0 B8R0.2 CCC(C)C(F)C(=O)O F2147-5574 [0,0,0,0,0,0|1,0,1]=2 1 B8R0.2 CCC(Cl)C(=O)N(C)C F8882-8758 [0,0,0,0,0,0|4,0,0]=4 2 B7R0.2 C#CC(C)CC(=O)O F1913-0982 [1,0,0,0,0,0|0,0,3]=4 3 B7R0.5 CCSC(F)C(=O)O F8884-4602 [1,0,0,0,0,0|2,0,1]=4 4 B7R0.5 NC(CCF)C(=O)O F1913-7468 [1,0,0,0,0,0|2,0,1]=4 5 B7R0.5 O=C(O)\C(Br)=C\CO F1913-6627 [1,0,0,0,0,0|2,0,1]=4 6 B7R0.5 O=C(O)\C(F)=C\CO F1913-6626 [1,0,0,0,0,0|2,0,1]=4 7 B7R0.10 CCC(C)C(F)CO F2147-5575 [1,0,0,0,0,0|1,0,2]=4 8 B7R0.16 CC(C)C(F)C(=O)O F8889-5916 [1,0,0,0,0,0|1,0,1]=3 9 B9R0.6 CCC\C(C)=C(/F)C(=O)O F1913-6647 [0,1,0,0,0,0|1,0,1]=3 10 B9R0.28 CCC(O)C(F)(F)C(=O)O F1913-1720 [0,1,0,0,0,0|2,0,1]=4 11 B9R1.41 CC1NCCC1C(=O)O F1913-1553 [0,0,0,1,0,0|2,0,1]=4 12 B9R1.110 O=C(O)C(F)C1CCC1 F2147-5897 [0,0,0,1,0,0|1,0,1]=3 13 B9R1.110 O=C(O)C(F)C1CNC1 F1913-0189 [0,0,0,1,0,0|2,0,1]=4 14 B9R1.110 O=C(O)C(F)C1COC1 F1913-0176 [0,0,0,1,0,0|2,0,1]=4 15 B6R0.4 O=C(O)\C=C\CF F0006-0316 [2,0,0,0,0,0|1,0,1]=4 16 B6R0.3 CCC(F)C(=O)O F2147-5487 [2,0,0,0,0,0|1,0,0]=3 17 B8R0.5 COCC(C)CC(=O)O F8881-0004 [1,1,0,0,0,0|0,0,1]=3 18 B8R0.23 CC(CC(=O)O)C(F)F F1913-1884 [1,1,0,0,0,0|1,0,1]=4 19 B8R0.8 COCCC(F)C(=O)O F2147-5761 [1,1,0,0,0,0|1,0,1]=4 20 B8R0.8 COCCC(N)C(=O)O F8887-3926 [1,1,0,0,0,0|1,0,1]=4 21 B8R0.8 CSC\C=C(/Br)C(=O)O F1913-6624 [1,1,0,0,0,0|1,0,1]=4 22 B8R0.8 CSC\C=C(/F)C(=O)O F1913-6625 [1,1,0,0,0,0|1,0,1]=4 23 B8R0.20 CCC(CC)C(=O)CCl F8880-2980 [1,1,0,0,0,0|1,0,1]=4 24 B8R0.18 COC(C(=O)O)C(C)C F8880-2353 [1,1,0,0,0,0|0,0,2]=4 25 B8R0.27 CC(C)(N)C(O)C(=O)O F1913-0556 [1,1,0,0,0,0|0,0,2]=4 26 B8R0.27 CC(C)(N)C(O)C(=O)O F8884-1396 [1,1,0,0,0,0|0,0,2]=4 27 B8R1.1 NCC1COC(=O)C1 F2147-1307 [1,0,0,1,0,0|1,0,1]=4 28 B8R1.1 NCC1COC(=O)O1 F1913-0465 [1,0,0,1,0,0|2,0,0]=4 29 B8R1.1 O=C1C=C(CO)CO1 F2147-2092 [1,0,0,1,0,0|1,0,1]=4 30 B8R1.1 O=C1CC(CO)CO1 F2147-2093 [1,0,0,1,0,0|1,0,1]=4 31 B8R1.4 O=C1C=C(I)CCO1 F2147-3524 [1,0,0,1,0,0|1,0,1]=4 32 B8R1.31 CC1CCC1C(=O)O F8880-6303 [1,0,0,1,0,0|0,0,1]=3 33 B8R1.34 O=C(O)CC1CSC1 F2147-4270 [1,0,0,1,0,0|1,0,1]=4 34 B8R1.42 NC1(CC(=O)O)CC1 F8881-5867 [1,0,0,1,0,0|1,0,1]=4 35 B8R1.7 O=C(O)C1=CCCO1 F8889-5190 [1,0,0,1,0,0|0,0,2]=4 36 B8R1.78 O=C(O)C1(F)CCC1 F1913-4938 [1,0,0,1,0,0|1,0,1]=4 37 B8R1.11 CCC1COCC1=O F2167-8875 [1,0,0,1,0,0|0,0,1]=3 38 B8R1.50 CN1CCC(O)C1=O F1905-0268 [1,0,0,1,0,0|1,0,1]=4 39 B10R1.25 CNC1CCC(=O)NC1=O F9994-0337 [0,0,0,1,0,1|2,0,0]=4 40 B10R1.25 CNC1CCC(=O)NC1=O F9994-0473 [0,0,0,1,0,1|2,0,0]=4 41 B10R1.204 NC(CC1CCC1)C(=O)O F8888-5303 [0,0,0,1,0,1|1,0,1]=4 42 B10R1.235 CCC1(C)CC(C(=O)O)C1 F1913-2589 [0,0,0,1,0,1|1,0,1]=4 43 B10R1.23 NC(C(=O)O)C1CCOC1 F8887-3946 [0,1,0,1,0,0|1,0,1]=4 44 B10R1.495 CC1(C(N)C(=O)O)CCC1 F2147-8779 [0,1,0,1,0,0|1,0,1]=4 45 B10R1.182 COC(=O)C(N)C1CCC1 F1913-3134 [0,1,0,1,0,0|1,0,1]=4 46 B10R1.182 COC(=O)C(N)C1CCC1 F8887-3419 [0,1,0,1,0,0|1,0,1]=4 47 B10R1.114 CC1CCOC(=O)C1(F)F F1913-7089 [0,1,0,1,0,0|1,0,1]=4 48 B10R1.39 CS[C@H]1CCN[C@@H]1C(=O)O F1913-7672 [0,1,0,1,0,0|1,0,1]=4 49 B10R1.229 CC1CCC1(C#N)C(=O)O F1913-6173 [0,1,0,1,0,0|1,0,1]=4 50 B10R1.128 CC1(C)CCCC1C(=O)O F2167-0029 [0,1,0,1,0,0|1,0,1]=4 51 B10R2.355 O=C(O)C1NCC2CC21 F2124-1142 [0,0,0,2,0,0|1,0,1]=4