0 B18R3.11 C1=CC2=C(C=C1)C(=CC=C2)NC3=NCCS3 MCULE-8533561538 [1,0,0,0,0,0|2,0,0]=3 1 B18R3.11 C1=CC2=CC=CC(=C2C=C1)CC3CCCN3 MCULE-5163958118 [1,0,0,0,0,0|1,0,1]=3 2 B18R3.11 C1=CC2=CC=CC(=C2C=C1)CC3CCCN3 MCULE-9327263122 [1,0,0,0,0,0|1,0,1]=3 3 B18R3.11 C1=CC2=CC=CC(=C2C=C1)CN3CCCC3 MCULE-3599630643 [1,0,0,0,0,0|3,0,0]=4 4 B18R3.11 C1=CC=C2C(=C1)C=CC=C2CC3=NCCN3 MCULE-9097339235 [1,0,0,0,0,0|0,0,0]=1 5 B18R3.11 C1=CC=C2C(=C1)C=CC=C2CC3=NNN=N3 MCULE-8403154323 [1,0,0,0,0,0|2,0,1]=4 6 B18R3.11 C1=CC=C2C(=C1)C=CC=C2CC3=[NH+]CCN3 MCULE-8346078401 [1,0,0,0,0,0|0,0,1]=2 7 B18R3.11 C1=CC=C2C(=C1)C=CC=C2CN3CCCC3 MCULE-8545409706 [1,0,0,0,0,0|3,0,0]=4 8 B18R2.124776 CCOC(=O)CC1=C2C=CC=CC2=C(C=C1)N MCULE-5885158381 [0,0,1,0,0,0|3,0,0]=4 9 B18R2.124776 CCOC(=O)CC1=CC=C(C2=C1C=CC=C2)C MCULE-2803783176 [0,0,1,0,0,0|3,0,0]=4 10 B18R2.124776 CCOC(=O)CC1=CC=C(C2=CC=CC=C12)Br MCULE-6465377016 [0,0,1,0,0,0|2,1,0]=4 11 B18R3.6430 CC1=C2C=CC=CC2=C(C=C1)[C@@H]3CCCN3 MCULE-5755868469 [0,0,0,0,1,0|2,0,1]=4 12 B18R3.6430 CC1=C2C=CC=CC2=C(C=C1)[C@H]3CCCN3 MCULE-3127712915 [0,0,0,0,1,0|2,0,1]=4 13 B18R3.6430 CC1=CC=C(C2=C1C=CC=C2)C3=NC=NN3 MCULE-4835518676 [0,0,0,0,1,0|2,0,1]=4 14 B18R3.6430 OC1=C2C=CC=CC2=C(C=C1)[C@@H]3CCCN3 MCULE-8968097686 [0,0,0,0,1,0|2,0,1]=4 15 B18R3.6430 OC1=C2C=CC=CC2=C(C=C1)[C@H]3CCCN3 MCULE-5265700145 [0,0,0,0,1,0|2,0,1]=4 16 B18R3.6430 [C@@H]1(CCCN1)C2=C3C=CC=CC3=C(C=C2)O MCULE-9988263736 [0,0,0,0,1,0|2,0,1]=4 17 B18R3.6430 [C@@H]1(CCCN1)C2=CC=C(C3=C2C=CC=C3)C MCULE-6249089516 [0,0,0,0,1,0|2,0,1]=4 18 B18R3.6430 [C@H]1(CCCN1)C2=C3C=CC=CC3=C(C=C2)O MCULE-3666058849 [0,0,0,0,1,0|2,0,1]=4 19 B18R3.6430 [C@H]1(CCCN1)C2=CC=C(C3=C2C=CC=C3)C MCULE-9166449893 [0,0,0,0,1,0|2,0,1]=4 20 B20R3.13189 ClC1=C2C=CC=CC2=C(C=C1)OC3CCCNC3 MCULE-3369642088 [0,0,0,0,0,1|2,0,1]=4 21 B20R3.13189 ClC1=C2C=CC=CC2=C(C=C1)OC3CCCNC3 MCULE-7889358879 [0,0,0,0,0,1|2,0,1]=4 22 B17R2.322318 CCNC(=O)CC1=C2C=CC=CC2=CC=C1 MCULE-3900786558 [1,0,1,0,0,0|1,0,0]=3 23 B17R2.322318 CCNC(=S)NC1=C2C=CC=CC2=CC=C1 MCULE-8767482066 [1,0,1,0,0,0|2,0,0]=4 24 B17R2.322318 CCOC(=N)CC1=CC=CC2=CC=CC=C12 MCULE-5645878061 [1,0,1,0,0,0|1,0,0]=3 25 B17R2.322318 CCOC(=N)CC1=CC=CC2=CC=CC=C12 MCULE-7161699507 [1,0,1,0,0,0|1,0,0]=3 26 B17R2.322318 CCOC(=O)CC1=CC=CC2=C1C=CC=C2 MCULE-1471706008 [1,0,1,0,0,0|2,0,0]=4 27 B19R3.83 CC1CN=C(S1)NC2=C3C=CC=CC3=CC=C2 MCULE-5291347080 [1,1,0,0,0,0|2,0,0]=4 28 B19R3.83 CC1CSC(=N1)NC2=C3C=CC=CC3=CC=C2 MCULE-9319680108 [1,1,0,0,0,0|2,0,0]=4 29 B19R3.83 SC1=NN=C(N1)CC2=C3C=CC=CC3=CC=C2 MCULE-2009828861 [1,1,0,0,0,0|1,0,1]=4 30 B19R3.5644 CC1(CCCN1)CC2=C3C=CC=CC3=CC=C2 MCULE-3068379338 [1,1,0,0,0,0|1,0,1]=4 31 B19R3.5644 CC1(CCCN1)CC2=C3C=CC=CC3=CC=C2 MCULE-8935075911 [1,1,0,0,0,0|1,0,1]=4 32 B17R2.50010 CCNC(=O)C1=C2C=CC=CC2=C(C=C1)Br MCULE-4158494010 [0,0,1,0,1,0|1,1,0]=4 33 B17R3.2679 C1=CC2=C(C=C1)C(=CC=C2)[C@@H]3CCCN3 MCULE-1543559009 [1,0,0,0,1,0|1,0,1]=4 34 B17R3.2679 C1=CC2=C(C=C1)C(=CC=C2)[C@H]3CCCN3 MCULE-7386076738 [1,0,0,0,1,0|1,0,1]=4 35 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)C3=NC=CN3 MCULE-4778994258 [1,0,0,0,1,0|0,0,2]=4 36 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)C3=NCCN3 MCULE-9853143567 [1,0,0,0,1,0|0,0,0]=2 37 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)C3=NCC[NH2+]3 MCULE-5902898793 [1,0,0,0,1,0|0,0,1]=3 38 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)C3CCCN3 MCULE-6006234638 [1,0,0,0,1,0|1,0,1]=4 39 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)C3CCCN3 MCULE-9141175340 [1,0,0,0,1,0|1,0,1]=4 40 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)[C@@H]3CCCN3 MCULE-1494780348 [1,0,0,0,1,0|1,0,1]=4 41 B17R3.2679 C1=CC2=CC=CC(=C2C=C1)[C@H]3CCCN3 MCULE-3138468905 [1,0,0,0,1,0|1,0,1]=4 42 B17R3.2679 C1=CC=C2C(=C1)C=CC=C2C3NCCS3 MCULE-1410800545 [1,0,0,0,1,0|1,0,1]=4 43 B17R3.2679 C1=CC=C2C(=C1)C=CC=C2C3NCCS3 MCULE-4964774111 [1,0,0,0,1,0|1,0,1]=4 44 B17R3.56142 [C@@H]1(CCN1)C2=C3C=CC=CC3=C(C=C2)O MCULE-3590955157 [0,0,0,0,2,0|1,0,1]=4 45 B17R3.56142 [C@@H]1(CCN1)C2=C3C=CC=CC3=C(C=C2)O MCULE-8762805184 [0,0,0,0,2,0|1,0,1]=4 46 B17R3.56142 [C@@H]1(CCN1)C2=CC=C(C3=C2C=CC=C3)C MCULE-1170933448 [0,0,0,0,2,0|1,0,1]=4 47 B17R3.56142 [C@@H]1(CCN1)C2=CC=C(C3=C2C=CC=C3)C MCULE-7080358778 [0,0,0,0,2,0|1,0,1]=4 48 B17R3.56142 [C@H]1(CCN1)C2=C3C=CC=CC3=C(C=C2)O MCULE-2243760467 [0,0,0,0,2,0|1,0,1]=4 49 B17R3.56142 [C@H]1(CCN1)C2=C3C=CC=CC3=C(C=C2)O MCULE-8780553462 [0,0,0,0,2,0|1,0,1]=4 50 B17R3.56142 [C@H]1(CCN1)C2=CC=C(C3=C2C=CC=C3)C MCULE-1626281623 [0,0,0,0,2,0|1,0,1]=4 51 B17R3.56142 [C@H]1(CCN1)C2=CC=C(C3=C2C=CC=C3)C MCULE-9758192939 [0,0,0,0,2,0|1,0,1]=4 52 B19R3.28 C1=CC2=CC=CC(=C2C=C1)CC3CCCCN3 MCULE-5038815370 [1,0,0,0,0,1|1,0,1]=4 53 B19R3.28 C1=CC2=CC=CC(=C2C=C1)CC3COCCN3 MCULE-2629325527 [1,0,0,0,0,1|1,0,1]=4 54 B19R3.28 C1=CC2=CC=CC(=C2C=C1)CC3COCCN3 MCULE-6652583018 [1,0,0,0,0,1|1,0,1]=4 55 B19R3.28 C1=CC=C2C(=C1)C=CC=C2CC3CCCCN3 MCULE-5079788258 [1,0,0,0,0,1|1,0,1]=4 56 B19R3.4444 C1=CC2=CC=CC(=C2C=C1)CSC3=NC=NN3 MCULE-5838210029 [1,0,0,0,0,1|1,0,1]=4 57 B19R3.4444 C1=CC=C2C(=C1)C=CC=C2CNC3=NN=NN3 MCULE-7194328041 [1,0,0,0,0,1|2,0,0]=4 58 B19R3.4444 C1=CC=C2C(=C1)C=CC=C2CSC3=NCCN3 MCULE-1521550147 [1,0,0,0,0,1|0,0,0]=2 59 B19R3.4444 C1=CC=C2C(=C1)C=CC=C2CSC3=NCCN3 MCULE-3963844041 [1,0,0,0,0,1|0,0,0]=2 60 B19R3.4444 C1=CC=C2C(=C1)C=CC=C2NCC3CCCN3 MCULE-8611059889 [1,0,0,0,0,1|1,0,1]=4 61 B19R3.4444 C1=CC=C2C(=C1)C=CC=C2NCC3CCCN3 MCULE-8836726430 [1,0,0,0,0,1|1,0,1]=4 62 B19R3.4444 C1=CC=C2C(=C1)C=CC=C2OCC3=NN=NN3 MCULE-3225964569 [1,0,0,0,0,1|2,0,0]=4 63 B21R3.433959 ClC1=C2C=CC=CC2=C(C=C1)OCC3CCCNC3 MCULE-4059577926 [0,0,0,0,0,2|1,0,1]=4 64 B21R3.433959 ClC1=C2C=CC=CC2=C(C=C1)OCC3CCCNC3 MCULE-9184331165 [0,0,0,0,0,2|1,0,1]=4