0 B19R1.27542 C=CCC1=CC(=CC=C1OCC(O)CNC(C)C)O MCULE-5226195901 [0,0,0,0,0,0|0,0,0]=0 1 B18R1.4935 C=CCC1=CC=CC=C1OCC(O)CNC(C)C MCULE-5383119061 [1,0,0,0,0,0|0,0,0]=1 2 B18R1.4935 C=CCC1=CC=CC=C1OCC(O)CNC(C)C MCULE-8135107027 [1,0,0,0,0,0|0,0,0]=1 3 B18R1.4935 C=CCC1=CC=CC=C1OC[C@@H](O)CNC(C)C MCULE-4865934088 [1,0,0,0,0,0|0,0,0]=1 4 B18R1.4935 C=CCC1=CC=CC=C1OC[C@@H](O)CNC(C)C MCULE-5780330728 [1,0,0,0,0,0|0,0,0]=1 5 B18R1.4935 CCCC1=CC=CC=C1OC[C@@H](O)CNC(C)C MCULE-1655279972 [1,0,0,0,0,0|0,0,2]=3 6 B18R1.22020 C=CCC1=C(C=CC(=C1)Cl)OCCCNC(C)C MCULE-5264377363 [1,0,0,0,0,0|1,0,0]=2 7 B18R1.22020 C=CCC1=C(C=CC(=C1)Cl)OCCCNC(C)C MCULE-5560073113 [1,0,0,0,0,0|1,0,0]=2 8 B17R1.1421 COC1=C(C=CC=C1)OCC(O)CNC(C)C MCULE-3527798315 [2,0,0,0,0,0|1,0,1]=4 9 B17R1.1421 COC1=CC=CC=C1OCC(O)CNC(C)C MCULE-6600420482 [2,0,0,0,0,0|1,0,1]=4 10 B17R1.1421 COC1=CC=CC=C1OC[C@@H](O)CNC(C)C MCULE-8458271630 [2,0,0,0,0,0|1,0,1]=4 11 B17R1.1421 CSC1=C(C=CC=C1)OCC(O)CNC(C)C MCULE-9686548006 [2,0,0,0,0,0|1,0,1]=4 12 B17R1.1421 [C@@H](O)(CNC(C)C)COC1=CC=CC=C1OC MCULE-5598300598 [2,0,0,0,0,0|1,0,1]=4 13 B17R1.14600 CC(C)NCC(O)COC1=CC=C(C=C1Br)Br MCULE-4857067328 [2,0,0,0,0,0|2,0,0]=4 14 B17R1.14600 CC(C)NCC(O)COC1=CC=C(C=C1Br)Br MCULE-7235975705 [2,0,0,0,0,0|2,0,0]=4 15 B17R1.14600 CC(C)NCC(O)COC1=CC=C(C=C1Cl)Cl MCULE-1933072470 [2,0,0,0,0,0|2,0,0]=4 16 B17R1.14600 CC(C)NCC(O)COC1=CC=C(C=C1Cl)Cl MCULE-8143353427 [2,0,0,0,0,0|2,0,0]=4 17 B17R1.14600 CC1=CC(=CC=C1OCC(O)CNC(C)C)Cl MCULE-1992712299 [2,0,0,0,0,0|1,0,0]=3 18 B17R1.14600 CC1=CC(=CC=C1OCC(O)CNC(C)C)Cl MCULE-4221914968 [2,0,0,0,0,0|1,0,0]=3 19 B19R1.10443 C=CCOC1=C(C=CC=C1)OCC(O)CNC(C)C MCULE-3209868387 [1,1,0,0,0,0|0,0,0]=2 20 B19R1.10443 C=CCOC1=C(C=CC=C1)OCC(O)CNC(C)C MCULE-5603406124 [1,1,0,0,0,0|0,0,0]=2 21 B19R1.10443 COCCC1=CC=CC=C1OCC(O)CNC(C)C MCULE-3786811982 [1,1,0,0,0,0|0,0,2]=4 22 B19R1.29731 C=CCC1=CC=CC=C1OCC(=NO)CNC(C)C MCULE-4101295208 [1,1,0,0,0,0|0,0,1]=3 23 B19R1.257933 CC(=O)C1=CC(=CC=C1OCC(O)CNC(C)C)N MCULE-7349588918 [1,1,0,0,0,0|1,0,1]=4 24 B19R1.27415 C=CCC1=C(C=CC(=C1)OC)OCCCCN(C)C MCULE-7068640195 [1,1,0,0,0,0|2,0,0]=4 25 B19R1.27415 C=CCC1=C(C=CC(=C1)OC)OCCCNC(C)C MCULE-2363417500 [1,1,0,0,0,0|0,0,0]=2 26 B19R1.27415 C=CCC1=C(C=CC(=C1)OC)OCCCNC(C)C MCULE-6250510121 [1,1,0,0,0,0|0,0,0]=2 27 B19R1.27416 C=CCC1=C(C=CC(=C1)Cl)OCCCNC(C)CC MCULE-4157283046 [1,1,0,0,0,0|1,0,0]=3 28 B19R1.27416 C=CCC1=C(C=CC(=C1)Cl)OCCCNC(C)CC MCULE-5796655135 [1,1,0,0,0,0|1,0,0]=3 29 B19R2.258038 CC(C)NCC(O)COC1=C(C=CC=C1)C2CC2 MCULE-5406864043 [1,0,0,1,0,0|0,0,2]=4 30 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1C=CC2 MCULE-8593428257 [1,0,0,1,0,0|0,0,2]=4 31 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1C=CN2 MCULE-7764948919 [1,0,0,1,0,0|1,0,1]=4 32 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1CC=C2 MCULE-6272363139 [1,0,0,1,0,0|0,0,0]=2 33 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1CC=C2 MCULE-9577057256 [1,0,0,1,0,0|0,0,0]=2 34 B19R2.1022145 CC(C)NCC(O)COC1=CC=CC2=C1OC=C2 MCULE-9932341166 [1,0,0,1,0,0|1,0,0]=3 35 B19R2.1022145 CC(C)NC[C@H](O)COC1=CC=CC2=C1C=CN2 MCULE-3120467697 [1,0,0,1,0,0|1,0,1]=4 36 B19R2.1022145 CC(C)NC[C@H](O)COC1=CC=CC2=C1C=CN2 MCULE-7768479155 [1,0,0,1,0,0|1,0,1]=4 37 B21R2.4494802 CC(C)NCC(O)COC1=CC=C(C2=CC=CC=C12)O MCULE-2781803891 [0,1,0,1,0,0|0,0,1]=3 38 B21R2.4494802 CC(C)NCC(O)COC1=CC=C(C2=CC=CC=C12)O MCULE-5812736652 [0,1,0,1,0,0|0,0,1]=3 39 B17R1.16960 C=CCC1=C(C=CC(=C1)C)OCCNC(C)C MCULE-4277031409 [1,0,0,0,1,0|1,0,0]=3 40 B17R1.16960 C=CCC1=C(C=CC(=C1)C)OCCNC(C)C MCULE-4296638431 [1,0,0,0,1,0|1,0,0]=3 41 B19R1.27539 C=CCC1=CC(=CC=C1OCCCNCC(C)O)C MCULE-1116898238 [1,0,0,0,0,1|2,0,0]=4 42 B19R1.27539 C=CCC1=CC(=CC=C1OCCCNCC(C)O)C MCULE-8720118379 [1,0,0,0,0,1|2,0,0]=4