0 B15R2.15371 CC1=CC=CC(=C1NC2=NCCN2)C MCULE-8658291527 [0,0,0,0,0,0|2,0,0]=2 1 B15R2.15371 CC1=CC=CC(=C1NC2=NCCS2)C MCULE-3990484846 [0,0,0,0,0,0|3,0,0]=3 2 B15R2.15371 ClC1=CC=CC(=C1/N=C/2\CCCN2)Cl MCULE-2738885996 [0,0,0,0,0,0|1,0,1]=2 3 B15R2.15371 ClC1=CC=CC(=C1/N=C\2/NCCS2)Cl MCULE-9783526202 [0,0,0,0,0,0|1,0,1]=2 4 B15R2.15371 ClC1=CC=CC(=C1CC2=NNN=N2)Cl MCULE-5008276927 [0,0,0,0,0,0|3,0,1]=4 5 B15R2.15371 ClC1=CC=CC(=C1CC2OCCO2)Cl MCULE-1854386050 [0,0,0,0,0,0|3,0,1]=4 6 B15R2.15371 ClC1=CC=CC(=C1NC2=NCCN2)Cl MCULE-5017779690 [0,0,0,0,0,0|0,0,0]=0 7 B15R2.15371 ClC1=CC=CC(=C1NC2=NCCN2)Cl MCULE-6555265624 [0,0,0,0,0,0|0,0,0]=0 8 B15R2.15371 ClC1=CC=CC(=C1NC2=NCCN2)Cl MCULE-9274594116 [0,0,0,0,0,0|0,0,0]=0 9 B15R2.15371 FC1=C(C(=CC=C1)Br)NC2=NCCN2 MCULE-3049261530 [0,0,0,0,0,0|0,2,0]=2 10 B15R2.15371 FC1=C(C(=CC=C1)Br)NC2=NCCN2 MCULE-7640826371 [0,0,0,0,0,0|0,2,0]=2 11 B15R2.15371 FC1=C(C(=CC=C1)Cl)CC2CCCN2 MCULE-3733280848 [0,0,0,0,0,0|2,1,1]=4 12 B14R2.50 CC1=C(C=CC=C1)NC2=NCCS2 MCULE-8540817027 [1,0,0,0,0,0|2,0,0]=3 13 B14R2.50 ClC1=C(C=CC=C1)CC2=NCCN2 MCULE-3850240814 [1,0,0,0,0,0|1,0,0]=2 14 B14R2.50 ClC1=C(C=CC=C1)CC2CCCN2 MCULE-4724136482 [1,0,0,0,0,0|2,0,1]=4 15 B14R2.50 ClC1=C(C=CC=C1)CC2CCCN2 MCULE-5633665370 [1,0,0,0,0,0|2,0,1]=4 16 B14R2.50 ClC1=C(C=CC=C1)N=C2SCCS2 MCULE-7621614349 [1,0,0,0,0,0|2,0,1]=4 17 B14R2.50 ClC1=C(C=CC=C1)NC2=NC=CS2 MCULE-9187450739 [1,0,0,0,0,0|1,0,2]=4 18 B16R2.6175 CC1=CC(=C(C(=C1)C)CC2=NCCN2)C MCULE-3851451102 [0,1,0,0,0,0|3,0,0]=4 19 B16R2.6175 CC1=CC(=C(C(=C1)C)NC2=NCCS2)C MCULE-4664617580 [0,1,0,0,0,0|3,0,0]=4 20 B16R2.6175 ClC1=CC(=CC(=C1N=C2NCCN2)Cl)I MCULE-7771230346 [0,1,0,0,0,0|0,0,2]=3 21 B16R2.6175 ClC1=CC(=CC(=C1N=C2NCCN2)Cl)I MCULE-8997645777 [0,1,0,0,0,0|0,0,2]=3 22 B16R2.6175 NC1=CC(=C(C(=C1)Cl)NC2=NCCN2)Cl MCULE-6259215099 [0,1,0,0,0,0|0,0,0]=1 23 B16R2.6175 NC1=CC(=C(C(=C1)Cl)NC2=NCCN2)Cl MCULE-7993920296 [0,1,0,0,0,0|0,0,0]=1 24 B16R2.6175 OC1=CC(=C(C(=C1)Cl)NC2=NCCN2)Cl MCULE-5144662218 [0,1,0,0,0,0|0,0,0]=1 25 B16R2.6175 OC1=CC(=C(C(=C1)Cl)NC2=NCC[NH2+]2)Cl MCULE-5648908255 [0,1,0,0,0,0|0,0,1]=2 26 B16R2.11484 O=C1CSC(=N1)NC2=C(C=CC=C2Cl)Cl MCULE-3407290654 [0,1,0,0,0,0|1,0,1]=3 27 B14R1.19171 CCCC(=O)CC1=C(C=CC=C1Cl)Cl MCULE-1317792401 [0,0,1,0,0,0|3,0,0]=4 28 B14R1.19171 CCCC(=O)NC1=C(C=CC=C1Cl)Cl MCULE-7768445612 [0,0,1,0,0,0|2,0,0]=3 29 B14R1.19171 CCNC(=O)CC1=C(C=CC=C1Cl)F MCULE-3450498702 [0,0,1,0,0,0|2,1,0]=4 30 B14R1.19171 CCNC(=O)NC1=C(C=CC=C1C)C MCULE-8770268980 [0,0,1,0,0,0|3,0,0]=4 31 B14R1.19171 CCNC(=O)NC1=C(C=CC=C1C)N MCULE-4486916193 [0,0,1,0,0,0|3,0,0]=4 32 B14R1.19171 CCNC(=O)NC1=C(C=CC=C1F)F MCULE-2416409130 [0,0,1,0,0,0|1,2,0]=4 33 B14R1.19171 CCNC(=S)NC1=C(C=CC=C1C)C MCULE-2568196830 [0,0,1,0,0,0|3,0,0]=4 34 B14R1.19171 CCOC(=N)CC1=C(C=CC=C1Cl)Cl MCULE-1385318317 [0,0,1,0,0,0|2,0,0]=3 35 B14R1.19171 CCOC(=N)CC1=C(C=CC=C1Cl)Cl MCULE-5305228176 [0,0,1,0,0,0|2,0,0]=3 36 B14R1.19171 CCOC(=O)CC1=C(C=CC=C1Cl)Cl MCULE-8926732772 [0,0,1,0,0,0|3,0,0]=4 37 B14R1.19171 CCOC(=O)NC1=C(C=CC=C1C)Cl MCULE-5920268983 [0,0,1,0,0,0|3,0,0]=4 38 B14R1.19171 CCOC(=O)NC1=C(C=CC=C1Cl)Cl MCULE-3083617076 [0,0,1,0,0,0|2,0,0]=3 39 B14R1.19171 CNCC(=O)NC1=C(C=CC=C1Cl)Cl MCULE-1031536565 [0,0,1,0,0,0|3,0,0]=4 40 B14R1.19171 CNCC(=O)NC1=C(C=CC=C1Cl)Cl MCULE-2689672509 [0,0,1,0,0,0|3,0,0]=4 41 B14R1.19171 O=C(CCCl)NC1=C(C=CC=C1Cl)Cl MCULE-1130518077 [0,0,1,0,0,0|3,0,0]=4 42 B16R3.33335 ClC1=CC=CC(=C1C2N3N2CCC3)Cl MCULE-8367941179 [0,0,0,1,0,0|3,0,0]=4 43 B14R2.4572 CC1=CSC(=C1NC2=NCCN2)Cl MCULE-7426597927 [0,0,0,0,1,0|2,0,0]=3 44 B14R2.9066 CC1=C(C(=CC=C1)Cl)[C@@H]2CCCN2 MCULE-9478204635 [0,0,0,0,1,0|2,0,1]=4 45 B14R2.9066 CC1=C(C(=CC=C1)Cl)[C@H]2CCCN2 MCULE-3370851780 [0,0,0,0,1,0|2,0,1]=4 46 B14R2.9066 ClC1=C(C(=CC=C1)Br)C2CCCN2 MCULE-1287986058 [0,0,0,0,1,0|1,1,1]=4 47 B14R2.9066 ClC1=C(C(=CC=C1)Br)C2CCCN2 MCULE-3598119978 [0,0,0,0,1,0|1,1,1]=4 48 B14R2.9066 ClC1=CC=CC(=C1C2=NN=NN2)Cl MCULE-7303217094 [0,0,0,0,1,0|2,0,0]=3 49 B14R2.9066 ClC1=CC=CC(=C1C2CCCN2)Cl MCULE-7187475745 [0,0,0,0,1,0|1,0,1]=3 50 B14R2.9066 ClC1=CC=CC(=C1[C@@H]2CCCN2)Cl MCULE-3088205589 [0,0,0,0,1,0|1,0,1]=3 51 B14R2.9066 ClC1=CC=CC(=C1[C@@H]2CCCN2)Cl MCULE-8473295231 [0,0,0,0,1,0|1,0,1]=3 52 B14R2.9066 ClC1=CC=CC(=C1[C@H]2CCCN2)Cl MCULE-1026702182 [0,0,0,0,1,0|1,0,1]=3 53 B14R2.9066 ClC1=CC=CC(=C1[C@H]2CCCN2)Cl MCULE-1916512166 [0,0,0,0,1,0|1,0,1]=3 54 B14R2.9066 ClC1=CN=CC(=C1[C@@H]2CCCN2)Cl MCULE-4030781305 [0,0,0,0,1,0|2,0,1]=4 55 B14R2.9066 ClC1=CN=CC(=C1[C@@H]2CCCN2)Cl MCULE-7145715315 [0,0,0,0,1,0|2,0,1]=4 56 B14R2.9066 ClC1=CN=CC(=C1[C@H]2CCCN2)Cl MCULE-3892836898 [0,0,0,0,1,0|2,0,1]=4 57 B14R2.9066 ClC1=CN=CC(=C1[C@H]2CCCN2)Cl MCULE-6604325689 [0,0,0,0,1,0|2,0,1]=4 58 B14R2.9066 FC1=C(C(=CC=C1)Cl)C2CCCN2 MCULE-1782685099 [0,0,0,0,1,0|1,1,1]=4 59 B14R2.9066 FC1=C(C(=CC=C1)Cl)C2CCCN2 MCULE-4198567650 [0,0,0,0,1,0|1,1,1]=4 60 B14R2.9066 FC1=C(C(=CC=C1)Cl)[C@@H]2CCCN2 MCULE-8680258799 [0,0,0,0,1,0|1,1,1]=4 61 B14R2.9066 FC1=C(C(=CC=C1)Cl)[C@H]2CCCN2 MCULE-5694453298 [0,0,0,0,1,0|1,1,1]=4 62 B14R2.9066 FC1=C(C(=CC=C1)Cl)[C@H]2CCCN2 MCULE-6838936521 [0,0,0,0,1,0|1,1,1]=4 63 B14R2.9066 FC1=C(C(=CC=C1)Cl)[C@H]2CCCN2 MCULE-9617414648 [0,0,0,0,1,0|1,1,1]=4 64 B14R2.9066 FC1=CC=CC(=C1[C@@H]2CCCN2)Cl MCULE-4993488647 [0,0,0,0,1,0|1,1,1]=4 65 B14R2.9066 FC1=CC=CC(=C1[C@H]2CCCN2)Cl MCULE-8278538347 [0,0,0,0,1,0|1,1,1]=4 66 B14R2.9066 [C@@H]1(CCCN1)C2=C(C=CC=C2Cl)C MCULE-5308482378 [0,0,0,0,1,0|2,0,1]=4 67 B14R2.9066 [C@H]1(CCCN1)C2=C(C=CC=C2Cl)C MCULE-8440998526 [0,0,0,0,1,0|2,0,1]=4 68 B16R2.3259 CC1=CC=CC(=C1NC2=NCCCS2)C MCULE-1591523525 [0,0,0,0,0,1|3,0,0]=4 69 B16R2.3259 CC1=CC=CC(=C1NC2=NCCCS2)C MCULE-5365381772 [0,0,0,0,0,1|3,0,0]=4 70 B16R2.25778 ClC1=CC=CC(=C1CNC2=NNC=N2)Cl MCULE-2476023380 [0,0,0,0,0,1|1,0,2]=4 71 B16R2.25778 ClC1=CC=CC(=C1CNC2=NNN=N2)Cl MCULE-2026021586 [0,0,0,0,0,1|2,0,1]=4 72 B16R2.25778 ClC1=CC=CC(=C1CNC2CCCC2)Cl MCULE-2246987636 [0,0,0,0,0,1|2,0,1]=4 73 B16R2.25778 ClC1=CC=CC(=C1CNC2CCCC2)Cl MCULE-6671230173 [0,0,0,0,0,1|2,0,1]=4 74 B16R2.25778 ClC1=CC=CC(=C1CSC2=NCCS2)Cl MCULE-3349907988 [0,0,0,0,0,1|2,0,0]=3 75 B16R2.25778 ClC1=CC=CC(=C1CSC2=NN=CN2)Cl MCULE-4122969893 [0,0,0,0,0,1|2,0,1]=4 76 B16R2.25778 FC1=C(C(=CC=C1)Cl)CSC2=NCCN2 MCULE-3075608937 [0,0,0,0,0,1|1,1,0]=3 77 B16R2.25778 FC1=C(C(=CC=C1)Cl)CSC2=NCCN2 MCULE-3247064123 [0,0,0,0,0,1|1,1,0]=3 78 B16R2.25778 FC1=C(C(=CC=C1)Cl)CSC2=NCCN2 MCULE-4813710903 [0,0,0,0,0,1|1,1,0]=3 79 B16R2.25778 FC1=C(C(=CC=C1)Cl)CSC2=NCCS2 MCULE-5890719580 [0,0,0,0,0,1|2,1,0]=4 80 B13R1.4928 CCC(=O)CC1=C(C=CC=C1Cl)Cl MCULE-1254348388 [1,0,1,0,0,0|2,0,0]=4 81 B13R1.4928 CCC(=O)NC1=C(C=CC=C1Cl)Cl MCULE-6165895593 [1,0,1,0,0,0|1,0,0]=3 82 B13R1.4928 CSC(=N)NC1=C(C=CC=C1Cl)Cl MCULE-7004480913 [1,0,1,0,0,0|1,0,0]=3 83 B13R1.4928 CSC(=N)NC1=C(C=CC=C1Cl)Cl MCULE-8254245016 [1,0,1,0,0,0|1,0,0]=3 84 B13R1.4928 N/C(=N/O)/CC1=C(C=CC=C1Cl)Cl MCULE-3177938039 [1,0,1,0,0,0|2,0,0]=4 85 B13R1.4928 NCC(=O)NC1=C(C=CC=C1Cl)Cl MCULE-4923762274 [1,0,1,0,0,0|2,0,0]=4 86 B13R1.4928 NNC(=S)NC1=C(C=CC=C1Cl)Cl MCULE-4164627558 [1,0,1,0,0,0|2,0,0]=4 87 B13R1.4928 O=C(CBr)NC1=C(C=CC=C1Cl)Cl MCULE-1685961875 [1,0,1,0,0,0|2,0,0]=4 88 B13R1.4928 O=C(CCl)NC1=C(C=CC=C1Cl)Cl MCULE-3872878309 [1,0,1,0,0,0|2,0,0]=4 89 B13R1.470 CCCC(=O)NC1=CC=CC=C1Cl MCULE-5861170772 [1,0,1,0,0,0|2,0,0]=4 90 B13R1.470 CCNC(=O)NC1=CC=CC=C1S MCULE-5359744823 [1,0,1,0,0,0|2,0,0]=4 91 B13R1.470 CCNC(=S)NC1=C(C=CC=C1)Cl MCULE-2426293957 [1,0,1,0,0,0|1,0,0]=3 92 B13R1.470 CCNC(=S)NC1=C(C=CC=C1)F MCULE-8867316191 [1,0,1,0,0,0|1,1,0]=4 93 B13R1.470 CCNC(=S)NC1=C(C=CC=C1)N MCULE-2899549204 [1,0,1,0,0,0|2,0,0]=4 94 B13R1.470 CCNC(=S)NC1=CC=CC=C1Br MCULE-9759155954 [1,0,1,0,0,0|1,1,0]=4 95 B13R1.470 CCNC(=S)NC1=CC=CC=C1C MCULE-7066210812 [1,0,1,0,0,0|2,0,0]=4 96 B13R1.470 CCOC(=N)CC1=C(C=CC=C1)Cl MCULE-8432075846 [1,0,1,0,0,0|2,0,0]=4 97 B13R1.470 CCOC(=N)CC1=CC=CC=C1Cl MCULE-5389626807 [1,0,1,0,0,0|2,0,0]=4 98 B13R1.470 CCOC(=O)NC1=CC=CC=C1Cl MCULE-6804122956 [1,0,1,0,0,0|2,0,0]=4 99 B13R1.8919 CCCNCC1=C(C=CC=C1Cl)Cl MCULE-3588092005 [1,0,1,0,0,0|1,0,1]=4 100 B13R1.8919 CCCNCC1=C(C=CC=C1Cl)Cl MCULE-4587286827 [1,0,1,0,0,0|1,0,1]=4 101 B13R1.8919 NCCCOC1=C(C=CC=C1Cl)Cl MCULE-3724823066 [1,0,1,0,0,0|1,0,1]=4 102 B13R1.8919 NCCCOC1=C(C=CC=C1Cl)Cl MCULE-6919520958 [1,0,1,0,0,0|1,0,1]=4 103 B13R1.8919 NCCSCC1=C(C=CC=C1Cl)Cl MCULE-2168533582 [1,0,1,0,0,0|1,0,1]=4 104 B13R1.8919 NCCSCC1=C(C=CC=C1Cl)Cl MCULE-6454200081 [1,0,1,0,0,0|1,0,1]=4 105 B13R1.8919 OCCNCC1=C(C=CC=C1Cl)Cl MCULE-4601479512 [1,0,1,0,0,0|1,0,1]=4 106 B13R2.64 C1=CC=C(C=C1)CC2=NCCN2 MCULE-5694308124 [2,0,0,0,0,0|1,0,0]=3 107 B13R2.64 C1=CC=C(C=C1)CC2=NCCN2 MCULE-8393678793 [2,0,0,0,0,0|1,0,0]=3 108 B13R2.64 C1=CC=C(C=C1)N=C2NCCN2 MCULE-9797207863 [2,0,0,0,0,0|0,0,2]=4 109 B13R2.64 C1=CC=C(C=C1)NC2=NC=NN2 MCULE-5005365444 [2,0,0,0,0,0|1,0,1]=4 110 B13R2.64 C1=CC=C(C=C1)NC2=NCCC2 MCULE-2683231905 [2,0,0,0,0,0|1,0,0]=3 111 B13R2.64 C1=CC=C(C=C1)NC2=NCCS2 MCULE-2196574986 [2,0,0,0,0,0|1,0,0]=3 112 B13R2.64 C1=CC=C(C=C1)NC2=NCCS2 MCULE-3861281239 [2,0,0,0,0,0|1,0,0]=3 113 B13R2.64 C1=CN=C(C=N1)NC2=NCCN2 MCULE-1693334469 [2,0,0,0,0,0|2,0,0]=4 114 B15R1.8287 CC(C)CC(=O)NC1=C(C=CC=C1Cl)Cl MCULE-9383445180 [0,1,1,0,0,0|2,0,0]=4 115 B15R1.8287 CC(C)OC(=O)NC1=C(C=CC=C1Cl)Cl MCULE-6837340101 [0,1,1,0,0,0|2,0,0]=4 116 B15R1.8287 N=C(N)NC(=N)NC1=C(C=CC=C1Cl)Cl MCULE-1651643983 [0,1,1,0,0,0|1,0,1]=4 117 B15R1.8287 N=C(N)NC(=N)NC1=C(C=CC=C1Cl)Cl MCULE-9300391583 [0,1,1,0,0,0|1,0,1]=4 118 B15R1.37637 CCCC(=O)NC1=C(C=C(C=C1Cl)Cl)Cl MCULE-3645276568 [0,1,1,0,0,0|2,0,0]=4 119 B15R1.45718 CCCCC(=O)NC1=C(C=CC=C1Cl)Cl MCULE-9879815232 [0,1,1,0,0,0|2,0,0]=4 120 B15R1.45718 CCNCC(=O)NC1=C(C=CC=C1Cl)Cl MCULE-9121314279 [0,1,1,0,0,0|1,0,0]=3 121 B15R2.123 COC1=C(C=CC=C1)NC2=NCCS2 MCULE-2389957159 [1,1,0,0,0,0|2,0,0]=4 122 B15R2.305 CC1=CC=CC=C1NC2=NCC(S2)C MCULE-5317462462 [1,1,0,0,0,0|2,0,0]=4 123 B15R2.305 CC1CN=C(S1)NC2=CC=CC=C2F MCULE-6154991103 [1,1,0,0,0,0|1,1,0]=4 124 B15R2.305 CC1CN=C(S1)NC2=CC=CC=C2N MCULE-5625485910 [1,1,0,0,0,0|2,0,0]=4 125 B15R2.1109 CC1=C(C=CC=C1Cl)NC2=NCCS2 MCULE-5296629079 [1,1,0,0,0,0|2,0,0]=4 126 B15R2.1109 ClC1=C(C(=CC=C1)NC2=NCCS2)Cl MCULE-6058429443 [1,1,0,0,0,0|1,0,0]=3 127 B15R2.1154 CC1=CC(=C(C=C1)NC2=NCCN2)Cl MCULE-6459811464 [1,1,0,0,0,0|0,0,0]=2 128 B15R2.1154 CC1=CC(=CC=C1NC2=NCCS2)F MCULE-4533698966 [1,1,0,0,0,0|2,0,0]=4 129 B15R2.1154 ClC1=CC(=C(C=C1)NC2=NC=NN2)Cl MCULE-7532657739 [1,1,0,0,0,0|1,0,1]=4 130 B15R2.1154 ClC1=CC(=C(C=C1)NC2=NCCS2)Cl MCULE-6686516710 [1,1,0,0,0,0|1,0,0]=3 131 B15R2.1154 ClC1=CC(=CC=C1NC2=NCCS2)Br MCULE-9132859233 [1,1,0,0,0,0|1,0,0]=3 132 B15R2.7567 CC1=C(C=C(C=C1)F)NC2=NCCN2 MCULE-9903645250 [1,1,0,0,0,0|1,0,0]=3 133 B15R2.7567 CC1=CC=C(C(=C1)NC2=NCCS2)C MCULE-3040953042 [1,1,0,0,0,0|2,0,0]=4 134 B15R2.15647 ClC1=CC=C(C(=C1Cl)[C@@H]2CCCN2)Cl MCULE-3890760079 [0,1,0,0,1,0|1,0,1]=4 135 B15R2.15647 ClC1=CC=C(C(=C1Cl)[C@@H]2CCCN2)Cl MCULE-7845424277 [0,1,0,0,1,0|1,0,1]=4 136 B15R2.15647 ClC1=CC=C(C(=C1Cl)[C@H]2CCCN2)Cl MCULE-1125256017 [0,1,0,0,1,0|1,0,1]=4 137 B15R2.15647 ClC1=CC=C(C(=C1Cl)[C@H]2CCCN2)Cl MCULE-8625548054 [0,1,0,0,1,0|1,0,1]=4 138 B17R2.41794 CC(OC1=C(C=CC=C1Cl)Cl)C2=NCCN2 MCULE-3837655056 [0,1,0,0,0,1|1,0,0]=3 139 B17R2.41794 CC(OC1=C(C=CC=C1Cl)Cl)C2=NCCN2 MCULE-4225376473 [0,1,0,0,0,1|1,0,0]=3 140 B17R2.41794 CC1=CC=CC(=C1NC(=O)C2=NCCN2)C MCULE-4501690400 [0,1,0,0,0,1|2,0,0]=4 141 B17R2.41794 C[C@H](OC1=C(C=CC=C1Cl)Cl)C2=NCCN2 MCULE-1426746395 [0,1,0,0,0,1|1,0,0]=3 142 B17R2.41794 O=C(NC1=C(C=CC=C1Cl)Cl)C2CCCN2 MCULE-5308452165 [0,1,0,0,0,1|1,0,1]=4 143 B17R2.41886 O=C(N=C1NCCN1)C2=C(C=CC=C2Cl)Cl MCULE-8805723799 [0,1,0,0,0,1|0,0,2]=4 144 B17R2.64751 O=NN1CCN=C1NC2=C(C=CC=C2Cl)Cl MCULE-9534191773 [0,2,0,0,0,0|0,0,0]=2 145 B17R2.71190 CCC1=CC=CC(=C1NC2=NCCN2)CC MCULE-3111354800 [0,2,0,0,0,0|2,0,0]=4 146 B15R2.65094 O=C(NC1=C(C=CC=C1Cl)Cl)C2CC2 MCULE-2690656658 [0,0,1,1,0,0|2,0,0]=4 147 B17R3.4464 ClC1=CC=CC2=C1CN(C2)C3=NCCN3 MCULE-3960033590 [0,0,0,1,0,1|1,0,0]=3 148 B17R3.4464 ClC1=CC=CC2=C1CN(C2)C3=NCCN3 MCULE-7538141859 [0,0,0,1,0,1|1,0,0]=3 149 B13R1.4453 CCCC(=O)C1=C(C=CC=C1Cl)Cl MCULE-3958755210 [0,0,1,0,1,0|2,0,0]=4 150 B13R1.4453 CCC[C@@H](N)C1=C(C=CC=C1Cl)Cl MCULE-2800639866 [0,0,1,0,1,0|1,0,1]=4 151 B13R1.4453 CCC[C@@H](N)C1=C(C=CC=C1Cl)Cl MCULE-9267620083 [0,0,1,0,1,0|1,0,1]=4 152 B13R1.4453 CCC[C@H](N)C1=C(C=CC=C1Cl)Cl MCULE-5856573440 [0,0,1,0,1,0|1,0,1]=4 153 B13R1.4453 CCC[C@H](N)C1=C(C=CC=C1Cl)Cl MCULE-6657106197 [0,0,1,0,1,0|1,0,1]=4 154 B13R1.4453 CCNC(=O)C1=C(C=CC=C1Cl)I MCULE-6049866401 [0,0,1,0,1,0|1,1,0]=4 155 B13R1.4453 CCOC(=O)C1=C(C=CC=C1Cl)Cl MCULE-6687299616 [0,0,1,0,1,0|2,0,0]=4 156 B13R2.18 ClC1=C(C=CC=C1)C2=NC=CN2 MCULE-1835797277 [1,0,0,0,1,0|0,0,2]=4 157 B13R2.18 ClC1=C(C=CC=C1)C2=NC=NN2 MCULE-6790188009 [1,0,0,0,1,0|1,0,1]=4 158 B13R2.18 ClC1=C(C=CC=C1)C2CCCN2 MCULE-3724263411 [1,0,0,0,1,0|1,0,1]=4 159 B13R2.18 ClC1=C(C=CC=C1)C2CCCN2 MCULE-6584975327 [1,0,0,0,1,0|1,0,1]=4 160 B13R2.18 ClC1=C(C=CC=C1)C2NCCS2 MCULE-4650449561 [1,0,0,0,1,0|1,0,1]=4 161 B13R2.18 ClC1=C(C=CC=C1)[C@@H]2CCCN2 MCULE-2979993370 [1,0,0,0,1,0|1,0,1]=4 162 B13R2.18 ClC1=C(C=CC=C1)[C@@H]2CCCN2 MCULE-6723968682 [1,0,0,0,1,0|1,0,1]=4 163 B13R2.18 ClC1=C(C=CC=C1)[C@H]2CCCN2 MCULE-3589668454 [1,0,0,0,1,0|1,0,1]=4 164 B13R2.18 ClC1=C(C=CC=C1)[C@H]2CCCN2 MCULE-3662820025 [1,0,0,0,1,0|1,0,1]=4 165 B13R2.18 ClC1=CC=CC=C1C2=NCCC2 MCULE-3031729590 [1,0,0,0,1,0|1,0,0]=3 166 B13R2.18 ClC1=CC=CC=C1C2=NCCN2 MCULE-2498957323 [1,0,0,0,1,0|0,0,0]=2 167 B13R2.18 ClC1=CC=CC=C1C2=NN=NN2 MCULE-4562921829 [1,0,0,0,1,0|2,0,0]=4 168 B13R2.18 ClC1=CC=CC=C1C2CCCN2 MCULE-2272753492 [1,0,0,0,1,0|1,0,1]=4 169 B13R2.18 ClC1=CC=CC=C1C2CCCN2 MCULE-6920081444 [1,0,0,0,1,0|1,0,1]=4 170 B13R2.18 ClC1=CC=CC=C1[C@@H]2CCCN2 MCULE-2597349134 [1,0,0,0,1,0|1,0,1]=4 171 B13R2.18 ClC1=CC=CC=C1[C@@H]2CCCN2 MCULE-4660036755 [1,0,0,0,1,0|1,0,1]=4 172 B13R2.18 ClC1=CC=CC=C1[C@H]2CCCN2 MCULE-5250799839 [1,0,0,0,1,0|1,0,1]=4 173 B13R2.18 ClC1=CC=CC=C1[C@H]2CCCN2 MCULE-6878375839 [1,0,0,0,1,0|1,0,1]=4 174 B13R2.18 NC1=C(C=CC=C1)C2=NCCO2 MCULE-9944374168 [1,0,0,0,1,0|2,0,0]=4 175 B13R2.18 NC1=CC=CC=C1C2=NCCC2 MCULE-9506917466 [1,0,0,0,1,0|2,0,0]=4 176 B13R2.18 NC1=CC=CC=C1C2=NCCN2 MCULE-6323057414 [1,0,0,0,1,0|1,0,0]=3 177 B13R2.18 OC1=C(C=CC=C1)C2=NCCN2 MCULE-4287982613 [1,0,0,0,1,0|1,0,0]=3 178 B13R2.18 OC1=C(C=CC=C1)C2=NCCO2 MCULE-6985220561 [1,0,0,0,1,0|2,0,0]=4 179 B13R2.18 SC1=CC=CC=C1C2=NCCN2 MCULE-3135658309 [1,0,0,0,1,0|1,0,0]=3 180 B13R2.18 [NH2+]1CCN=C1C2=C(C=CC=C2)O MCULE-2889400573 [1,0,0,0,1,0|1,0,1]=4 181 B13R2.402 NC1=CC=CC(=C1NC2CC2)Cl MCULE-8847072949 [0,0,0,0,2,0|1,0,1]=4 182 B13R2.3490 ClC1=CC=CC(=C1[C@@H]2CCN2)Cl MCULE-2191067046 [0,0,0,0,2,0|0,0,1]=3 183 B13R2.3490 ClC1=CC=CC(=C1[C@@H]2CCN2)Cl MCULE-9019210377 [0,0,0,0,2,0|0,0,1]=3 184 B13R2.3490 ClC1=CC=CC(=C1[C@H]2CCN2)Cl MCULE-2968958460 [0,0,0,0,2,0|0,0,1]=3 185 B13R2.3490 ClC1=CC=CC(=C1[C@H]2CCN2)Cl MCULE-8229127824 [0,0,0,0,2,0|0,0,1]=3 186 B13R2.3490 ClC1=CN=CC(=C1[C@@H]2CCN2)Cl MCULE-2738785187 [0,0,0,0,2,0|1,0,1]=4 187 B13R2.3490 ClC1=CN=CC(=C1[C@@H]2CCN2)Cl MCULE-4325719952 [0,0,0,0,2,0|1,0,1]=4 188 B13R2.3490 ClC1=CN=CC(=C1[C@H]2CCN2)Cl MCULE-1431483145 [0,0,0,0,2,0|1,0,1]=4 189 B13R2.3490 ClC1=CN=CC(=C1[C@H]2CCN2)Cl MCULE-3456441293 [0,0,0,0,2,0|1,0,1]=4 190 B13R2.3490 FC1=C(C(=CC=C1)Cl)[C@@H]2CCN2 MCULE-4519627985 [0,0,0,0,2,0|0,1,1]=4 191 B13R2.3490 FC1=C(C(=CC=C1)Cl)[C@@H]2CCN2 MCULE-7210711177 [0,0,0,0,2,0|0,1,1]=4 192 B13R2.3490 FC1=C(C(=CC=C1)Cl)[C@H]2CCN2 MCULE-3070042215 [0,0,0,0,2,0|0,1,1]=4 193 B13R2.3490 FC1=C(C(=CC=C1)Cl)[C@H]2CCN2 MCULE-4216760019 [0,0,0,0,2,0|0,1,1]=4 194 B13R2.3490 [C@@H]1(CCN1)C2=C(C=CC=C2Cl)C MCULE-5158280927 [0,0,0,0,2,0|1,0,1]=4 195 B13R2.3490 [C@@H]1(CCN1)C2=C(C=CC=C2Cl)C MCULE-9588389172 [0,0,0,0,2,0|1,0,1]=4 196 B13R2.3490 [C@H]1(CCN1)C2=C(C=CC=C2Cl)C MCULE-1622111946 [0,0,0,0,2,0|1,0,1]=4 197 B13R2.3490 [C@H]1(CCN1)C2=C(C=CC=C2Cl)C MCULE-7915666328 [0,0,0,0,2,0|1,0,1]=4 198 B15R2.38 CC1=C(C=CC=C1)NC2=NCCCS2 MCULE-2197863694 [1,0,0,0,0,1|2,0,0]=4 199 B15R2.38 ClC1=C(C=CC=C1)NC2=NCCCS2 MCULE-6718923178 [1,0,0,0,0,1|1,0,0]=3 200 B15R2.562 CC1=C(C=CC=C1)CNC2=NCCN2 MCULE-8927749570 [1,0,0,0,0,1|1,0,0]=3 201 B15R2.562 CC1=CC=CC=C1CSC2=NCCN2 MCULE-5766686216 [1,0,0,0,0,1|2,0,0]=4 202 B15R2.562 CC1=CC=CC=C1CSC2=NCCN2 MCULE-8775671014 [1,0,0,0,0,1|2,0,0]=4 203 B15R2.562 ClC1=C(C=CC=C1)NCC2CCCN2 MCULE-1924036913 [1,0,0,0,0,1|1,0,1]=4 204 B15R2.562 ClC1=C(C=CC=C1)NCC2CCCN2 MCULE-5919788376 [1,0,0,0,0,1|1,0,1]=4 205 B15R2.562 ClC1=CC=CC=C1CNC2=NN=NN2 MCULE-5861403696 [1,0,0,0,0,1|2,0,0]=4 206 B15R2.562 ClC1=CC=CC=C1CSC2=NCCN2 MCULE-3747440636 [1,0,0,0,0,1|1,0,0]=3 207 B15R2.562 ClC1=CC=CC=C1CSC2=NCCN2 MCULE-9369927761 [1,0,0,0,0,1|1,0,0]=3 208 B15R2.562 FC1=CC=CC=C1CSC2=NCCN2 MCULE-2487862158 [1,0,0,0,0,1|1,1,0]=4 209 B15R2.562 FC1=CC=CC=C1CSC2=NCCN2 MCULE-9353594850 [1,0,0,0,0,1|1,1,0]=4 210 B17R2.3933 ClC1=CC=CC(=C1CNC2CCCNC2)Cl MCULE-1113592865 [0,0,0,0,0,2|1,0,1]=4 211 B17R2.3933 ClC1=CC=CC(=C1CNC2CCCNC2)Cl MCULE-8423432829 [0,0,0,0,0,2|1,0,1]=4 212 B17R2.3933 FC1=C(C(=CC=C1)Cl)CSC2=NCCCN2 MCULE-5397730365 [0,0,0,0,0,2|1,1,0]=4 213 B17R2.3933 FC1=C(C(=CC=C1)Cl)CSC2=NCCCN2 MCULE-8078724315 [0,0,0,0,0,2|1,1,0]=4 214 B17R2.41802 ClC1=CC=CC(=C1CNCC2CCCN2)Cl MCULE-5399804219 [0,0,0,0,0,2|1,0,1]=4 215 B17R2.41802 ClC1=CC=CC(=C1CNCC2CCCN2)Cl MCULE-7312990317 [0,0,0,0,0,2|1,0,1]=4