0 B13R1.123 N1C(=O)C(=C(NC1=O)NCCN)Cl MCULE-9513163363 [0,0,0,0,0,0|3,0,0]=3 1 B13R1.123 NCCNC1=C(C(=O)NC(=O)N1)Cl MCULE-8251069948 [0,0,0,0,0,0|3,0,0]=3 2 B13R1.123 O=C1NC(=O)C(=C(N1)NCCO)I MCULE-2270584284 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.40 CCCC1=C(C(=O)NC(=N1)N)I MCULE-4100707386 [1,0,0,0,0,0|2,0,1]=4 4 B12R1.40 CCCC1=CC(=O)NC(=O)N1C MCULE-7410631807 [1,0,0,0,0,0|2,0,0]=3 5 B12R1.100 C=CCCC1=CC(=O)NC(=O)N1 MCULE-4964997977 [1,0,0,0,0,0|1,0,1]=3 6 B12R1.100 CCCCC1=CC(=O)NC(=S)N1 MCULE-7970488328 [1,0,0,0,0,0|1,1,0]=3 7 B12R1.100 CCOCC1=CC(=O)NC(=S)N1 MCULE-5094075584 [1,0,0,0,0,0|2,1,0]=4 8 B12R1.374 CC1=C(C=C(C=C1)F)CCCO MCULE-9309190486 [1,0,0,0,0,0|3,0,0]=4 9 B12R1.374 CC1=CC=C(C(=C1)CCCO)C MCULE-4696359720 [1,0,0,0,0,0|3,0,0]=4 10 B12R1.374 CC1=NNC(=O)N=C1NCCO MCULE-6646799060 [1,0,0,0,0,0|2,0,1]=4 11 B14R1.47 CCCCNC1=CC(=O)NC(=O)N1C MCULE-1100690277 [0,1,0,0,0,0|3,0,0]=4 12 B14R1.47 CCCCNC1=CC(=O)NC(=O)N1C MCULE-3763745230 [0,1,0,0,0,0|3,0,0]=4 13 B14R1.47 O=C1NC(=O)C(=C(N1)NCCCO)Br MCULE-8138285378 [0,1,0,0,0,0|1,0,0]=2 14 B14R1.136 CN1C(=O)C=C(N(C1=O)C)NCCO MCULE-7960700562 [0,1,0,0,0,0|3,0,0]=4 15 B14R1.7443 N#CC1=C(NC(=O)NC1=O)NCCO MCULE-8565908686 [0,1,0,0,0,0|1,0,1]=3 16 B12R1.1624 CCCCN1C(=O)NC(=O)C1=O MCULE-3718131937 [0,0,0,0,1,0|3,0,0]=4 17 B11R1.17 CC1=C(C=CC=C1)CCCO MCULE-1965312124 [2,0,0,0,0,0|2,0,0]=4 18 B11R1.17 CC1=C(C=CN=C1)CCCO MCULE-3360396742 [2,0,0,0,0,0|1,0,1]=4 19 B11R1.8 CC1=C(NC(=O)NC1=O)CCl MCULE-8748721239 [2,0,0,0,0,0|1,0,0]=3 20 B11R1.8 CC1=C(NC(=O)NC1=O)CO MCULE-2105308817 [2,0,0,0,0,0|0,0,0]=2 21 B11R1.8 CCC1=CC(=O)NC(=O)N1C MCULE-8533980518 [2,0,0,0,0,0|2,0,0]=4 22 B11R1.8 O=C1NC(=O)C(=C(N1)CCl)Cl MCULE-2767621981 [2,0,0,0,0,0|2,0,0]=4 23 B11R1.8 O=C1NC(=O)C(=C(N1)CO)O MCULE-8946189974 [2,0,0,0,0,0|1,0,0]=3 24 B11R1.34 C=CCC1=CC(=O)NC(=O)N1 MCULE-1243468197 [2,0,0,0,0,0|0,0,2]=4 25 B11R1.34 CC#CC1=CC(=O)NC(=O)N1 MCULE-7820995699 [2,0,0,0,0,0|0,0,2]=4 26 B11R1.34 CCCC1=CC(=O)NC(=S)N1 MCULE-9403710688 [2,0,0,0,0,0|0,1,0]=3 27 B11R1.34 CCOC1=CC(=O)NC(=O)N1 MCULE-9489557815 [2,0,0,0,0,0|1,0,0]=3 28 B11R1.34 CSCC1=CC(=O)NC(=O)N1 MCULE-7457913087 [2,0,0,0,0,0|1,0,0]=3 29 B13R1.32 CCCC1=CC(=O)N(C(=O)N1C)C MCULE-5315365920 [1,1,0,0,0,0|2,0,0]=4 30 B13R1.3980 CCCC1=C(C(=O)NC(=C1)C)CN MCULE-4045012586 [1,1,0,0,0,0|2,0,0]=4 31 B13R1.3980 CCCC1=C(C(=O)NC(=C1)C)CN MCULE-9598306471 [1,1,0,0,0,0|2,0,0]=4 32 B13R1.3980 CCNC1=C(C(=O)NC(=O)N1)N=O MCULE-1467604416 [1,1,0,0,0,0|2,0,0]=4 33 B13R1.4789 COC(=O)C1=C(C(=O)NC(=O)N1)C MCULE-8950475704 [1,1,0,0,0,0|1,0,1]=4 34 B13R1.55 CCCCOC1=CC(=O)NC(=S)N1 MCULE-6645679805 [1,1,0,0,0,0|1,1,0]=4 35 B13R1.136 CCCNC1=CC(=O)N(C(=O)N1)C MCULE-9773925967 [1,1,0,0,0,0|2,0,0]=4 36 B13R1.136 CN1C(=O)C=C(NC1=O)NCCO MCULE-6902379600 [1,1,0,0,0,0|1,0,0]=3 37 B13R1.656 CC1=NNC(=O)N=C1NCCCO MCULE-7945233105 [1,1,0,0,0,0|1,0,1]=4 38 B13R1.3467 CC1=C(C(=O)OC1=O)CCC(=O)O MCULE-1230724012 [0,1,0,0,1,0|1,0,1]=4 39 B15R1.50 CN1C(=O)C=C(N(C1=O)C)NCCCO MCULE-1185652227 [0,2,0,0,0,0|2,0,0]=4 40 B15R1.4074 COCCNC1=C(C(=O)NC(=O)N1)C#N MCULE-1496359121 [0,2,0,0,0,0|1,0,1]=4 41 B13R2.328 CC1=CC(=O)NC2=C1CCCC2 MCULE-9550041267 [1,0,0,1,0,0|2,0,0]=4 42 B13R2.328 CC1=NC2=C(CCCC2)C(=O)N1 MCULE-1800339049 [1,0,0,1,0,0|1,0,1]=4 43 B13R2.328 O=C1C=C(C2=C(N1)CCCC2)O MCULE-4062993823 [1,0,0,1,0,0|1,0,1]=4 44 B13R2.328 O=C1NC(=O)C2=C(N1)CCCC2 MCULE-9151971389 [1,0,0,1,0,0|0,0,0]=2 45 B13R2.328 O=C1NC(=O)C2=C(N1)CCNC2 MCULE-2815789898 [1,0,0,1,0,0|1,0,0]=3 46 B13R2.328 O=C1NC(=O)C2=C(N1)CCNC2 MCULE-7685054222 [1,0,0,1,0,0|1,0,0]=3 47 B13R2.328 O=C1NC(=O)C2=C(N1)CCOC2 MCULE-1218331162 [1,0,0,1,0,0|0,0,0]=2 48 B13R2.328 O=C1NC(=O)C2=C(N1)CNCC2 MCULE-4928549418 [1,0,0,1,0,0|1,0,0]=3 49 B13R2.328 O=C1NC(=O)C2=C(N1)CNCC2 MCULE-8260673017 [1,0,0,1,0,0|1,0,0]=3 50 B13R2.328 O=C1NC(=S)C2=C(N1)CCCC2 MCULE-4928737692 [1,0,0,1,0,0|0,1,0]=3 51 B13R2.328 O=C1NC(=S)NC2=C1CCCC2 MCULE-8949483335 [1,0,0,1,0,0|0,1,0]=3 52 B13R2.328 O=C1NC2=C(CCCC2)C(=O)O1 MCULE-7643480090 [1,0,0,1,0,0|1,0,0]=3 53 B13R2.5393 CC1=C2SCCN2C(=O)NC1=O MCULE-3209013455 [1,0,0,1,0,0|1,0,0]=3 54 B13R2.5393 CN1C(=O)NC(=O)C2=C1CCC2 MCULE-5195405167 [1,0,0,1,0,0|2,0,0]=4 55 B13R2.4023 O=C1OC(=O)C2=C1CCCCC2 MCULE-9616259526 [0,0,0,1,1,0|2,0,0]=4 56 B15R2.6124 N#CC1=C2CCCCN2C(=O)NC1=O MCULE-8184313040 [0,1,0,1,0,0|1,0,1]=4 57 B11R1.598 CCCN1C(=O)NC(=O)C1=O MCULE-1291887289 [1,0,0,0,1,0|2,0,0]=4 58 B11R1.230 CCCCC1=C(NC(=O)N1)C MCULE-3662387750 [1,0,0,0,1,0|2,0,0]=4 59 B11R1.230 CCCCC1NC(=O)NC1=O MCULE-4511804745 [1,0,0,0,1,0|1,0,1]=4 60 B11R1.230 O=C1CN(C(=O)N1)CCCO MCULE-5023828736 [1,0,0,0,1,0|1,0,1]=4 61 B11R1.465 CCCCC1=C(NC=C1C)C MCULE-5947298894 [1,0,0,0,1,0|2,0,0]=4 62 B13R1.1601 CC1=C(C(=O)NC(=O)N1)NCCCl MCULE-6737112308 [0,0,0,0,1,1|2,0,0]=4 63 B13R1.1601 CC1=C(C(=O)NC(=S)N1)CCCO MCULE-5904743327 [0,0,0,0,1,1|0,1,0]=3