0 B8R0.28 C=C(C)CCCC(C)C CS-0205146 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.28 CC(=O)NCCC(C)C CS-0334392 [0,0,0,0,0,0|1,0,2]=3 2 B8R0.28 CC(C)=CCNC(=N)N CS-0084779 [0,0,0,0,0,0|3,0,0]=3 3 B7R0.4 CC#CCOC(C)=O CS-0700398 [1,0,0,0,0,0|0,1,2]=4 4 B7R0.4 CC(=O)SCCC#N CS-0936110 [1,0,0,0,0,0|1,0,2]=4 5 B7R0.4 CCCCSC(C)=O CS-0330240 [1,0,0,0,0,0|0,0,2]=3 6 B7R0.4 CCOCCC(C)=O CS-0622377 [1,0,0,0,0,0|2,0,1]=4 7 B7R0.4 CNCCNC(C)=O CS-0506953 [1,0,0,0,0,0|2,0,1]=4 8 B7R0.4 C\C=C\C=C\C(C)=O CS-0622142 [1,0,0,0,0,0|1,0,1]=3 9 B9R0.7 CC(=O)CCC(=O)C(C)C CS-0262045 [0,1,0,0,0,0|1,0,1]=3 10 B9R0.7 CC(=O)SC[C@H](N)C(=O)O CS-0914560 [0,1,0,0,0,0|2,0,1]=4 11 B9R0.7 CC(C)=CCC(N)C(=O)O CS-0216156 [0,1,0,0,0,0|2,0,0]=3 12 B9R0.7 CC(C)=CC[C@@H](N)C(=O)O CS-0505173 [0,1,0,0,0,0|2,0,0]=3 13 B9R0.7 CC(C)=CC[C@H](N)C(=O)O CS-0468261 [0,1,0,0,0,0|2,0,0]=3 14 B9R1.35 CC(=O)C1=CSC(C)=C1 CS-0262638 [0,0,0,1,0,0|2,0,1]=4 15 B9R1.35 CC(C)C1CCC(=O)C1 CS-0564316 [0,0,0,1,0,0|1,0,2]=4 16 B9R1.35 CC(C)N1CCC(=O)C1 CS-0718203 [0,0,0,1,0,0|2,0,1]=4 17 B9R1.49 CN1CCNC(=O)CC1 CS-W003571 [0,0,0,1,0,0|2,0,1]=4 18 B9R1.49 O=C1CCNC(=O)CC1 CS-0215332 [0,0,0,1,0,0|2,0,1]=4 19 B9R1.53 CC(=O)CC1CC(=O)N1 CS-0726191 [0,0,0,1,0,0|2,0,1]=4 20 B7R0.6 C=C(C)CCC(N)=O CS-0667691 [0,0,0,0,1,0|1,0,2]=4 21 B7R0.6 C=C(Cl)CSC(C)=O CS-0208779 [0,0,0,0,1,0|1,0,1]=3 22 B7R0.6 CC(=O)CCN(C)C CS-0044371 [0,0,0,0,1,0|1,0,1]=3 23 B7R0.6 CC(=O)COC(C)C CS-0258624 [0,0,0,0,1,0|1,0,1]=3 24 B7R0.6 CC(=O)OCC(C)O CS-0505133 [0,0,0,0,1,0|1,1,1]=4 25 B7R0.6 CC(=O)\C=C\N(C)C CS-0356797 [0,0,0,0,1,0|1,0,1]=3 26 B7R0.6 CC(C)=CCC(=O)O CS-0453086 [0,0,0,0,1,0|1,0,0]=2 27 B7R0.6 CC(C)CCC(N)=O CS-0850663 [0,0,0,0,1,0|1,0,2]=4 28 B7R0.6 CC(C)NCC(=O)O CS-0274531 [0,0,0,0,1,0|2,0,1]=4 29 B7R0.6 CC(C)SCC(=O)O CS-0216007 [0,0,0,0,1,0|2,0,1]=4 30 B7R0.6 CN(C)CCC(N)=O CS-0683253 [0,0,0,0,1,0|2,0,1]=4 31 B9R0.55 CC(=O)CCCCC(C)=O CS-0698151 [0,0,0,0,0,1|2,0,1]=4 32 B9R0.55 CC(=O)CCOCC(C)C CS-0450930 [0,0,0,0,0,1|1,0,2]=4 33 B9R0.55 CC(=O)NCCCN(C)C CS-0333061 [0,0,0,0,0,1|2,0,1]=4 34 B9R0.55 CC(=O)NCCNC(C)=O CS-0313400 [0,0,0,0,0,1|2,0,1]=4 35 B9R0.55 CC(=O)NCCNC(C)C CS-0233597 [0,0,0,0,0,1|1,0,2]=4 36 B6R0.4 C=CCCC(N)=O CS-0524500 [2,0,0,0,0,0|2,0,0]=4 37 B6R0.4 C=CCNC(C)=O CS-0224602 [2,0,0,0,0,0|1,0,0]=3 38 B6R0.4 CC(=O)SCC#N CS-0110092 [2,0,0,0,0,0|1,0,1]=4 39 B6R0.4 CNCCC(C)=O CS-0119661 [2,0,0,0,0,0|1,0,1]=4 40 B6R0.4 COCCC(C)=O CS-0250048 [2,0,0,0,0,0|1,0,1]=4 41 B8R0.7 CC(=O)SCCCCN CS-0509949 [1,1,0,0,0,0|0,0,2]=4 42 B8R0.9 CCC(=O)CCC(C)=O CS-0211119 [1,1,0,0,0,0|1,0,1]=4 43 B8R0.9 CCC(=O)COC(C)=O CS-0359350 [1,1,0,0,0,0|0,1,1]=4 44 B8R0.23 CC(=O)C(=O)CC(C)C CS-W011132 [0,1,0,0,1,0|1,0,1]=4 45 B8R0.23 CC(=O)CC(=O)N(C)C CS-0155066 [0,1,0,0,1,0|1,0,0]=3 46 B8R0.23 CC(=O)CC(O)C(C)=O CS-0615715 [0,1,0,0,1,0|1,0,1]=4 47 B8R0.23 CC(=O)\C=C(/C)N(C)C CS-0698969 [0,1,0,0,1,0|1,0,1]=4 48 B8R0.23 CN(C)C(=O)CC(=O)O CS-0264633 [0,1,0,0,1,0|2,0,0]=4 49 B8R0.29 CC(=O)CCC(C)(C)C CS-0446419 [0,1,0,0,1,0|0,0,2]=4 50 B8R0.29 CC(=O)CCC(C)(C)O CS-0242570 [0,1,0,0,1,0|0,0,2]=4 51 B10R0.98 CC(=O)SCCC(=O)N(C)C CS-0974378 [0,1,0,0,0,1|1,0,0]=3 52 B10R0.3 C=C\C=C(/C)CCC=C(C)C CS-0224691 [0,2,0,0,0,0|2,0,0]=4 53 B10R0.57 C=C(COC(C)=O)C(=O)OC CS-0132287 [0,2,0,0,0,0|1,1,0]=4 54 B10R0.43 CC(C)=CCC(C)(C)C(=O)O CS-0959569 [0,2,0,0,0,0|2,0,0]=4 55 B10R0.84 C=C(C)C(CO)CC=C(C)C CS-0136076 [0,2,0,0,0,0|2,0,0]=4 56 B8R1.4 CC1=CCCC(=O)O1 CS-0264028 [1,0,0,1,0,0|2,0,0]=4 57 B8R1.34 CC(=O)SC1CNC1 CS-0055209 [1,0,0,1,0,0|1,0,1]=4 58 B8R1.3 C[C@@H]1CCC(=O)CN1 CS-0505934 [0,0,0,1,1,0|1,0,1]=4 59 B8R1.3 O=C1CCC(=O)OC1 CS-0504617 [0,0,0,1,1,0|1,1,0]=4 60 B8R1.23 CC(=O)N1CC(=O)C1 CS-0380562 [0,0,0,1,1,0|2,0,0]=4 61 B8R1.51 CC1(C)CC(=O)CO1 CS-0450890 [0,0,0,1,1,0|1,0,1]=4 62 B8R1.51 CC1(C)COC(=O)C1 CS-0309995 [0,0,0,1,1,0|0,1,1]=4 63 B10R1.54 CC(=O)O[C@H]1C=CC(=O)C1 CS-0053635 [0,0,0,1,0,1|1,1,0]=4 64 B10R1.13 CC(C)=C1CC=C(Br)CC1 CS-0211351 [0,1,0,1,0,0|2,0,0]=4 65 B6R0.2 C=C(C)CC(=O)O CS-0222727 [0,0,0,0,2,0|1,0,1]=4 66 B6R0.2 CC(=O)\C=C(/C)N CS-0970843 [0,0,0,0,2,0|1,0,0]=3 67 B6R0.2 CC(C)=CC(N)=O CS-0237253 [0,0,0,0,2,0|1,0,0]=3