0 B10R1.17 C#CCCC1CCCCC1 2709AL [1,0,0,0,0,0|1,0,1]=3 1 B10R1.17 CCOCC1CCNCC1 8768AD [1,0,0,0,0,0|3,0,0]=4 2 B10R1.17 CNCCC1CCCCO1 4410AJ [1,0,0,0,0,0|1,0,0]=2 3 B10R1.17 COCCC1CCCNC1 4077AF [1,0,0,0,0,0|2,0,0]=3 4 B10R1.17 CSCCN1CCNCC1 5776AE [1,0,0,0,0,0|3,0,0]=4 5 B10R1.17 NCCCC1CCCNC1 2033AJ [1,0,0,0,0,0|3,0,0]=4 6 B10R1.17 NCCSC1CCCCC1 7883AE [1,0,0,0,0,0|3,0,0]=4 7 B10R1.17 OCCCC1CCCNC1 1979AB [1,0,0,0,0,0|3,0,0]=4 8 B10R1.17 OCCOC1CCCCC1 5273AJ [1,0,0,0,0,0|3,0,0]=4 9 B10R1.18 CC(C)CC1CNCCN1 W8832 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.18 CC(C)CC1CNCCO1 5678AC [1,0,0,0,0,0|2,0,0]=3 11 B10R1.18 CC(C)CN1CCNCC1 W5487 [1,0,0,0,0,0|2,0,0]=3 12 B10R1.18 CC(C)C[C@@H]1CNCCN1 W8809 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.18 CC(C)C[C@@H]1CNCCO1 1601AC [1,0,0,0,0,0|2,0,0]=3 14 B10R1.18 CC(C)C[C@H]1CNCCN1 4557AA [1,0,0,0,0,0|2,0,0]=3 15 B10R1.18 CC(C)C[C@H]1CNCCO1 5431AA [1,0,0,0,0,0|2,0,0]=3 16 B10R1.18 CC(C)NC1CCNCC1 7608AB [1,0,0,0,0,0|2,0,0]=3 17 B10R1.18 CC(N)CC1CCCCC1 7941AB [1,0,0,0,0,0|0,0,0]=1 18 B10R1.18 CC(N)CC1CCCCC1 7946AB [1,0,0,0,0,0|0,0,0]=1 19 B10R1.18 CN(C)CC1CCCCC1 3680AL [1,0,0,0,0,0|1,0,0]=2 20 B10R1.18 CN(C)CC1CCCCN1 0544AD [1,0,0,0,0,0|2,0,0]=3 21 B10R1.18 CN(C)CC1CCNCC1 5540AD [1,0,0,0,0,0|2,0,0]=3 22 B10R1.18 CN(C)C[C@H]1CNCCO1 0895AB [1,0,0,0,0,0|3,0,0]=4 23 B12R1.49 COC(=O)CC1CCC(N)CC1 3376AB [0,1,0,0,0,0|2,0,1]=4 24 B12R1.118 CCN(CC)CC1CCCNC1 1018AD [0,1,0,0,0,0|3,0,0]=4 25 B12R2.2058 C1CC(CN2CCNCC2)C1 3969AC [0,0,0,1,0,0|3,0,0]=4 26 B12R2.2058 C1CC(NC2CCOCC2)C1 6565AH [0,0,0,1,0,0|3,0,0]=4 27 B12R2.3511 COC(=O)C1C2CCCCC21 1737AE [0,0,0,1,0,0|2,0,1]=4 28 B10R1.15 C#CC(O)C1CCCCC1 Y6226 [0,0,0,0,1,0|2,0,1]=4 29 B10R1.15 CCC(C)N1CCNCC1 3345AE [0,0,0,0,1,0|3,0,0]=4 30 B10R1.15 NCC(O)C1CCCCC1 9382AJ [0,0,0,0,1,0|3,0,0]=4 31 B9R0.18 CCCCC(C)CCCC 6803AL [1,0,1,0,0,0|1,0,0]=3 32 B9R0.46 CCCCCCC(C)CC 6115AL [1,0,1,0,0,0|1,0,0]=3 33 B9R0.46 CC[C@H](C)CCCCCO 4206AL [1,0,1,0,0,0|2,0,0]=4 34 B9R0.45 CCCCCCCCCCl 8135AF [1,0,1,0,0,0|2,0,0]=4 35 B9R0.45 CCCCCCCCCS Q791 [1,0,1,0,0,0|2,0,0]=4 36 B9R0.45 C\C=C/CCCCCCC 7421AL [1,0,1,0,0,0|1,0,1]=4 37 B9R1.8 BrCCC1CCCCN1 8894AE [2,0,0,0,0,0|2,0,0]=4 38 B9R1.8 NNCC1CCCCC1 3969AJ [2,0,0,0,0,0|1,0,0]=3 39 B9R1.8 NNCC1CCOCC1 4616AC [2,0,0,0,0,0|2,0,0]=4 40 B11R0.136 CCCC(CC)CC(CC)CO 2509AC [0,1,1,0,0,0|1,0,0]=3 41 B11R1.1 CNCCN1CCN(C)CC1 4409AJ [1,1,0,0,0,0|2,0,0]=4 42 B11R1.28 CCOCCC1CCCCN1 0293AD [1,1,0,0,0,0|2,0,0]=4 43 B11R1.28 CCOCCC1CCNCC1 0378AD [1,1,0,0,0,0|2,0,0]=4 44 B11R1.28 NCCCCC1CCCCC1 2802AJ [1,1,0,0,0,0|1,0,0]=3 45 B11R1.28 OCCCCC1CCCNC1 5961AJ [1,1,0,0,0,0|2,0,0]=4 46 B11R1.28 OCCCCC1CCNCC1 0254AB [1,1,0,0,0,0|2,0,0]=4 47 B11R1.28 OCCCCN1CCCCC1 6389AB [1,1,0,0,0,0|2,0,0]=4 48 B11R1.91 CC(N)CCN1CCCCC1 5546AA [1,1,0,0,0,0|2,0,0]=4 49 B11R1.20 CC(C)NC1CCN(C)CC1 Z2328 [1,1,0,0,0,0|2,0,0]=4 50 B11R1.12 CCC(CN)N1CCCCC1 0845AF [0,1,0,0,1,0|2,0,0]=4 51 B13R1.417 COC(CNC1CCCCC1)OC 7014AC [0,1,0,0,0,1|1,0,0]=3 52 B11R2.20 C1COC2CCNCC2C1 7309AJ [1,0,0,1,0,0|1,0,0]=3 53 B11R2.20 [C@@H]12CCCCN1CCNC2 9231AH [1,0,0,1,0,0|1,0,0]=3 54 B11R2.20 [C@H]12CNCCN1CCOC2 9051AH [1,0,0,1,0,0|2,0,0]=4 55 B11R2.239 C1CC(C2CNC2)CCO1 5464AE [1,0,0,1,0,0|1,0,0]=3 56 B11R2.239 C1CCN(C2CNC2)CC1 6644AA [1,0,0,1,0,0|1,0,0]=3 57 B11R2.1037 C1CCC2CCCC(C1)N2 9098AD [1,0,0,1,0,0|2,0,0]=4 58 B11R2.1261 C1CC2(CCN1)CCNC2 2602AA [1,0,0,1,0,0|1,0,0]=3 59 B11R2.1261 C1CCC2(CCCC2)NC1 3430AJ [1,0,0,1,0,0|2,0,0]=4 60 B11R2.1261 C1CNCC2(C1)CCNC2 5579AB [1,0,0,1,0,0|1,0,0]=3 61 B11R2.10 CN1CC2CCNCC2C1 4418AC [1,0,0,1,0,0|2,0,0]=4 62 B11R2.508 CC1(O)CC2CCC1CC2 2117AB [1,0,0,1,0,0|1,0,0]=3 63 B11R2.678 OC1CC2CCCC(C1)N2 2405AB [1,0,0,1,0,0|2,0,0]=4 64 B11R2.703 CN1CC2(CCNCC2)C1 5805AC [1,0,0,1,0,0|2,0,0]=4 65 B13R2.32 [C@H]12CCCC[C@@H]1N(C)C(=O)CO2 5796AD [0,0,0,1,0,1|1,0,1]=4 66 B13R2.11462 CC1(C)CC2(CCNCC2)CO1 2061AJ [0,1,0,1,0,0|2,0,0]=4 67 B9R1.12 CNCCC1OCCO1 5054AL [1,0,0,0,1,0|2,0,0]=4 68 B9R1.12 COCCC1CCCN1 3594AF [1,0,0,0,1,0|2,0,0]=4 69 B9R1.6 CC(C)[C@@H]1CNCCN1 4020AA [1,0,0,0,1,0|2,0,0]=4 70 B9R1.6 CC(C)[C@H]1CNCCN1 X9850 [1,0,0,0,1,0|2,0,0]=4 71 B9R1.6 CN(C)[C@@H]1CCCNC1 Z2127 [1,0,0,0,1,0|2,0,0]=4 72 B9R1.6 CN(C)[C@H]1CCCNC1 Z2163 [1,0,0,0,1,0|2,0,0]=4 73 B9R1.13 CC(C)OC1CCNC1 2309AJ [1,0,0,0,1,0|2,0,0]=4 74 B9R1.13 CC(C)O[C@H]1CCNC1 9170AH [1,0,0,0,1,0|2,0,0]=4 75 B9R1.13 CN(C)C[C@@H]1CCCN1 9550AC [1,0,0,0,1,0|2,0,0]=4