0 B11R1.20 CC(=O)NC1CCC(=O)CC1 CS14069 [0,0,0,0,0,0|0,0,0]=0 1 B11R1.20 CN1CCC(CC(N)=O)CC1 MC429698 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.1 CCCC1CCC(=O)OC1 MC440473 [1,0,0,0,0,0|2,0,1]=4 3 B10R1.1 CN1CCC(CC=O)CC1 MC431131 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.18 O=C(O)CC1CCCCC1 CS10565 [1,0,0,0,0,0|2,0,1]=4 5 B10R1.18 O=C(O)CC1CCNCC1 CS10136 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.18 O=C(O)CC1CCOCC1 CS19613 [1,0,0,0,0,0|3,0,0]=4 7 B12R1.49 COC(=O)CC1CCC(=O)CC1 MC425454 [0,1,0,0,0,0|1,0,0]=2 8 B10R0.55 COC(=O)CCCCC(=O)O CS19614 [0,0,1,0,0,0|3,0,0]=4 9 B10R1.13 CC(=O)C1CC=C(C)CC1 CS14813 [0,0,0,0,1,0|1,0,1]=3 10 B10R1.13 CC(=O)N1CCC(N)CC1 CS13776 [0,0,0,0,1,0|2,0,1]=4 11 B10R1.13 CC(=O)N1CCC(N)CC1 CS20412 [0,0,0,0,1,0|2,0,1]=4 12 B10R1.13 CN(C)C1CCC(=O)CC1 MC429047 [0,0,0,0,1,0|2,0,0]=3 13 B10R1.13 NC1CCC(C(=O)O)CC1 CS12037 [0,0,0,0,1,0|2,0,1]=4 14 B10R1.13 NC1CCC(C(=O)O)CC1 CS14216 [0,0,0,0,1,0|2,0,1]=4 15 B10R1.13 NC1CCC(C(=O)O)CC1 CS14217 [0,0,0,0,1,0|2,0,1]=4 16 B10R1.13 O=C(O)C1CCC(O)CC1 MC428316 [0,0,0,0,1,0|1,0,2]=4 17 B10R1.13 O=C1CCC(C(=O)O)CC1 MC425116 [0,0,0,0,1,0|1,0,0]=2 18 B10R1.13 O=C1CCC(C(=O)O)CN1 MC444434 [0,0,0,0,1,0|2,0,0]=3 19 B10R1.13 O=C1CNC(C(=O)O)CN1 CS17718 [0,0,0,0,1,0|3,0,0]=4 20 B9R1.1 CNC1CCC(=O)CC1 CS14610 [2,0,0,0,0,0|0,0,0]=2 21 B9R1.1 CNC1CCC(O)CC1 MC103812 [2,0,0,0,0,0|0,0,2]=4 22 B9R1.1 CNC1CCN(C)CC1 CS18451 [2,0,0,0,0,0|2,0,0]=4 23 B9R1.1 COC1CCC(=O)CC1 CS14437 [2,0,0,0,0,0|1,0,0]=3 24 B9R1.1 N#CC1CCC(=O)CC1 CS13355 [2,0,0,0,0,0|1,0,1]=4 25 B9R1.1 O=CC1CCC(=O)CC1 MC112097 [2,0,0,0,0,0|0,0,0]=2 26 B9R1.8 CCNC1CCCCC1 CS11778 [2,0,0,0,0,0|0,0,2]=4 27 B11R0.176 CCOC(=O)CCCCC(N)=O MC428169 [0,1,1,0,0,0|2,0,0]=4 28 B11R1.1 CCCOC1CCC(=O)CC1 CS17706 [1,1,0,0,0,0|1,0,1]=4 29 B11R1.22 COC(=O)C1CCC(=O)CC1 CS15890 [1,1,0,0,0,0|2,0,0]=4 30 B11R1.36 CC(=O)N(C)C1CCCNC1 MC104146 [1,1,0,0,0,0|1,0,1]=4 31 B11R1.36 CC(=O)N(C)C1CCCNC1 MC105309 [1,1,0,0,0,0|1,0,1]=4 32 B11R1.509 CS(=O)(=O)NC1CCNCC1 MC443242 [1,1,0,0,0,0|2,0,0]=4 33 B11R1.19 CS(=O)(=O)N1CCC(=O)CC1 MC425704 [0,1,0,0,1,0|2,0,0]=4 34 B11R1.727 O=C(Cl)C1CCS(=O)(=O)CC1 MC106034 [0,1,0,0,1,0|2,0,0]=4 35 B13R1.19 CCNC(=O)NC1CCC(O)CC1 MC100022 [0,2,0,0,0,0|0,0,2]=4 36 B13R1.19 CCOC(=O)CC1CCC(=O)CC1 MC425464 [0,2,0,0,0,0|1,0,0]=3 37 B13R1.19 CCOC(=O)NC1CCC(O)CC1 MC100023 [0,2,0,0,0,0|0,0,2]=4 38 B11R2.34 O=C1CCC(C2CC2)CC1 MC105704 [1,0,0,1,0,0|1,0,1]=4 39 B11R2.742 O=C1CCC2(CC1)COC2 MC102492 [1,0,0,1,0,0|2,0,0]=4 40 B11R2.703 O=C1CC2(CCNCC2)C1 MC116354 [1,0,0,1,0,0|2,0,0]=4 41 B11R2.139 O=C1CC2CC(=O)CC2C1 CS12011 [0,0,0,1,1,0|1,0,0]=3 42 B13R2.5120 O=C1CCC2(CC1)CCC(=O)N2 MC444079 [0,0,0,1,0,1|2,0,0]=4 43 B13R2.5120 O=C1CCC2(CC1)CNC(=O)C2 MC104325 [0,0,0,1,0,1|0,0,0]=2 44 B9R1.6 CC(=O)C1CC=CCC1 MC430669 [1,0,0,0,1,0|0,0,1]=3 45 B9R1.6 CC(=O)C1CCOCC1 CS13055 [1,0,0,0,1,0|1,0,0]=3 46 B9R1.6 CC(=O)N1CCNCC1 CS18512 [1,0,0,0,1,0|2,0,0]=4 47 B9R1.6 NC(=O)C1CCNCC1 CS22309 [1,0,0,0,1,0|2,0,0]=4 48 B9R1.6 O=C(O)C1CC=CCC1 MC20590 [1,0,0,0,1,0|1,0,1]=4 49 B9R1.6 O=C(O)C1CC=CCC1 MC20996 [1,0,0,0,1,0|1,0,1]=4 50 B9R1.6 O=C(O)C1CCCCC1 CS16426 [1,0,0,0,1,0|1,0,1]=4 51 B9R1.6 O=C(O)C1CCNCC1 CS15208 [1,0,0,0,1,0|2,0,0]=4 52 B9R1.6 O=C(O)C1CCNCC1 CS22807 [1,0,0,0,1,0|2,0,0]=4 53 B9R1.6 O=C(O)C1CCOCC1 CS18392 [1,0,0,0,1,0|2,0,0]=4 54 B9R1.13 O=C(Cl)OC1CCCC1 CS11187 [1,0,0,0,1,0|2,0,0]=4 55 B9R1.13 O=C(O)CC1CCCC1 MC112805 [1,0,0,0,1,0|2,0,0]=4 56 B9R1.35 O=C1CCC(C(=O)O)C1 CS19439 [0,0,0,0,2,0|1,0,0]=3 57 B9R1.35 O=C1CCC(C(=O)O)C1 MC105133 [0,0,0,0,2,0|1,0,0]=3 58 B9R1.35 O=C1CCC(C(=O)O)C1 MC105627 [0,0,0,0,2,0|1,0,0]=3 59 B9R1.35 O=C1CCC(C(=O)O)N1 CS22212 [0,0,0,0,2,0|2,0,0]=4 60 B9R1.35 O=C1CCC(C(=O)O)N1 MC438135 [0,0,0,0,2,0|2,0,0]=4 61 B9R1.35 O=C1CCC(C(=O)O)S1 MC103888 [0,0,0,0,2,0|2,0,0]=4 62 B9R1.53 CC(=O)NC1CC(N)C1 MC104659 [0,0,0,0,2,0|1,0,1]=4 63 B9R1.53 CC(=O)OC1CC(=O)N1 CS18165 [0,0,0,0,2,0|2,0,0]=4