0 B8R0.7 C#CCCCCC(=O)O ACT09524 [0,0,0,0,0,0|1,0,3]=4 1 B7R0.1 C#CCCCCCO ACT09966 [1,0,0,0,0,0|0,0,2]=3 2 B7R0.1 C(CCCO)CCN ACT05269 [1,0,0,0,0,0|1,0,0]=2 3 B7R0.1 C(CCCS)CCS ACT06276 [1,0,0,0,0,0|1,1,0]=3 4 B7R0.1 CCCSSCCC ACT06139 [1,0,0,0,0,0|2,0,0]=3 5 B7R0.4 C(CCN)CC(=O)O ACT10888 [1,0,0,0,0,0|2,0,1]=4 6 B7R0.4 CC(=O)CCCCBr ACT03439 [1,0,0,0,0,0|1,0,2]=4 7 B9R0.47 C(CCN)C[C@@H](C(=O)O)N ACT11895 [0,1,0,0,0,0|2,0,1]=4 8 B9R1.2 CN1CCCC(C1)CO ACT04179 [0,0,0,1,0,0|3,0,0]=4 9 B9R1.6 C1CC(CNC1)C(=O)O ACT02108 [0,0,0,1,0,0|2,0,1]=4 10 B9R1.6 C1CCNC(C1)C(=O)O ACT04791 [0,0,0,1,0,0|2,0,1]=4 11 B9R1.6 C1CCNC(C1)C(=O)O ACT09684 [0,0,0,1,0,0|2,0,1]=4 12 B9R1.6 C1CCN[C@@H](C1)C(=O)O ACT07825 [0,0,0,1,0,0|2,0,1]=4 13 B9R1.6 C1CCN[C@@H](C1)C(=O)O ACT12035 [0,0,0,1,0,0|2,0,1]=4 14 B9R1.6 C1CCN[C@H](C1)C(=O)O ACT07350 [0,0,0,1,0,0|2,0,1]=4 15 B9R1.6 C1CNCCC1C(=O)O ACT02073 [0,0,0,1,0,0|2,0,1]=4 16 B9R1.6 C1COCCC1C(=O)O ACT04577 [0,0,0,1,0,0|2,0,1]=4 17 B9R1.6 C1C[C@@H](CNC1)C(=O)O ACT05132 [0,0,0,1,0,0|2,0,1]=4 18 B9R1.6 C1C[C@H](CNC1)C(=O)O ACT11798 [0,0,0,1,0,0|2,0,1]=4 19 B9R1.6 CC(=O)C1CCOCC1 ACT08411 [0,0,0,1,0,0|1,0,2]=4 20 B9R1.6 CC(C)N1CCNCC1 ACT02167 [0,0,0,1,0,0|3,0,0]=4 21 B9R1.6 CN(C)C1CCNCC1 ACT09758 [0,0,0,1,0,0|3,0,0]=4 22 B6R0.6 C=CCCCCO ACT10087 [2,0,0,0,0,0|0,0,2]=4 23 B6R0.6 CNCCCNC ACT10138 [2,0,0,0,0,0|2,0,0]=4 24 B8R0.4 CCCSSSCCC ACT06147 [1,1,0,0,0,0|2,0,0]=4 25 B8R0.6 C(CCN)C[C@@H](CO)N ACT07913 [1,1,0,0,0,0|1,0,0]=3 26 B8R0.6 CCCCCC(C#C)O ACT10370 [1,1,0,0,0,0|0,0,2]=4 27 B8R0.6 CCCCCC(C=C)O ACT05316 [1,1,0,0,0,0|0,0,2]=4 28 B8R0.6 CCCCCC(CC)O ACT06057 [1,1,0,0,0,0|0,0,0]=2 29 B8R0.8 CCCCC(C(=O)O)Br ACT02064 [1,1,0,0,0,0|1,0,1]=4 30 B10R0.4 C(CCCC(=O)O)CCCBr ACT04715 [0,2,0,0,0,0|1,0,1]=4 31 B8R1.2 C1CC(CNC1)CO ACT04176 [1,0,0,1,0,0|1,0,0]=3 32 B8R1.2 C1CCC(CC1)CO ACT10090 [1,0,0,1,0,0|0,0,0]=2 33 B8R1.2 C1CCNC(C1)CO ACT02103 [1,0,0,1,0,0|1,0,0]=3 34 B8R1.2 C1CCN[C@@H](C1)CO ACT09705 [1,0,0,1,0,0|1,0,0]=3 35 B8R1.2 C1CCN[C@H](C1)CO ACT09534 [1,0,0,1,0,0|1,0,0]=3 36 B8R1.2 C1CNCCC1CO ACT02060 [1,0,0,1,0,0|1,0,0]=3 37 B8R1.2 C1COCC(N1)CO ACT07199 [1,0,0,1,0,0|2,0,0]=4 38 B8R1.2 C1COCCC1CN ACT01866 [1,0,0,1,0,0|2,0,0]=4 39 B8R1.2 C1COCCC1CO ACT04637 [1,0,0,1,0,0|1,0,0]=3 40 B8R1.2 CNC1CCOCC1 ACT10530 [1,0,0,1,0,0|2,0,0]=4 41 B8R1.5 C1CCC(C(C1)N)N ACT11641 [1,0,0,1,0,0|2,0,0]=4 42 B8R1.5 C1CC[C@@H]([C@H](C1)N)N ACT02838 [1,0,0,1,0,0|2,0,0]=4 43 B8R1.5 C1CC[C@H]([C@@H](C1)N)N ACT03415 [1,0,0,1,0,0|2,0,0]=4 44 B8R1.5 C1CC[C@H]([C@@H](C1)N)N ACT11629 [1,0,0,1,0,0|2,0,0]=4 45 B8R1.5 C1CC[C@H]([C@@H](C1)N)N ACT11642 [1,0,0,1,0,0|2,0,0]=4 46 B8R1.8 C1CC(NC1)CCO ACT09194 [1,0,0,1,0,0|1,0,0]=3 47 B8R1.11 CN1CCCC1CO ACT09599 [1,0,0,1,0,0|1,0,0]=3 48 B8R1.11 CN1CCC[C@@H]1CO ACT10747 [1,0,0,1,0,0|1,0,0]=3 49 B8R1.11 CN1CCC[C@H]1CO ACT09566 [1,0,0,1,0,0|1,0,0]=3 50 B8R1.22 C1CCNCC(C1)N ACT07491 [1,0,0,1,0,0|2,0,0]=4 51 B8R1.22 CN1CCCNCC1 ACT09728 [1,0,0,1,0,0|2,0,0]=4 52 B8R1.1 CCN1CCC(C1)O ACT03468 [1,0,0,1,0,0|1,0,0]=3 53 B8R1.72 CC1(CCCCC1)O ACT11541 [1,0,0,1,0,0|0,0,0]=2 54 B10R1.13 C1[C@@H](CC[C@@H](C1)N)C(=O)O ACT11996 [0,1,0,1,0,0|1,0,1]=4 55 B10R1.13 C1[C@@H](CC[C@H](C1)N)C(=O)O ACT02784 [0,1,0,1,0,0|1,0,1]=4 56 B10R1.13 CC(C)N1CCC(CC1)O ACT11105 [0,1,0,1,0,0|2,0,0]=4 57 B10R1.18 C1COCCC1CC(=O)O ACT01894 [0,1,0,1,0,0|1,0,1]=4 58 B10R1.1 CCCC1CCC(=O)CC1 ACT05145 [0,1,0,1,0,0|0,0,2]=4 59 B10R2.2 C1CC2CN(CC2C1)N ACT11108 [0,0,0,2,0,0|2,0,0]=4