0 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1C=CC2 MCULE-8593428257 [0,0,0,0,0,0|1,0,0]=1 1 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1C=CN2 MCULE-7764948919 [0,0,0,0,0,0|0,0,0]=0 2 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1CC=C2 MCULE-6272363139 [0,0,0,0,0,0|1,0,1]=2 3 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1CC=C2 MCULE-9577057256 [0,0,0,0,0,0|1,0,1]=2 4 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1OC=C2 MCULE-9932341166 [0,0,0,0,0,0|2,0,0]=2 5 B19R2.1022145 CC(C)NC[C@H](O)COC1=CC=CC2=C1C=CN2 MCULE-3120467697 [0,0,0,0,0,0|0,0,0]=0 6 B19R2.1022145 CC(C)NC[C@H](O)COC1=CC=CC2=C1C=CN2 MCULE-7768479155 [0,0,0,0,0,0|0,0,0]=0 7 B20R2.11063047 CC(C)(C)NC[C@H](O)COC1=CC=CC2=C1CC=C2 MCULE-3422445616 [0,1,0,0,0,0|1,0,1]=3 8 B18R1.4935 C=CCC1=CC=CC=C1OCC(O)CNC(C)C MCULE-5383119061 [0,0,1,0,0,0|1,0,1]=3 9 B18R1.4935 C=CCC1=CC=CC=C1OCC(O)CNC(C)C MCULE-8135107027 [0,0,1,0,0,0|1,0,1]=3 10 B18R1.4935 C=CCC1=CC=CC=C1OC[C@@H](O)CNC(C)C MCULE-4865934088 [0,0,1,0,0,0|1,0,1]=3 11 B18R1.4935 C=CCC1=CC=CC=C1OC[C@@H](O)CNC(C)C MCULE-5780330728 [0,0,1,0,0,0|1,0,1]=3 12 B18R1.4935 CCCC1=CC=CC=C1OC[C@@H](O)CNC(C)C MCULE-1655279972 [0,0,1,0,0,0|1,0,2]=4 13 B18R2.560567 CC(C)NC(=O)CCC1=C2C=CNC2=CC=C1 MCULE-8540655228 [0,0,0,0,1,0|1,0,2]=4 14 B20R2.10963774 CC(C)NCC(O)COC1=C2C=CC=CC2=CC=C1 MCULE-6124856976 [0,0,0,0,0,1|1,0,0]=2 15 B20R2.10963774 CC(C)NCC(O)COC1=C2C=CC=CC2=CC=C1 MCULE-7804628650 [0,0,0,0,0,1|1,0,0]=2 16 B20R2.10963774 CC(C)NC[C@@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-5440407779 [0,0,0,0,0,1|1,0,0]=2 17 B20R2.10963774 CC(C)NC[C@@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-5800988302 [0,0,0,0,0,1|1,0,0]=2 18 B20R2.10963774 CC(C)NC[C@@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-7361292589 [0,0,0,0,0,1|1,0,0]=2 19 B20R2.10963774 CC(C)NC[C@@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-8071653566 [0,0,0,0,0,1|1,0,0]=2 20 B20R2.10963774 CC(C)NC[C@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-6308528682 [0,0,0,0,0,1|1,0,0]=2 21 B20R2.10963774 CC(C)NC[C@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-7821120370 [0,0,0,0,0,1|1,0,0]=2 22 B20R2.10963774 CC(C)NC[C@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-7995233869 [0,0,0,0,0,1|1,0,0]=2 23 B20R2.10963774 CC(C)NC[C@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-8175273982 [0,0,0,0,0,1|1,0,0]=2 24 B17R1.1421 COC1=C(C=CC=C1)OCC(O)CNC(C)C MCULE-3527798315 [1,0,1,0,0,0|1,0,1]=4 25 B17R1.1421 COC1=CC=CC=C1OCC(O)CNC(C)C MCULE-6600420482 [1,0,1,0,0,0|1,0,1]=4 26 B17R1.1421 COC1=CC=CC=C1OC[C@@H](O)CNC(C)C MCULE-8458271630 [1,0,1,0,0,0|1,0,1]=4 27 B17R1.1421 CSC1=C(C=CC=C1)OCC(O)CNC(C)C MCULE-9686548006 [1,0,1,0,0,0|1,0,1]=4 28 B17R1.1421 [C@@H](O)(CNC(C)C)COC1=CC=CC=C1OC MCULE-5598300598 [1,0,1,0,0,0|1,0,1]=4 29 B19R1.10443 C=CCOC1=C(C=CC=C1)OCC(O)CNC(C)C MCULE-3209868387 [0,1,1,0,0,0|1,0,1]=4 30 B19R1.10443 C=CCOC1=C(C=CC=C1)OCC(O)CNC(C)C MCULE-5603406124 [0,1,1,0,0,0|1,0,1]=4 31 B19R1.27542 C=CCC1=CC(=CC=C1OCC(O)CNC(C)C)O MCULE-5226195901 [0,1,1,0,0,0|1,0,1]=4 32 B19R2.1389231 CC(C)CC[C@@H](O)[C@@H](N)C1=C2C=CNC2=CC=C1 MCULE-2263098631 [0,1,0,0,1,0|1,0,0]=3 33 B19R2.1389231 CC(C)CC[C@@H](O)[C@@H](N)C1=C2C=CNC2=CC=C1 MCULE-7212683326 [0,1,0,0,1,0|1,0,0]=3 34 B19R2.1389231 CC(C)CC[C@H](O)[C@H](N)C1=C2C=CNC2=CC=C1 MCULE-5471763397 [0,1,0,0,1,0|1,0,0]=3 35 B19R2.1389231 CC(C)CC[C@H](O)[C@H](N)C1=C2C=CNC2=CC=C1 MCULE-8215425781 [0,1,0,0,1,0|1,0,0]=3 36 B19R2.1 CC(C)NC(=O)COC1=C2C=CN(C2=CC=C1)C MCULE-9837714057 [0,1,0,0,1,0|0,0,2]=4 37 B21R2.210872 CC(C)NCC(O)COC1=CC(=O)OC2=C1C=CC=C2 MCULE-5145229526 [0,1,0,0,0,1|2,0,0]=4 38 B21R2.210872 CC(C)NCC(O)COC1=CC(=O)OC2=C1C=CC=C2 MCULE-6605798837 [0,1,0,0,0,1|2,0,0]=4 39 B21R2.3237171 CC(C)NCC(O)COC1=CC=CC2=C1C=C(C=C2)O MCULE-4252356908 [0,1,0,0,0,1|1,0,0]=3 40 B21R2.3237171 CC(C)NCC(O)COC1=CC=CC2=C1C=C(C=C2)O MCULE-4514002295 [0,1,0,0,0,1|1,0,0]=3 41 B21R2.4389558 CC(C)NCC(O)COC1=C2C=CC=C(C2=CC=C1)O MCULE-1912559760 [0,1,0,0,0,1|1,0,0]=3 42 B21R2.4494802 CC(C)NCC(O)COC1=CC=C(C2=CC=CC=C12)O MCULE-2781803891 [0,1,0,0,0,1|1,0,0]=3 43 B21R2.4494802 CC(C)NCC(O)COC1=CC=C(C2=CC=CC=C12)O MCULE-5812736652 [0,1,0,0,0,1|1,0,0]=3 44 B21R2.221517 CC(C)(C)NCC(O)COC1=C2NC(=O)NC2=CC=C1 MCULE-6772350133 [0,2,0,0,0,0|1,0,0]=3 45 B21R2.221517 CC(C)(C)NCC(O)COC1=C2NC(=O)NC2=CC=C1 MCULE-9132903933 [0,2,0,0,0,0|1,0,0]=3 46 B21R2.221517 CC1=CC2=C(N1)C=CC=C2OCC(O)CNC(C)(C)C MCULE-7804650113 [0,2,0,0,0,0|0,0,0]=2 47 B21R2.457419 CCC1=CC2=CC=CC(=C2O1)OCC(O)CNC(C)C MCULE-5933814861 [0,2,0,0,0,0|2,0,0]=4 48 B21R2.14121573 CC(C)(C)NCC(O)COC1=CC=CC2=C1C(=O)OC2 MCULE-2591643608 [0,2,0,0,0,0|2,0,0]=4 49 B21R2.14121573 CC(C)(C)NCC(O)COC1=CC=CC2=C1C(=O)OC2 MCULE-7586586258 [0,2,0,0,0,0|2,0,0]=4 50 B21R2.14121573 CC(C)(C)NC[C@@H](O)COC1=CC=CC2=C1C(=O)OC2 MCULE-2614577238 [0,2,0,0,0,0|2,0,0]=4 51 B21R2.14121573 CC1=CNC2=C1C(=CC=C2)OCC(O)CNC(C)(C)C MCULE-2698991248 [0,2,0,0,0,0|0,0,0]=2 52 B21R2.14121573 CC1=CNC2=C1C(=CC=C2)OCC(O)C[NH2+]C(C)(C)C MCULE-7857567878 [0,2,0,0,0,0|0,0,1]=3 53 B19R3.19245 C1=CC2=C(CC=C2)C(=C1)OCC3CNCCO3 MCULE-3523505897 [1,0,0,1,0,0|1,0,1]=4 54 B19R3.19245 C1=CC2=C(CC=C2)C(=C1)OCC3CNCCO3 MCULE-6408363094 [1,0,0,1,0,0|1,0,1]=4 55 B19R3.19245 C1=CC2=C(CC=C2)C(=C1)OC[C@@H]3CNCCO3 MCULE-4343894912 [1,0,0,1,0,0|1,0,1]=4 56 B19R3.19245 C1=CC2=C(CC=C2)C(=C1)OC[C@@H]3CNCCO3 MCULE-5890973723 [1,0,0,1,0,0|1,0,1]=4 57 B17R2.90971 CC(C)CC[C@@H](N)C1=C2C=CNC2=CC=C1 MCULE-1701514823 [0,0,0,0,2,0|2,0,0]=4 58 B17R2.90971 CC(C)CC[C@@H](N)C1=C2C=CNC2=CC=C1 MCULE-4238216180 [0,0,0,0,2,0|2,0,0]=4 59 B17R2.90971 CC(C)CC[C@H](N)C1=C2C=CNC2=CC=C1 MCULE-3313596273 [0,0,0,0,2,0|2,0,0]=4 60 B17R2.90971 CC(C)CC[C@H](N)C1=C2C=CNC2=CC=C1 MCULE-7361868785 [0,0,0,0,2,0|2,0,0]=4 61 B19R2.1021309 CC(C)SCCCOC1=CC=CC2=C1C=CC=C2 MCULE-5224053626 [1,0,0,0,0,1|2,0,0]=4 62 B19R2.6063385 CC(C)[NH2+]C(O)COC1=CC=CC2=CC=CC=C12 MCULE-3868012049 [0,0,0,0,1,1|1,0,1]=4 63 B19R2.6063385 CC(C)[NH2+]C(O)COC1=CC=CC2=CC=CC=C12 MCULE-7876226647 [0,0,0,0,1,1|1,0,1]=4 64 B19R2.6063385 CN(C)CC(O)COC1=CC=CC2=C1C=CC=C2 MCULE-9655466942 [0,0,0,0,1,1|2,0,0]=4 65 B19R2.6063385 C[NH+](C)CC(O)COC1=CC=CC2=C1C=CC=C2 MCULE-1976599326 [0,0,0,0,1,1|2,0,0]=4