0 B10R0.74 CCCCCCCC(NN)=O AK117029 [0,0,0,0,0,0|2,0,2]=4 1 B10R0.74 CCCCCCCC(NO)=O AK-43792 [0,0,0,0,0,0|2,0,2]=4 2 B10R0.74 COC(CCCCCCBr)=O AK-29360 [0,0,0,0,0,0|2,0,2]=4 3 B10R0.74 O=C(OC)CCCCCCN AK-61182 [0,0,0,0,0,0|2,0,2]=4 4 B9R0.2 CCCCCCCB(O)O AK145619 [1,0,0,0,0,0|2,0,0]=3 5 B9R0.2 O=C(O)CCCCCCN AK-47536 [1,0,0,0,0,0|2,0,1]=4 6 B9R0.2 OC(=O)CCCCCCBr AK-28585 [1,0,0,0,0,0|2,0,1]=4 7 B9R0.2 OCCCCCCC(O)=O AK-29232 [1,0,0,0,0,0|2,0,1]=4 8 B9R0.45 BrCCCCCCCCBr AK-48263 [1,0,0,0,0,0|2,0,0]=3 9 B9R0.45 C#CCCCCCCCO AK117239 [1,0,0,0,0,0|1,0,2]=4 10 B9R0.45 C=CCCCCCCCBr AK161876 [1,0,0,0,0,0|1,0,2]=4 11 B9R0.45 C=CCCCCCCCCl AK164575 [1,0,0,0,0,0|1,0,2]=4 12 B9R0.45 CCCCCCCCCBr AK164444 [1,0,0,0,0,0|1,0,0]=2 13 B9R0.45 OCCCCCCCCBr AK113930 [1,0,0,0,0,0|2,0,0]=3 14 B9R0.46 CCC(C)CCCCCO AK-82137 [1,0,0,0,0,0|2,0,0]=3 15 B9R0.46 CCCCCCC(C)CO AK158822 [1,0,0,0,0,0|2,0,0]=3 16 B11R0.4 CCOC(=O)CCCCCCBr AK-68411 [0,1,0,0,0,0|1,0,2]=4 17 B11R0.4 O=C(OCC)CCCCCCN AK-41611 [0,1,0,0,0,0|1,0,2]=4 18 B11R0.42 CCCCCCCC(=O)N(C)C AK-87625 [0,1,0,0,0,0|1,0,2]=4 19 B11R0.42 CCCCCCC[C@H](N)C(O)=O AK-58077 [0,1,0,0,0,0|2,0,1]=4 20 B11R1.1 OC1CCN(CCCCl)CC1 AK126720 [0,0,0,1,0,0|2,0,0]=3 21 B11R1.1 OCCCC1CCN(C)CC1 AK135455 [0,0,0,1,0,0|3,0,0]=4 22 B11R1.27 O=C1OC(CCCCC)CC1 AK551064 [0,0,0,1,0,0|1,0,2]=4 23 B11R1.40 OC[C@@H](N)CC1CCCCC1 AK-57591 [0,0,0,1,0,0|2,0,0]=3 24 B8R0.4 BrCCCCCCCBr AK109234 [2,0,0,0,0,0|2,0,0]=4 25 B8R0.4 C(CCCCO)CCBr AK-41195 [2,0,0,0,0,0|1,0,0]=3 26 B8R0.4 OCCCCCCC#C AK-48557 [2,0,0,0,0,0|0,0,2]=4 27 B8R0.4 OCCCCCCCO AK-44723 [2,0,0,0,0,0|1,0,0]=3 28 B8R0.4 OCCCNCCCO AK-33226 [2,0,0,0,0,0|2,0,0]=4 29 B8R0.7 CC(O)CCCCCC AK113715 [2,0,0,0,0,0|0,0,0]=2 30 B8R0.7 C[C@@H](O)CCCCCC AK115983 [2,0,0,0,0,0|0,0,0]=2 31 B8R0.6 C=CC(O)CCCCC AK164470 [2,0,0,0,0,0|0,0,2]=4 32 B10R0.4 CCCCCCCCB(O)O AK-84208 [1,1,0,0,0,0|2,0,0]=4 33 B10R0.4 O=C(O)CCCCCCCBr AK-33752 [1,1,0,0,0,0|1,0,1]=4 34 B10R0.4 O=C(O)CCCCCCCN AK-45259 [1,1,0,0,0,0|1,0,1]=4 35 B10R0.75 CCCCCCC(N)C(O)=O AK-87750 [1,1,0,0,0,0|1,0,1]=4 36 B10R0.75 CCCCCC[C@H](N)C(O)=O AK-87751 [1,1,0,0,0,0|1,0,1]=4 37 B10R0.78 CCCCC(C)CCC(O)=O AK164469 [1,1,0,0,0,0|1,0,1]=4 38 B10R0.71 C(CCCCBr)CCCCBr AK-48264 [1,1,0,0,0,0|1,0,0]=3 39 B10R0.71 C=CCCCCCCCCBr AK-48406 [1,1,0,0,0,0|0,0,2]=4 40 B10R0.71 ClCCCCCCCCCCl AK-48518 [1,1,0,0,0,0|1,0,0]=3 41 B10R0.71 OCCCCCCCCCBr AK-77024 [1,1,0,0,0,0|1,0,0]=3 42 B10R0.71 OCCCCCCCCCO AK117066 [1,1,0,0,0,0|1,0,0]=3 43 B12R0.1 CCCCCCCCC(OCC)=O AK113976 [0,2,0,0,0,0|0,0,2]=4 44 B12R0.4 CCCCCCCC(O)CC(O)=O AK140664 [0,2,0,0,0,0|0,0,1]=3 45 B10R1.18 CC(N)CC1CCCCC1 AK-51120 [1,0,0,1,0,0|1,0,0]=3 46 B10R1.18 O=C(O)CC1CCCCC1 AK-41373 [1,0,0,1,0,0|1,0,1]=4 47 B10R1.18 OB(CC1CCCCC1)O AK-85394 [1,0,0,1,0,0|2,0,0]=4 48 B10R1.66 O=C(O)CCC1CCCC1 AK-45246 [1,0,0,1,0,0|1,0,1]=4 49 B10R1.348 O=C(O)C1CCCCCC1 AK-25427 [1,0,0,1,0,0|1,0,1]=4 50 B10R1.17 C(CCC)C1CCNCC1 AK-27060 [1,0,0,1,0,0|1,0,0]=3 51 B10R1.17 CCCCN1CCOCC1 AK-47686 [1,0,0,1,0,0|2,0,0]=4 52 B10R1.20 CNC1C(NC)CCCC1 AK-39338 [1,0,0,1,0,0|2,0,0]=4 53 B10R1.20 CNC1C(NC)CCCC1 AK-64638 [1,0,0,1,0,0|2,0,0]=4 54 B10R1.20 CN[C@H]1[C@H](NC)CCCC1 AK-41490 [1,0,0,1,0,0|2,0,0]=4 55 B10R1.20 CN[C@H]1[C@H](NC)CCCC1 AK-64322 [1,0,0,1,0,0|2,0,0]=4 56 B10R1.20 OCC1C(CO)CCCC1 AK342703 [1,0,0,1,0,0|2,0,0]=4 57 B10R1.20 OC[C@@H]1[C@@H](CO)CCCC1 AK134190 [1,0,0,1,0,0|2,0,0]=4 58 B10R1.20 OC[C@H]1[C@H](CO)CCCC1 AK-79086 [1,0,0,1,0,0|2,0,0]=4 59 B10R1.85 ClCCN1CCCCCC1 AK-81569 [1,0,0,1,0,0|2,0,0]=4 60 B10R1.1 NC1CCC(CCO)CC1 AK-68022 [1,0,0,1,0,0|2,0,0]=4 61 B10R1.1 O=C1CCC(CCC)CC1 AK-41694 [1,0,0,1,0,0|0,0,2]=4 62 B10R1.1 OC1CCN(CCN)CC1 AK-57286 [1,0,0,1,0,0|2,0,0]=4 63 B10R1.15 CC[C@@H](C1CCCCC1)N AK544253 [1,0,0,1,0,0|1,0,0]=3 64 B10R1.15 N[C@@H](C1CCCCC1)CO AK103603 [1,0,0,1,0,0|2,0,0]=4 65 B10R1.27 CC(NC)CC1CCCC1 AK140667 [1,0,0,1,0,0|2,0,0]=4 66 B12R1.1 COCCCN1CCC(N)CC1 AK102965 [0,1,0,1,0,0|2,0,0]=4 67 B12R1.1 N[C@H]1CC[C@H](OCCOC)CC1 AK440717 [0,1,0,1,0,0|2,0,0]=4 68 B12R1.1 OC1CCC(CCCCC)CC1 AK-88549 [0,1,0,1,0,0|0,0,0]=2 69 B12R1.16 O=C(C1CCC(O)CC1)OCC AK-45280 [0,1,0,1,0,0|1,0,1]=4 70 B12R1.16 O=C([C@H]1CC[C@H](O)CC1)OCC AK316366 [0,1,0,1,0,0|1,0,1]=4 71 B12R2.1175 OC1CCC2(CC1)OCCO2 AK-88544 [0,0,0,2,0,0|2,0,0]=4