0 B19R1.28706 CCCCNC1=CC=C(C=C1)C(=O)OCCN(C)C MCULE-2802771697 [0,0,0,0,0,0|0,0,0]=0 1 B19R1.28706 CCCCNC1=CC=C(C=C1)C(=O)OCCN(C)C MCULE-8973928579 [0,0,0,0,0,0|0,0,0]=0 2 B19R1.28706 CCCCOC1=CC=C(C=C1)C(=O)NCCN(C)C MCULE-1605692499 [0,0,0,0,0,0|2,0,0]=2 3 B18R1.6542 CCCOC1=CC=C(C=C1)C(=O)NCCN(C)C MCULE-3300497842 [1,0,0,0,0,0|2,0,0]=3 4 B18R1.22853 CCCCOC1=CC=C(C=C1)C(=O)NCCOC MCULE-9627824074 [1,0,0,0,0,0|3,0,0]=4 5 B20R1.34337 CCCCOC1=CC=C(C=C1)C(=O)OC(C)CN(C)C MCULE-5110946408 [0,1,0,0,0,0|1,0,0]=2 6 B20R1.34337 CCCCOC1=CC=C(C=C1)C(=O)OC(C)CN(C)C MCULE-8555822099 [0,1,0,0,0,0|1,0,0]=2 7 B20R1.72572 CCCC(=O)NC1=CC=C(C=C1)C(=O)NCCC(C)C MCULE-1171751646 [0,1,0,0,0,0|2,0,1]=4 8 B18R1.9 CCCCCC1=CC=C(C=C1)C(=O)C=CN(C)C MCULE-1023167483 [0,0,0,0,1,0|1,0,2]=4 9 B17R1.1856 CCCCCC(=O)C1=CC=C(C=C1)CCCC MCULE-5750951890 [2,0,0,0,0,0|2,0,0]=4 10 B17R1.8600 CCOC1=CC=C(C=C1)C(=O)NCCN(C)C MCULE-3344554854 [2,0,0,0,0,0|2,0,0]=4 11 B17R1.8600 CCOC1=CC=C(C=C1)C(=O)OCCN(C)C MCULE-2630909016 [2,0,0,0,0,0|1,0,0]=3 12 B17R1.8600 CCOC1=CC=C(C=C1)C(=O)OCCN(C)C MCULE-4659432125 [2,0,0,0,0,0|1,0,0]=3 13 B17R1.17546 CCCCCC1=CC=C(C=C1)C(=O)CCCC MCULE-6349828569 [2,0,0,0,0,0|2,0,0]=4 14 B17R1.17546 CCCCCC1=CC=C(C=C1)C(=O)CCSC MCULE-3860027488 [2,0,0,0,0,0|2,0,0]=4 15 B19R1.507 CC(C)CCOC1=CC=C(C=C1)C(=O)CCN(C)C MCULE-5976472583 [0,1,0,0,1,0|1,0,0]=3 16 B19R1.507 CC(C)CCOC1=CC=C(C=C1)C(=O)CC[NH+](C)C MCULE-8112970012 [0,1,0,0,1,0|1,0,1]=4 17 B21R1.3790 CCCCOC1=CC=C(C=C1)C(=O)OCCN(CC)CC MCULE-3038836363 [0,2,0,0,0,0|1,0,0]=3 18 B21R1.3790 CCCCOC1=CC=C(C=C1)C(=O)OCCN(CC)CC MCULE-3847920757 [0,2,0,0,0,0|1,0,0]=3 19 B19R2.112185 CN(C)CCOC(=O)C1=CC=C2OCCOC2=C1 MCULE-5188869689 [1,0,0,1,0,0|2,0,0]=4 20 B19R2.416 CCCCNC(=O)C1=CC=C(C=C1)N2CCCC2 MCULE-5884910664 [1,0,0,1,0,0|2,0,0]=4 21 B19R2.416 CCCCOC(=O)C1=CC=C(C=C1)N2CCCC2 MCULE-1642284391 [1,0,0,1,0,0|1,0,0]=3 22 B19R2.3465918 CN(C)CCC(=O)C1=CC2=C(C=C1)OCCCO2 MCULE-4146302149 [0,0,0,1,1,0|2,0,0]=4 23 B21R2.13854 CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C MCULE-9475704933 [0,1,0,1,0,0|2,0,0]=4 24 B21R2.12946 CC(C)CCNC(=O)C1=CC=C(C=C1)N2CCCCC2 MCULE-2595964339 [0,1,0,1,0,0|2,0,0]=4 25 B21R2.12946 CC(C)CCNC(=O)C1=CC=C(C=C1)N2CCOCC2 MCULE-8454927404 [0,1,0,1,0,0|2,0,0]=4 26 B21R2.12946 CN(C)CCNC(=O)C1=CC=C(C=C1)N2CCCCC2 MCULE-3814572734 [0,1,0,1,0,0|1,0,0]=3 27 B21R2.12946 CN(C)CCNC(=O)C1=CC=C(C=C1)N2CCOCC2 MCULE-6651718161 [0,1,0,1,0,0|1,0,0]=3 28 B21R2.254591 CC(C)CCNC(=O)C1=CC=C(C=C1)CN2CCCC2 MCULE-3756523851 [0,1,0,1,0,0|2,0,0]=4 29 B17R1.46 CCCCC1=CC=C(C=C1)C(=O)CCN(C)C MCULE-4843562752 [1,0,0,0,1,0|0,0,0]=2 30 B17R1.46 CCCCC1=CC=C(C=C1)C(=O)CCN(C)C MCULE-6326916003 [1,0,0,0,1,0|0,0,0]=2 31 B17R1.46 CCCOC1=CC=C(C=C1)C(=O)CCN(C)C MCULE-4017089711 [1,0,0,0,1,0|1,0,0]=3 32 B17R1.46 CCCOC1=CC=C(C=C1)C(=O)CCN(C)C MCULE-9975564993 [1,0,0,0,1,0|1,0,0]=3 33 B17R1.46 CCCSC1=CC=C(C=C1)C(=O)CCN(C)C MCULE-7920332519 [1,0,0,0,1,0|1,0,0]=3 34 B17R1.46 CCCSC1=CC=C(C=C1)C(=O)CCN(C)C MCULE-8548185693 [1,0,0,0,1,0|1,0,0]=3 35 B17R1.16 CCCCCC1=CC=C(C=C1)C(=O)CC(C)C MCULE-1034749859 [0,0,0,0,2,0|2,0,0]=4 36 B19R1.6511 CCCOC1=CC=C(C=C1)C(=O)NCCCN(C)C MCULE-7414254508 [1,0,0,0,0,1|2,0,0]=4 37 B19R1.6511 CCCOC1=CC=C(C=C1)C(=O)NCCCN(C)C MCULE-7837791405 [1,0,0,0,0,1|2,0,0]=4 38 B19R1.28816 CCCCOC(=O)CC1=CC=C(C=C1)OCCCC MCULE-9993218480 [1,0,0,0,0,1|2,0,0]=4