0 B28R3.1028095 COC1=C(C=C(C(=C1)N)Cl)C(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-7309406542 [0,0,0,0,0,0|0,0,0]=0 1 B28R3.1028095 COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3=CC=CC=C3)Cl)N MCULE-4312246940 [0,0,0,0,0,0|0,0,0]=0 2 B28R3.1028095 COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3=CC=CC=C3)Cl)N MCULE-7238478101 [0,0,0,0,0,0|0,0,0]=0 3 B28R3.1028095 COC1=CC(=C(C=C1C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3)Cl)N MCULE-2692729586 [0,0,0,0,0,0|0,0,1]=1 4 B28R3.1028095 COC1=CC(=C(C=C1C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3)Cl)N MCULE-3109607566 [0,0,0,0,0,0|0,0,1]=1 5 B27R3.2195902 COC1=CC=C(C=C1C(=O)NC2CCN(CC2)CC3=CC=CC=C3)Cl MCULE-4700599391 [1,0,0,0,0,0|0,0,0]=1 6 B27R3.2251813 COC1=C(C=CC(=C1)Cl)C(=O)NC2CCN(CC2)CC3=CN=CC=C3 MCULE-6120255691 [1,0,0,0,0,0|2,0,0]=3 7 B27R3.4587368 NC1=C(C=C(C(=C1)O)C(=O)NC2CCN(CC2)CC3=CC=CC=C3)Cl MCULE-2784394548 [1,0,0,0,0,0|0,0,0]=1 8 B27R3.4587368 O=C(NC1CCN(CC1)CC2=CC=CC=C2)C3=CC(=C(C=C3Cl)F)F MCULE-8371400302 [1,0,0,0,0,0|2,1,0]=4 9 B29R3.167339529 COC1=C(C=C(C(=C1)N)Cl)C(=O)NC2CCN(CC2)CC3=CC=C(C=C3)F MCULE-8642923864 [0,1,0,0,0,0|0,0,0]=1 10 B26R3.15943 COC1=C(C=CC=C1)C(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-1572348573 [2,0,0,0,0,0|0,0,0]=2 11 B26R3.4210757 CC1=CC=C(C=C1C(=O)NC2CCN(CC2)CC3=CC=CN=C3)Cl MCULE-1357623138 [2,0,0,0,0,0|1,0,0]=3 12 B26R3.4210757 O=C(NC1CCN(CC1)CC2=CC=CC=C2)C3=CC(=CC=C3Cl)Cl MCULE-1747125633 [2,0,0,0,0,0|1,0,0]=3 13 B26R3.78147 O=C(NC1CCN(CC1)CC2=CC=CC=C2)C3=C(C=C(C=C3)Cl)Cl MCULE-7422285654 [2,0,0,0,0,0|2,0,0]=4 14 B26R3.1094 CC1=CC=C(C=C1C)C(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-8911186871 [2,0,0,0,0,0|2,0,0]=4 15 B26R3.1094 O=C(NC1CCN(CC1)CC2=CC=CC=C2)C3=CC=C(C(=C3)Cl)Cl MCULE-8302515848 [2,0,0,0,0,0|1,0,0]=3 16 B28R3.1039723 COC1=CC(=C(C=C1NC(=O)C2CCN(CC2)CC3=CC=CC=C3)Cl)N MCULE-3942984855 [1,1,0,0,0,0|2,0,0]=4 17 B28R3.1049069 COC1=CC=C(C(=C1C(=O)NC2CCN(CC2)CC3=CC=NC=C3)F)F MCULE-2790469086 [1,1,0,0,0,0|1,1,0]=4 18 B28R3.1052717 CNC1=CC(=C(C=C1)OC)C(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-6328496349 [1,1,0,0,0,0|1,0,0]=3 19 B28R3.2275508 COC1=CC=C(C=C1C(=O)N[C@@H]2CCN(C[C@H]2O)CC3=CC=CC=N3)Cl MCULE-9781033535 [1,1,0,0,0,0|1,0,0]=3 20 B28R3.1024914 CNC1=CC(=C(C=C1Cl)C(=O)N[C@H]2CCN(C2)CC3=CC=CC=C3)OC MCULE-9651862776 [0,1,0,0,1,0|0,0,0]=2 21 B30R3.14345689 COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3=CC=CC=C3)OC)OC MCULE-5765748687 [0,2,0,0,0,0|2,0,0]=4 22 B26R3.2135040 COC1=C(C=C(C=C1)Cl)C(=O)N2CCC(CC2)CC3=CC=CC=C3 MCULE-6373767037 [1,0,0,0,1,0|2,0,0]=4 23 B26R3.2135040 COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)CC3=CC=CC=C3 MCULE-6181238202 [1,0,0,0,1,0|1,0,0]=3 24 B28R3.2270459 COC1=C(C=C(C=C1)C)NC(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-2035080479 [1,0,0,0,0,1|1,0,0]=3 25 B28R3.2270459 COC1=C(C=C(C=C1)Cl)NC(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-3728946538 [1,0,0,0,0,1|0,0,0]=2 26 B28R3.2270459 COC1=C(C=C(C=C1)Cl)NC(=S)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-7872114420 [1,0,0,0,0,1|0,1,0]=3 27 B28R3.2270459 COC1=CC=C(C=C1NC(=O)CN2CCN(CC2)CC3=CC=CC=C3)Cl MCULE-6450376347 [1,0,0,0,0,1|2,0,0]=4 28 B25R3.1573 COC1=CC=CC=C1CNC2CCN(CC2)CC3=CC=CC=C3 MCULE-2012124088 [3,0,0,0,0,0|0,0,1]=4 29 B25R3.26010 CC1=C(C=CC=C1)C(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-7403158666 [3,0,0,0,0,0|0,0,0]=3 30 B25R3.26010 NC1=C(C=CC=C1)C(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-4943518937 [3,0,0,0,0,0|1,0,0]=4 31 B25R3.26010 O=C(NC1CCN(CC1)CC2=CC=CC=C2)C3=C(C=CC=C3)Br MCULE-6152807167 [3,0,0,0,0,0|1,0,0]=4 32 B25R3.26010 O=C(NC1CCN(CC1)CC2=CC=CC=C2)C3=C(C=CC=C3)Cl MCULE-4586615726 [3,0,0,0,0,0|1,0,0]=4 33 B25R3.26010 O=C(NC1CCN(CC1)CC2=CC=CC=C2)C3=CC=CC=C3F MCULE-7366554523 [3,0,0,0,0,0|1,0,0]=4 34 B25R3.67879 CC1=CC(=CC=C1)C(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-2107823822 [3,0,0,0,0,0|1,0,0]=4 35 B25R3.67879 O=C(NC1CCN(CC1)CC2=CC=CC=C2)C3=CC=CC(=C3)Br MCULE-3364257396 [3,0,0,0,0,0|0,1,0]=4 36 B25R3.67879 O=C(NC1CCN(CC1)CC2=CC=CC=C2)C3=CC=CC(=C3)Cl MCULE-9819813297 [3,0,0,0,0,0|0,0,0]=3 37 B25R3.67879 O=C(NC1CCN(CC1)CC2=CC=CC=C2)C3=CC=CC(=C3)F MCULE-8190416134 [3,0,0,0,0,0|0,1,0]=4 38 B25R3.985 CC1=CC=C(C=C1)C(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-8962544675 [3,0,0,0,0,0|1,0,0]=4 39 B25R3.985 O=C(NC1CCN(CC1)CC2=CC=CC=C2)C3=CC=C(C=C3)Br MCULE-3111870610 [3,0,0,0,0,0|1,0,0]=4 40 B25R3.985 O=C(NC1CCN(CC1)CC2=CC=CC=C2)C3=CC=C(C=C3)Cl MCULE-6067499297 [3,0,0,0,0,0|1,0,0]=4 41 B25R3.985 O=C(NC1CCN(CC1)CC2=CC=CC=C2)C3=CC=C(C=C3)F MCULE-3904225512 [3,0,0,0,0,0|1,0,0]=4 42 B25R3.985 O=C(NC1CCN(CC1)CC2=CC=CC=C2)C3=CC=C(C=C3)I MCULE-9192126656 [3,0,0,0,0,0|1,0,0]=4 43 B27R3.118449 CCOC1=CC=CC=C1C(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-7182820341 [2,1,0,0,0,0|0,0,0]=3 44 B27R3.4595462 O=C(N[C@@H]1CCN(C[C@H]1O)CC2=CN=CC=C2)C3=CC(=CC=C3O)Cl MCULE-1952802793 [2,1,0,0,0,0|1,0,0]=4 45 B29R3.391242 COC1=CC(=C(C=C1)OC)NC(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-3366214492 [1,1,0,0,0,1|1,0,0]=4 46 B29R3.168706186 COC1=CC=C(C(=C1C(=O)NC2CCN(CC2)CCC3=CC=CC=C3)F)F MCULE-6251706174 [1,1,0,0,0,1|0,1,0]=4 47 B29R3.16555184 COC1=CC=C(C=C1S(=O)(=O)NCC2CCN(CC2)CC3=CC=CC=C3)Cl MCULE-3089522191 [1,1,0,0,0,1|1,0,0]=4 48 B29R3.14850 COC1=CC(=C(C=C1)NC(=O)NC2CCN(CC2)CC3=CC=CC=C3)OC MCULE-7423050556 [1,1,0,0,0,1|1,0,0]=4 49 B29R3.2329579 COC1=C(C=C(C=C1)N(=O)=O)C(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-8630678094 [1,2,0,0,0,0|1,0,0]=4 50 B29R3.1059074703 CNC1=C(C=C(C(=C1)OC)C(=O)N[C@@H]2CCN([C@@H]2C)CC3=CC=CC=C3)Cl MCULE-4151192212 [0,2,0,0,1,0|0,0,0]=3 51 B27R3.94315276 COC1=CC=C(C=C1C(=O)N2CCCN(CC2)CC3=CC=NC=C3)Cl MCULE-3709613143 [1,0,1,1,0,0|1,0,0]=4 52 B27R4.3095964 O=C1C2=CC=CC=C2CCN1C3CCN(CC3)CC4=CC=CC=C4 MCULE-8598871780 [2,0,0,1,0,0|1,0,0]=4 53 B25R3.1556 COC1=C(C=CC=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3 MCULE-5061838273 [2,0,0,0,1,0|1,0,0]=4 54 B25R3.143913 COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)C3=CC=CC=C3 MCULE-4264444751 [1,0,0,0,2,0|1,0,0]=4 55 B27R3.16493 CCC1=CC=CC=C1NC(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-5584107447 [2,0,0,0,0,1|1,0,0]=4 56 B27R3.16493 COC1=C(C=CC=C1)CC(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-9357906541 [2,0,0,0,0,1|0,0,0]=3 57 B27R3.16493 COC1=CC=CC=C1NC(=O)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-6036565838 [2,0,0,0,0,1|0,0,0]=3 58 B27R3.16678 COC1=C(C=CC=C1)C(=O)NN=C2CCN(CC2)CC3=CC=CC=C3 MCULE-4810591525 [2,0,0,0,0,1|0,0,1]=4 59 B27R3.2182086 COC1=CC=C(C=C1C(=O)N2CCN(CC2)CCC3=CC=CC=C3)Cl MCULE-2036466234 [1,0,0,0,1,1|1,0,0]=4 60 B27R3.9281218 COC1=C(C=C(C=C1)Cl)C(=O)NCC2CCN(CC2)CC3=CC=CO3 MCULE-6729569534 [1,0,0,0,1,1|1,0,0]=4 61 B27R3.9281218 COC1=C(C=C(C=C1)Cl)C(=O)NCC2CCN(CC2)CC3=CC=CS3 MCULE-5748365319 [1,0,0,0,1,1|1,0,0]=4 62 B27R3.9281218 COC1=C(C=C(C=C1)Cl)C(=O)NCC2CCN(CC2)CC3=CSC=C3 MCULE-8919666538 [1,0,0,0,1,1|1,0,0]=4