0 B20R2.10963774 CC(C)CNC(=O)COC1=C2C=CC=CC2=CC=C1 MCULE-1815303782 [0,0,0,0,0,0|2,0,2]=4 1 B20R2.10963774 CC(C)NCC(O)COC1=C2C=CC=CC2=CC=C1 MCULE-6124856976 [0,0,0,0,0,0|0,0,0]=0 2 B20R2.10963774 CC(C)NCC(O)COC1=C2C=CC=CC2=CC=C1 MCULE-7804628650 [0,0,0,0,0,0|0,0,0]=0 3 B20R2.10963774 CC(C)NC[C@@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-5440407779 [0,0,0,0,0,0|0,0,0]=0 4 B20R2.10963774 CC(C)NC[C@@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-5800988302 [0,0,0,0,0,0|0,0,0]=0 5 B20R2.10963774 CC(C)NC[C@@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-7361292589 [0,0,0,0,0,0|0,0,0]=0 6 B20R2.10963774 CC(C)NC[C@@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-8071653566 [0,0,0,0,0,0|0,0,0]=0 7 B20R2.10963774 CC(C)NC[C@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-6308528682 [0,0,0,0,0,0|0,0,0]=0 8 B20R2.10963774 CC(C)NC[C@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-7821120370 [0,0,0,0,0,0|0,0,0]=0 9 B20R2.10963774 CC(C)NC[C@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-7995233869 [0,0,0,0,0,0|0,0,0]=0 10 B20R2.10963774 CC(C)NC[C@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-8175273982 [0,0,0,0,0,0|0,0,0]=0 11 B19R2.1021309 CC(C)SCCCOC1=CC=CC2=C1C=CC=C2 MCULE-5224053626 [1,0,0,0,0,0|1,0,0]=2 12 B19R2.1682031 CCCCC(O)C#CC1=CC=CC2=CC=CC=C12 MCULE-1059289730 [1,0,0,0,0,0|2,0,1]=4 13 B21R2.210872 CC(C)NCC(O)COC1=CC(=O)OC2=C1C=CC=C2 MCULE-5145229526 [0,1,0,0,0,0|1,0,0]=2 14 B21R2.210872 CC(C)NCC(O)COC1=CC(=O)OC2=C1C=CC=C2 MCULE-6605798837 [0,1,0,0,0,0|1,0,0]=2 15 B21R2.3237171 CC(C)NCC(O)COC1=CC=CC2=C1C=C(C=C2)O MCULE-4252356908 [0,1,0,0,0,0|0,0,0]=1 16 B21R2.3237171 CC(C)NCC(O)COC1=CC=CC2=C1C=C(C=C2)O MCULE-4514002295 [0,1,0,0,0,0|0,0,0]=1 17 B21R2.4389558 CC(C)NCC(O)COC1=C2C=CC=C(C2=CC=C1)O MCULE-1912559760 [0,1,0,0,0,0|0,0,0]=1 18 B21R2.4494802 CC(C)NCC(O)COC1=CC=C(C2=CC=CC=C12)O MCULE-2781803891 [0,1,0,0,0,0|0,0,0]=1 19 B21R2.4494802 CC(C)NCC(O)COC1=CC=C(C2=CC=CC=C12)O MCULE-5812736652 [0,1,0,0,0,0|0,0,0]=1 20 B19R1.10443 C=CCOC1=C(C=CC=C1)OCC(O)CNC(C)C MCULE-3209868387 [0,0,1,0,0,0|1,0,1]=3 21 B19R1.10443 C=CCOC1=C(C=CC=C1)OCC(O)CNC(C)C MCULE-5603406124 [0,0,1,0,0,0|1,0,1]=3 22 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1C=CC2 MCULE-8593428257 [0,0,0,0,1,0|0,0,1]=2 23 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1C=CN2 MCULE-7764948919 [0,0,0,0,1,0|1,0,0]=2 24 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1CC=C2 MCULE-6272363139 [0,0,0,0,1,0|0,0,1]=2 25 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1CC=C2 MCULE-9577057256 [0,0,0,0,1,0|0,0,1]=2 26 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1OC=C2 MCULE-9932341166 [0,0,0,0,1,0|1,0,0]=2 27 B19R2.1022145 CC(C)NC[C@H](O)COC1=CC=CC2=C1C=CN2 MCULE-3120467697 [0,0,0,0,1,0|1,0,0]=2 28 B19R2.1022145 CC(C)NC[C@H](O)COC1=CC=CC2=C1C=CN2 MCULE-7768479155 [0,0,0,0,1,0|1,0,0]=2 29 B19R2.6063385 CC(C)NC(=O)CCC1=CC=CC2=CC=CC=C12 MCULE-7398318578 [0,0,0,0,1,0|1,0,2]=4 30 B19R2.6063385 CC(C)NC(=O)COC1=C2C=CC=CC2=CC=C1 MCULE-9558209194 [0,0,0,0,1,0|0,0,2]=3 31 B19R2.6063385 CC(C)[NH2+]C(O)COC1=CC=CC2=CC=CC=C12 MCULE-3868012049 [0,0,0,0,1,0|0,0,1]=2 32 B19R2.6063385 CC(C)[NH2+]C(O)COC1=CC=CC2=CC=CC=C12 MCULE-7876226647 [0,0,0,0,1,0|0,0,1]=2 33 B19R2.6063385 CN(C)CC(O)CNC1=C2C=CC=CC2=CC=N1 MCULE-7295431614 [0,0,0,0,1,0|3,0,0]=4 34 B19R2.6063385 CN(C)CC(O)COC1=CC=CC2=C1C=CC=C2 MCULE-9655466942 [0,0,0,0,1,0|1,0,0]=2 35 B19R2.6063385 C[NH+](C)CC(O)COC1=CC=CC2=C1C=CC=C2 MCULE-1976599326 [0,0,0,0,1,0|1,0,0]=2 36 B21R2.26604040 CC(C)CCNC(=O)COC1=CC=CC2=CC=CC=C12 MCULE-4306912806 [0,0,0,0,0,1|1,0,2]=4 37 B18R1.4935 C=CCC1=CC=CC=C1OCC(O)CNC(C)C MCULE-5383119061 [1,0,1,0,0,0|0,0,1]=3 38 B18R1.4935 C=CCC1=CC=CC=C1OCC(O)CNC(C)C MCULE-8135107027 [1,0,1,0,0,0|0,0,1]=3 39 B18R1.4935 C=CCC1=CC=CC=C1OC[C@@H](O)CNC(C)C MCULE-4865934088 [1,0,1,0,0,0|0,0,1]=3 40 B18R1.4935 C=CCC1=CC=CC=C1OC[C@@H](O)CNC(C)C MCULE-5780330728 [1,0,1,0,0,0|0,0,1]=3 41 B18R2.165811 BrCCCCCOC1=C2C=CC=CC2=CC=C1 MCULE-6951447614 [2,0,0,0,0,0|2,0,0]=4 42 B18R2.165811 CCCCCCNC1=C2C=CC=CC2=CC=C1 MCULE-2020032126 [2,0,0,0,0,0|2,0,0]=4 43 B18R2.892603 CCNC(=O)COC1=C2C=CC=CC2=CC=C1 MCULE-7538881377 [2,0,0,0,0,0|0,0,2]=4 44 B18R2.892603 CNCC(O)COC1=CC=CC2=CC=CC=C12 MCULE-6573854832 [2,0,0,0,0,0|0,0,0]=2 45 B18R2.892603 C[NH2+]CC(O)COC1=C2C=CC=CC2=CC=C1 MCULE-8748868825 [2,0,0,0,0,0|0,0,1]=3 46 B20R2.146654 CN(C)CCCCOC1=CC=C(C2=C1C=CC=C2)Cl MCULE-6385649727 [1,1,0,0,0,0|2,0,0]=4 47 B20R2.146654 CN(C)CCCCOC1=CC=C(C2=C1C=CC=C2)Cl MCULE-9028301787 [1,1,0,0,0,0|2,0,0]=4 48 B20R2.5183951 CC(C)(C)NCCCOC1=C2C=CC=CC2=CC=C1 MCULE-5332485988 [1,1,0,0,0,0|0,0,0]=2 49 B20R2.5183951 CC(C)(C)NCCCOC1=C2C=CC=CC2=CC=C1 MCULE-6624965475 [1,1,0,0,0,0|0,0,0]=2 50 B20R2.11063047 CC(C)(C)NC[C@H](O)COC1=CC=CC2=C1CC=C2 MCULE-3422445616 [0,1,0,0,1,0|0,0,1]=3 51 B20R2.14093367 CC(C)CC[C@@H](O)[C@@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-2741218286 [0,1,0,0,1,0|1,0,0]=3 52 B20R2.14093367 CC(C)CC[C@@H](O)[C@@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-4512494519 [0,1,0,0,1,0|1,0,0]=3 53 B20R2.14093367 CC(C)CC[C@H](O)[C@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-4299171654 [0,1,0,0,1,0|1,0,0]=3 54 B20R2.14093367 CC(C)CC[C@H](O)[C@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-5458678330 [0,1,0,0,1,0|1,0,0]=3 55 B22R2.3125848 COC1=CC2=C(C=CC=C2OCC(O)CNC(C)C)C=C1 MCULE-2540091054 [0,2,0,0,0,0|0,0,0]=2 56 B20R2.28938 CC(C)NCC(O)COC1=CC=C2C=CC=CC2=C1 MCULE-1693368577 [0,0,1,1,0,0|0,0,0]=2 57 B20R2.28938 CC(C)NCC(O)COC1=CC=C2C=CC=CC2=C1 MCULE-6332021678 [0,0,1,1,0,0|0,0,0]=2 58 B20R3.2720 C1=CC2=CC=CC(=C2N=C1)OCC3CCCNC3 MCULE-1045303663 [1,0,0,1,0,0|2,0,0]=4 59 B20R3.2720 C1=CC2=CC=CC(=C2N=C1)OCC3CCCNC3 MCULE-3321476540 [1,0,0,1,0,0|2,0,0]=4 60 B20R3.2720 C1=CC=C2C(=C1)C=CC=C2OCC3CCCNC3 MCULE-1120773003 [1,0,0,1,0,0|1,0,0]=3 61 B20R3.2720 C1=CC=C2C(=C1)C=CC=C2OCC3CCCNC3 MCULE-2093950811 [1,0,0,1,0,0|1,0,0]=3 62 B18R2.556536 CC(=O)NCCOC1=C2C=CC=CC2=CC=C1 MCULE-9322464364 [1,0,0,0,1,0|1,0,1]=4 63 B18R2.2459307 CC(C)CC[C@@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-7836792116 [0,0,0,0,2,0|2,0,0]=4 64 B18R2.2459307 CC(C)CC[C@@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-8103641719 [0,0,0,0,2,0|2,0,0]=4 65 B18R2.2459307 CC(C)CC[C@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-7616801559 [0,0,0,0,2,0|2,0,0]=4 66 B18R2.2459307 CC(C)CC[C@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-9100356494 [0,0,0,0,2,0|2,0,0]=4 67 B18R2.2880857 CC(C)NC(C)CC1=CC=CC2=CC=CC=C12 MCULE-2004256835 [0,0,0,0,2,0|1,0,0]=3 68 B18R2.2880857 CC(C)NC(C)CC1=CC=CC2=CC=CC=C12 MCULE-9875380504 [0,0,0,0,2,0|1,0,0]=3 69 B18R2.2417296 CC(C)C(O)C#CC1=CC=CC2=CC=CC=C12 MCULE-5792623253 [0,0,0,0,2,0|1,0,1]=4 70 B20R2.1477122 CC(C)OCCCNCC1=C2C=CC=CC2=CC=C1 MCULE-6536213418 [1,0,0,0,0,1|2,0,0]=4 71 B20R2.1477122 CC(C)OCCCNCC1=CC=CC2=CC=CC=C12 MCULE-8811520395 [1,0,0,0,0,1|2,0,0]=4 72 B20R2.1477122 CC(C)SCCCCOC1=CC=CC2=C1C=CC=C2 MCULE-8008107073 [1,0,0,0,0,1|1,0,0]=3 73 B20R2.1477122 CN(C)CCOCCOC1=CC=CC2=C1C=CC=C2 MCULE-3307635475 [1,0,0,0,0,1|2,0,0]=4 74 B20R2.1477122 CN(C)CCOCCOC1=CC=CC2=C1C=CC=C2 MCULE-7056734921 [1,0,0,0,0,1|2,0,0]=4