0 B8R0.7 C#CCCCCC(=O)O ACT09524 [1,0,0,0,0,0|0,0,2]=3 1 B10R0.4 C(CCCC(=O)O)CCCBr ACT04715 [0,1,0,0,0,0|0,0,0]=1 2 B10R1.18 C1COCCC1CC(=O)O ACT01894 [0,0,0,1,0,0|1,0,0]=2 3 B10R1.61 C1COC[C@@H]([C@@H]1C(=O)O)N ACT07935 [0,0,0,1,0,0|2,0,0]=3 4 B10R1.66 CC(=O)OCC1CCCO1 ACT06570 [0,0,0,1,0,0|3,0,0]=4 5 B7R0.1 C#CCCCCCO ACT09966 [2,0,0,0,0,0|0,0,2]=4 6 B7R0.1 C(CCCO)CCN ACT05269 [2,0,0,0,0,0|1,0,0]=3 7 B7R0.1 C(CCCS)CCS ACT06276 [2,0,0,0,0,0|1,1,0]=4 8 B7R0.4 C(CCN)CC(=O)O ACT10888 [2,0,0,0,0,0|1,0,0]=3 9 B7R0.4 CC(=O)CCCCBr ACT03439 [2,0,0,0,0,0|2,0,0]=4 10 B9R0.45 CCCCCCCCC#C ACT10241 [1,1,0,0,0,0|1,0,1]=4 11 B9R0.47 C(CCN)C[C@@H](C(=O)O)N ACT11895 [1,1,0,0,0,0|1,0,0]=3 12 B9R0.55 C(CCC(=O)O)CC(=O)O ACT11881 [1,1,0,0,0,0|1,0,1]=4 13 B11R0.141 CCNC(=O)CC[C@@H](C(=O)O)N ACT11058 [0,2,0,0,0,0|1,0,1]=4 14 B11R0.30 CC(C)CCCCCCC(=O)O ACT08442 [0,2,0,0,0,0|0,0,0]=2 15 B11R0.30 CC(C)\C=C\CCCCC(=O)O ACT08431 [0,2,0,0,0,0|0,0,1]=3 16 B11R0.46 CCCCCN(C)CCC(=O)O ACT08502 [0,2,0,0,0,0|0,0,0]=2 17 B11R0.176 C(CCC(=O)O)CC(CCS)S ACT09741 [0,2,0,0,0,0|0,0,0]=2 18 B11R0.142 CCCCCCC(C(=O)OC)Br ACT02600 [0,2,0,0,0,0|0,0,0]=2 19 B9R1.5 C1CCNC(=O)C(C1)N ACT01818 [1,0,0,1,0,0|2,0,0]=4 20 B9R1.5 C1CCNC(=O)[C@H](C1)N ACT05209 [1,0,0,1,0,0|2,0,0]=4 21 B9R1.5 CN1CCCCCC1=O ACT05308 [1,0,0,1,0,0|1,0,0]=3 22 B9R1.8 C1CCN[C@@H](C1)CCO ACT02082 [1,0,0,1,0,0|1,0,1]=4 23 B9R1.8 C1COCCC1CCO ACT09747 [1,0,0,1,0,0|1,0,1]=4 24 B9R1.15 CN1CCCCC1CO ACT04178 [1,0,0,1,0,0|1,0,1]=4 25 B9R1.15 CN1CCCC[C@@H]1CO ACT10048 [1,0,0,1,0,0|1,0,1]=4 26 B9R1.15 CN1CCCC[C@H]1CO ACT08347 [1,0,0,1,0,0|1,0,1]=4 27 B9R1.15 COC1CCCNC1=O ACT04469 [1,0,0,1,0,0|2,0,0]=4 28 B9R1.6 C1CC(CC=C1)C(=O)O ACT12046 [1,0,0,1,0,0|0,0,2]=4 29 B9R1.6 C1CC(CNC1)C(=O)N ACT04813 [1,0,0,1,0,0|2,0,0]=4 30 B9R1.6 C1CC(CNC1)C(=O)O ACT02108 [1,0,0,1,0,0|1,0,0]=3 31 B9R1.6 C1CCNC(C1)C(=O)N ACT04811 [1,0,0,1,0,0|2,0,0]=4 32 B9R1.6 C1CCNC(C1)C(=O)O ACT04791 [1,0,0,1,0,0|1,0,0]=3 33 B9R1.6 C1CCNC(C1)C(=O)O ACT09684 [1,0,0,1,0,0|1,0,0]=3 34 B9R1.6 C1CCN[C@@H](C1)C(=O)O ACT07825 [1,0,0,1,0,0|1,0,0]=3 35 B9R1.6 C1CCN[C@@H](C1)C(=O)O ACT12035 [1,0,0,1,0,0|1,0,0]=3 36 B9R1.6 C1CCN[C@H](C1)C(=O)O ACT07350 [1,0,0,1,0,0|1,0,0]=3 37 B9R1.6 C1CNC(CN1)C(=O)O ACT02609 [1,0,0,1,0,0|2,0,0]=4 38 B9R1.6 C1CNC(CN1)C(=O)O ACT09465 [1,0,0,1,0,0|2,0,0]=4 39 B9R1.6 C1CNCCC1C(=O)N ACT04822 [1,0,0,1,0,0|2,0,0]=4 40 B9R1.6 C1CNCCC1C(=O)O ACT02073 [1,0,0,1,0,0|1,0,0]=3 41 B9R1.6 C1CN[C@@H](CN1)C(=O)O ACT02175 [1,0,0,1,0,0|2,0,0]=4 42 B9R1.6 C1CN[C@@H](CN1)C(=O)O ACT04805 [1,0,0,1,0,0|2,0,0]=4 43 B9R1.6 C1CN[C@H](CN1)C(=O)O ACT02151 [1,0,0,1,0,0|2,0,0]=4 44 B9R1.6 C1CN[C@H](CN1)C(=O)O ACT04806 [1,0,0,1,0,0|2,0,0]=4 45 B9R1.6 C1COCCC1C(=O)Cl ACT01885 [1,0,0,1,0,0|2,0,0]=4 46 B9R1.6 C1COCCC1C(=O)O ACT04577 [1,0,0,1,0,0|1,0,0]=3 47 B9R1.6 C1C[C@@H](CNC1)C(=O)O ACT05132 [1,0,0,1,0,0|1,0,0]=3 48 B9R1.6 C1C[C@H](CNC1)C(=O)O ACT11798 [1,0,0,1,0,0|1,0,0]=3 49 B9R1.6 CC(=O)C1CCOCC1 ACT08411 [1,0,0,1,0,0|2,0,0]=4 50 B11R1.565 C1CC(CCC(=O)C1)C(=O)O ACT10546 [0,1,0,1,0,0|0,0,1]=3 51 B11R1.40 COC(=O)CC1CCNCC1 ACT05231 [0,1,0,1,0,0|1,0,0]=3 52 B11R1.40 COC(=O)CC1CCNCC1 ACT05232 [0,1,0,1,0,0|1,0,0]=3 53 B11R1.178 CC(=O)N1CCC[C@H]1C(=O)O ACT08606 [0,1,0,1,0,0|1,0,1]=4 54 B11R2.1 C1CN2C(CN1)COC2=O ACT05206 [0,0,0,2,0,0|2,0,0]=4 55 B11R2.845 C1C2CC(C1C=C2)C(=O)O ACT11565 [0,0,0,2,0,0|0,0,2]=4