 [0,1,0,0,1,0|1,0,1]=4 152 B20R3.418 CN1C=CN=C1SCC2=C3C=CC=CC3=CC=C2 MCULE-7325656226 [0,1,0,0,0,1|0,0,2]=4 153 B20R3.418 CN1C=NN=C1SCC2=C3C=CC=CC3=CC=C2 MCULE-8629784071 [0,1,0,0,0,1|1,0,1]=4 154 B20R3.418 CN1CCCC1CNC2=CC=CC3=CC=CC=C23 MCULE-9613879155 [0,1,0,0,0,1|1,0,1]=4 155 B20R3.418 CN1CCC[C@H]1CNC2=C3C=CC=CC3=CC=C2 MCULE-1016011454 [0,1,0,0,0,1|1,0,1]=4 156 B20R3.418 CN1CCC[C@H]1CNC2=CC=CC3=C2C=CC=C3 MCULE-7632869437 [0,1,0,0,0,1|1,0,1]=4 157 B20R3.418 CN1N=NN=C1NCC2=CC=CC3=CC=CC=C23 MCULE-3090504835 [0,1,0,0,0,1|2,0,0]=4 158 B20R3.418 CN1N=NN=C1SCC2=C3C=CC=CC3=CC=C2 MCULE-9285874861 [0,1,0,0,0,1|2,0,0]=4 159 B20R3.5155 CC1=NN=C(N1)SCC2=C3C=CC=CC3=CC=C2 MCULE-8243696639 [0,1,0,0,0,1|1,0,1]=4 160 B20R3.16136 O=C(NC1=NCCS1)C2=C3C=CC=CC3=CC=C2 MCULE-6187613966 [0,1,0,0,0,1|1,0,1]=4 161 B20R3.27706 CN1C(=NN=C1CC2=C3C=CC=CC3=CC=C2)S MCULE-3828029102 [0,2,0,0,0,0|1,0,1]=4 162 B20R3.27706 NN1C(=NN=C1CC2=CC=CC3=C2C=CC=C3)S MCULE-3546317886 [0,2,0,0,0,0|1,0,1]=4 163 B20R3.26788 CN1C=CN=C1C(O)C2=CC=CC3=CC=CC=C23 MCULE-2640960813 [0,2,0,0,0,0|0,0,2]=4 164 B18R3.36580 C1=CC2=C(C=C1)C=C(C=C2)CC3CCCN3 MCULE-3036756685 [0,0,1,1,0,0|1,0,1]=4 165 B18R3.36580 C1=CC2=C(C=C1)C=C(C=C2)CC3CCCN3 MCULE-8350520376 [0,0,1,1,0,0|1,0,1]=4 166 B18R3.36580 C1=CC2=C(C=C1)CCC(=C2)CC3=NCCN3 MCULE-4437674254 [0,0,1,1,0,0|0,0,2]=4 167 B18R3.36580 C1=CC2=CC=C(C=C2C=C1)CC3=NCCN3 MCULE-4581148654 [0,0,1,1,0,0|0,0,0]=2 168 B18R3.2108 C1=CC2=C(C=C1)C(=CC=C2)C3CCCNC3 MCULE-5607788976 [0,0,1,1,0,0|1,0,1]=4 169 B18R3.2108 C1=CC2=C(C=C1)C(=CC=C2)[C@@H]3CCCCN3 MCULE-1309964395 [0,0,1,1,0,0|1,0,1]=4 170 B18R3.2108 C1=CC2=C(C=C1)C(=CC=C2)[C@@H]3CCCCN3 MCULE-2701532127 [0,0,1,1,0,0|1,0,1]=4 171 B18R3.2108 C1=CC2=C(C=C1)C(=CC=C2)[C@@H]3CNCCN3 MCULE-1829476430 [0,0,1,1,0,0|0,0,2]=4 172 B18R3.2108 C1=CC2=C(C=C1)C(=CC=C2)[C@@H]3CNCCN3 MCULE-3522638221 [0,0,1,1,0,0|0,0,2]=4 173 B18R3.2108 C1=CC2=C(C=C1)C(=CC=C2)[C@@H]3COCCN3 MCULE-2298708612 [0,0,1,1,0,0|1,0,1]=4 174 B18R3.2108 C1=CC2=C(C=C1)C(=CC=C2)[C@@H]3COCCN3 MCULE-8157808625 [0,0,1,1,0,0|1,0,1]=4 175 B18R3.2108 C1=CC2=C(C=C1)C(=CC=C2)[C@H]3CCCCN3 MCULE-1460443181 [0,0,1,1,0,0|1,0,1]=4 176 B18R3.2108 C1=CC2=C(C=C1)C(=CC=C2)[C@H]3CCCCN3 MCULE-5824646031 [0,0,1,1,0,0|1,0,1]=4 177 B18R3.2108 C1=CC2=C(C=C1)C(=CC=C2)[C@H]3CNCCN3 MCULE-3095828886 [0,0,1,1,0,0|0,0,2]=4 178 B18R3.2108 C1=CC2=C(C=C1)C(=CC=C2)[C@H]3CNCCN3 MCULE-3175878367 [0,0,1,1,0,0|0,0,2]=4 179 B18R3.2108 C1=CC2=C(C=C1)C(=CC=C2)[C@H]3COCCN3 MCULE-3783576403 [0,0,1,1,0,0|1,0,1]=4 180 B18R3.2108 C1=CC2=C(C=C1)C(=CC=C2)[C@H]3COCCN3 MCULE-5777970781 [0,0,1,1,0,0|1,0,1]=4 181 B18R3.2108 C1=CC2=CC=CC(=C2C=C1)C3CCCNC3 MCULE-9221597694 [0,0,1,1,0,0|1,0,1]=4 182 B18R3.2108 C1=CC2=CC=CC(=C2C=C1)C3CNCCN3 MCULE-1565143713 [0,0,1,1,0,0|0,0,2]=4 183 B18R3.2108 C1=CC2=CC=CC(=C2C=C1)C3CNCCN3 MCULE-2754887778 [0,0,1,1,0,0|0,0,2]=4 184 B18R3.2108 C1=CC2=CC=CC(=C2C=C1)C3CNCCO3 MCULE-4289608844 [0,0,1,1,0,0|1,0,1]=4 185 B18R3.2108 C1=CC2=CC=CC(=C2C=C1)C3CSCCN3 MCULE-9111005255 [0,0,1,1,0,0|1,0,1]=4 186 B18R3.61863 CCCN1C=NC2=CC=CC3=C2C1=CC=C3 MCULE-6815085628 [0,0,1,1,0,0|2,0,0]=4 187 B18R3.1019323 O=C(NC1=C2C=CC=CC2=CC=C1)N3CC3 MCULE-9659177291 [0,0,1,1,0,0|2,0,0]=4 188 B16R2.160202 CCCC(=O)C1=CC=CC2=CC=CC=C12 MCULE-4950786005 [0,0,1,0,1,0|2,0,0]=4 189 B16R2.160202 CCC[C@@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-3770132728 [0,0,1,0,1,0|1,0,1]=4 190 B16R2.160202 CCC[C@@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-5224524081 [0,0,1,0,1,0|1,0,1]=4 191 B16R2.160202 CCC[C@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-2931627469 [0,0,1,0,1,0|1,0,1]=4 192 B16R2.160202 CCC[C@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-7820074099 [0,0,1,0,1,0|1,0,1]=4 193 B16R2.160202 CCOC(=O)C1=C2C=CC=CC2=CC=C1 MCULE-9486216078 [0,0,1,0,1,0|2,0,0]=4 194 B16R3.1816 C1=CC2=C(C=C1)C(=CC=C2)[C@@H]3CCN3 MCULE-1739034633 [0,0,0,0,2,0|0,0,1]=3 195 B16R3.1816 C1=CC2=C(C=C1)C(=CC=C2)[C@@H]3CCN3 MCULE-8207062529 [0,0,0,0,2,0|0,0,1]=3 196 B16R3.1816 C1=CC2=C(C=C1)C(=CC=C2)[C@H]3CCN3 MCULE-3853554779 [0,0,0,0,2,0|0,0,1]=3 197 B16R3.1816 C1=CC2=C(C=C1)C(=CC=C2)[C@H]3CCN3 MCULE-9830785681 [0,0,0,0,2,0|0,0,1]=3 198 B16R3.1816 C1=CC2=C(C=C1)C(=CC=N2)[C@@H]3CCN3 MCULE-2516898416 [0,0,0,0,2,0|1,0,1]=4 199 B16R3.1816 C1=CC2=C(C=C1)C(=CC=N2)[C@@H]3CCN3 MCULE-5347406522 [0,0,0,0,2,0|1,0,1]=4 200 B16R3.1816 C1=CC2=C(C=C1)C(=CC=N2)[C@H]3CCN3 MCULE-1329323684 [0,0,0,0,2,0|1,0,1]=4 201 B16R3.1816 C1=CC2=C(C=C1)C(=CC=N2)[C@H]3CCN3 MCULE-4764431063 [0,0,0,0,2,0|1,0,1]=4 202 B16R3.8 C1=CC2=C(C=C1)C(=CN2)C3=NCCO3 MCULE-6591026232 [0,0,0,0,2,0|2,0,0]=4 203 B20R3.2340 C1=CC2=C(C=C1)C(=CC=C2)/N=C\3/NCCCCS3 MCULE-8612913070 [0,0,0,0,0,2|2,0,0]=4 204 B20R3.2720 C1=CC=C2C(=C1)C=CC=C2OCC3CCCNC3 MCULE-1120773003 [0,0,0,0,0,2|1,0,1]=4 205 B20R3.2720 C1=CC=C2C(=C1)C=CC=C2OCC3CCCNC3 MCULE-2093950811 [0,0,0,0,0,2|1,0,1]=4