0 B18R1.4935 C=CCC1=CC=CC=C1OCC(O)CNC(C)C MCULE-5383119061 [0,0,0,0,0,0|0,0,0]=0 1 B18R1.4935 C=CCC1=CC=CC=C1OCC(O)CNC(C)C MCULE-8135107027 [0,0,0,0,0,0|0,0,0]=0 2 B18R1.4935 C=CCC1=CC=CC=C1OC[C@@H](O)CNC(C)C MCULE-4865934088 [0,0,0,0,0,0|0,0,0]=0 3 B18R1.4935 C=CCC1=CC=CC=C1OC[C@@H](O)CNC(C)C MCULE-5780330728 [0,0,0,0,0,0|0,0,0]=0 4 B18R1.4935 CCCC1=CC=CC=C1OC[C@@H](O)CNC(C)C MCULE-1655279972 [0,0,0,0,0,0|0,0,2]=2 5 B17R1.1421 COC1=C(C=CC=C1)OCC(O)CNC(C)C MCULE-3527798315 [1,0,0,0,0,0|1,0,1]=3 6 B17R1.1421 COC1=CC=CC=C1OCC(O)CNC(C)C MCULE-6600420482 [1,0,0,0,0,0|1,0,1]=3 7 B17R1.1421 COC1=CC=CC=C1OC[C@@H](O)CNC(C)C MCULE-8458271630 [1,0,0,0,0,0|1,0,1]=3 8 B17R1.1421 CSC1=C(C=CC=C1)OCC(O)CNC(C)C MCULE-9686548006 [1,0,0,0,0,0|1,0,1]=3 9 B17R1.1421 [C@@H](O)(CNC(C)C)COC1=CC=CC=C1OC MCULE-5598300598 [1,0,0,0,0,0|1,0,1]=3 10 B19R1.10443 C=CCOC1=C(C=CC=C1)OCC(O)CNC(C)C MCULE-3209868387 [0,1,0,0,0,0|0,0,0]=1 11 B19R1.10443 C=CCOC1=C(C=CC=C1)OCC(O)CNC(C)C MCULE-5603406124 [0,1,0,0,0,0|0,0,0]=1 12 B19R1.10443 COCCC1=CC=CC=C1OCC(O)CNC(C)C MCULE-3786811982 [0,1,0,0,0,0|0,0,2]=3 13 B19R1.27542 C=CCC1=CC(=CC=C1OCC(O)CNC(C)C)O MCULE-5226195901 [0,1,0,0,0,0|0,0,0]=1 14 B19R1.29731 C=CCC1=CC=CC=C1OCC(=NO)CNC(C)C MCULE-4101295208 [0,1,0,0,0,0|0,0,1]=2 15 B19R2.258038 CC(C)NCC(O)COC1=C(C=CC=C1)C2CC2 MCULE-5406864043 [0,0,0,1,0,0|0,0,2]=3 16 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1C=CC2 MCULE-8593428257 [0,0,0,1,0,0|0,0,2]=3 17 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1C=CN2 MCULE-7764948919 [0,0,0,1,0,0|1,0,1]=3 18 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1CC=C2 MCULE-6272363139 [0,0,0,1,0,0|0,0,0]=1 19 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1CC=C2 MCULE-9577057256 [0,0,0,1,0,0|0,0,0]=1 20 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1OC=C2 MCULE-9932341166 [0,0,0,1,0,0|1,0,0]=2 21 B19R2.1022145 CC(C)NC[C@H](O)COC1=CC=CC2=C1C=CN2 MCULE-3120467697 [0,0,0,1,0,0|1,0,1]=3 22 B19R2.1022145 CC(C)NC[C@H](O)COC1=CC=CC2=C1C=CN2 MCULE-7768479155 [0,0,0,1,0,0|1,0,1]=3 23 B16R1.57 CC(C)OCCCOC1=C(C=CC=C1)C=O MCULE-6468701157 [2,0,0,0,0,0|2,0,0]=4 24 B16R1.694 C=CCC1=C(C=CC=C1)OCC(O)CNC MCULE-1918761571 [2,0,0,0,0,0|0,0,0]=2 25 B18R1.22020 C=CCC1=C(C=CC(=C1)Cl)OCCCNC(C)C MCULE-5264377363 [1,1,0,0,0,0|0,0,0]=2 26 B18R1.22020 C=CCC1=C(C=CC(=C1)Cl)OCCCNC(C)C MCULE-5560073113 [1,1,0,0,0,0|0,0,0]=2 27 B18R1.57272 C=CCC1=C(C(=CC=C1)C)OCCCCN(C)C MCULE-2152785281 [1,1,0,0,0,0|2,0,0]=4 28 B18R1.57272 C=CCC1=C(C(=CC=C1)C)OCCCCN(C)C MCULE-5046999818 [1,1,0,0,0,0|2,0,0]=4 29 B18R1.7319 CCC(C)NCC(O)COC1=CC=CC=C1OC MCULE-1384366041 [1,1,0,0,0,0|1,0,1]=4 30 B18R1.7319 CCC(C)NCC(O)COC1=CC=CC=C1OC MCULE-6196178563 [1,1,0,0,0,0|1,0,1]=4 31 B18R1.38875 CC(C)(C)NCC(O)COC1=C(C=CC=C1)C#N MCULE-6827904092 [1,1,0,0,0,0|1,0,1]=4 32 B18R1.38875 CC(C)(C)NCC(O)COC1=CC=CC=C1C#N MCULE-4286995798 [1,1,0,0,0,0|1,0,1]=4 33 B18R1.38875 COC1=CC=CC=C1OCC(O)CNC(C)(C)C MCULE-3929124579 [1,1,0,0,0,0|1,0,1]=4 34 B18R1.38875 COC1=CC=CC=C1OCC(O)CNC(C)(C)C MCULE-5747488725 [1,1,0,0,0,0|1,0,1]=4 35 B18R1.106042 CC(C)NCC(O)COC1=C(C=CC=C1)C(C)C MCULE-1212191912 [1,1,0,0,0,0|0,0,1]=3 36 B18R1.106042 CC(C)NCC(O)COC1=C(C=CC=C1)C(C)C MCULE-6748351522 [1,1,0,0,0,0|0,0,1]=3 37 B18R1.2620 C=CCC1=CC=CC=C1OCC(O)CNCCO MCULE-5094331455 [1,1,0,0,0,0|0,0,0]=2 38 B18R1.2620 C=CCC1=CC=CC=C1OCC(O)CNCCO MCULE-7234904306 [1,1,0,0,0,0|0,0,0]=2 39 B20R1.51253 C#CCOC1=CC=CC=C1OCC(O)CNC(C)(C)C MCULE-3934864395 [0,2,0,0,0,0|0,0,2]=4 40 B20R1.51253 C#CCOC1=CC=CC=C1OCC(O)CNC(C)(C)C MCULE-4902999220 [0,2,0,0,0,0|0,0,2]=4 41 B20R1.57239 CCC(C)C1=C(C=CC=C1)OCC(O)CNC(C)(C)C MCULE-6786467365 [0,2,0,0,0,0|0,0,2]=4 42 B20R1.57239 CCC(C)C1=C(C=CC=C1)OCC(O)CNC(C)(C)C MCULE-9839184635 [0,2,0,0,0,0|0,0,2]=4 43 B18R2.14644 CC(C)NCC(O)C1=CC=C2C=CC=CC2=C1 MCULE-2162040926 [1,0,0,1,0,0|1,0,1]=4 44 B18R2.14644 CC(C)NCC(O)C1=CC=C2C=CC=CC2=C1 MCULE-7450797403 [1,0,0,1,0,0|1,0,1]=4 45 B18R2.14644 CC(C)NCC(O)C1COC2=C(O1)C=CC=C2 MCULE-9948402013 [1,0,0,1,0,0|1,0,1]=4 46 B18R2.14644 CC(C)NC[C@H](O)C1=CC=C2C=CC=CC2=C1 MCULE-6636132460 [1,0,0,1,0,0|1,0,1]=4 47 B18R2.14644 CC(C)NC[C@H](O)C1=CC=C2C=CC=CC2=C1 MCULE-9905310593 [1,0,0,1,0,0|1,0,1]=4 48 B18R2.2627 C=CCC1=C(C=CC=C1)OCC2CCCNC2 MCULE-5546789693 [1,0,0,1,0,0|1,0,0]=3 49 B18R2.2627 C=CCC1=C(C=CC=C1)OCC2CCCNC2 MCULE-8971488419 [1,0,0,1,0,0|1,0,0]=3 50 B20R2.10963774 CC(C)NCC(O)COC1=C2C=CC=CC2=CC=C1 MCULE-6124856976 [0,0,0,1,0,1|0,0,1]=3 51 B20R2.10963774 CC(C)NCC(O)COC1=C2C=CC=CC2=CC=C1 MCULE-7804628650 [0,0,0,1,0,1|0,0,1]=3 52 B20R2.10963774 CC(C)NC[C@@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-5440407779 [0,0,0,1,0,1|0,0,1]=3 53 B20R2.10963774 CC(C)NC[C@@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-5800988302 [0,0,0,1,0,1|0,0,1]=3 54 B20R2.10963774 CC(C)NC[C@@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-7361292589 [0,0,0,1,0,1|0,0,1]=3 55 B20R2.10963774 CC(C)NC[C@@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-8071653566 [0,0,0,1,0,1|0,0,1]=3 56 B20R2.10963774 CC(C)NC[C@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-6308528682 [0,0,0,1,0,1|0,0,1]=3 57 B20R2.10963774 CC(C)NC[C@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-7821120370 [0,0,0,1,0,1|0,0,1]=3 58 B20R2.10963774 CC(C)NC[C@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-7995233869 [0,0,0,1,0,1|0,0,1]=3 59 B20R2.10963774 CC(C)NC[C@H](O)COC1=C2C=CC=CC2=CC=C1 MCULE-8175273982 [0,0,0,1,0,1|0,0,1]=3 60 B20R2.11063047 CC(C)(C)NC[C@H](O)COC1=CC=CC2=C1CC=C2 MCULE-3422445616 [0,1,0,1,0,0|0,0,0]=2 61 B16R1.695 C=CCC1=C(C=CC=C1)OCCCN(C)C MCULE-3700861850 [1,0,0,0,1,0|1,0,0]=3 62 B16R1.695 C=CCC1=C(C=CC=C1)OCCCN(C)C MCULE-5195102194 [1,0,0,0,1,0|1,0,0]=3 63 B18R1.7318 COC1=CC=CC=C1OCC(O)CNCC(C)C MCULE-3993821640 [1,0,0,0,0,1|1,0,1]=4 64 B18R1.7318 COC1=CC=CC=C1OCC(O)CNCC(C)C MCULE-5845153931 [1,0,0,0,0,1|1,0,1]=4