0 B9R1.3 CC1NCCN(C)C1=O 9620AH [1,0,0,0,0,0|2,0,0]=3 1 B9R1.3 CC1NCCN(C)C1=O 9621AH [1,0,0,0,0,0|2,0,0]=3 2 B9R1.3 CN1CCCC(N)C1=O 2119AJ [1,0,0,0,0,0|2,0,0]=3 3 B9R1.3 CN1CCC[C@H](N)C1=O 6486AC [1,0,0,0,0,0|2,0,0]=3 4 B9R1.40 CC1(C)CNCCC1=O 2067AJ [1,0,0,0,0,0|1,0,0]=2 5 B9R1.40 CC1(C)CNCCC1O W5828 [1,0,0,0,0,0|1,0,2]=4 6 B9R1.40 CC1(C)COCCC1=O 9422AB [1,0,0,0,0,0|1,0,0]=2 7 B9R1.40 CN1CCNCC1(C)C 3535AF [1,0,0,0,0,0|3,0,0]=4 8 B9R1.66 CC1(C)CC(N)CCO1 1321AJ [1,0,0,0,0,0|2,0,1]=4 9 B9R1.66 CC1(C)CC(N)CCO1 Z4507 [1,0,0,0,0,0|2,0,1]=4 10 B9R1.66 CN1CCNC(C)(C)C1 9607AH [1,0,0,0,0,0|2,0,1]=4 11 B9R0.1 CCC(C)CCCC(C)C 5421AL [0,0,1,0,0,0|1,0,1]=3 12 B9R0.6 CC(N)C(=O)N(C)CCO 2906AD [0,0,1,0,0,0|3,0,0]=4 13 B9R0.6 CCCC(C)C(=O)C(C)C 9737AA [0,0,1,0,0,0|0,0,0]=1 14 B8R0.28 CC(=O)CCCN(C)C Y9101 [1,0,1,0,0,0|1,0,1]=4 15 B8R0.28 CC(=O)CCOC(C)C 6552AL [1,0,1,0,0,0|1,0,1]=4 16 B8R0.28 CC(C)CSCC(C)C 8004AF [1,0,1,0,0,0|1,0,1]=4 17 B8R0.2 CCC(Br)C(=O)N(C)C 2371AE [1,0,1,0,0,0|2,0,0]=4 18 B8R0.2 CNC(C)C(=O)N(C)C 8368AE [1,0,1,0,0,0|2,0,0]=4 19 B8R0.3 CCCC(N)C(=O)NC 1487AF [1,0,1,0,0,0|2,0,0]=4 20 B8R0.3 CNCC(C)C(=O)OC Z2743 [1,0,1,0,0,0|2,0,0]=4 21 B8R0.5 CCCC(C)CC(C)C 5321AL [1,0,1,0,0,0|0,0,1]=3 22 B8R0.8 CCCCC(=O)C(C)=O 5249AL [1,0,1,0,0,0|1,0,1]=4 23 B8R0.8 CCCCC(=O)C(C)C 5543AA [1,0,1,0,0,0|0,0,0]=2 24 B8R0.8 CCCCC(C)C(C)C 5236AL [1,0,1,0,0,0|1,0,1]=4 25 B8R0.8 CCCOC(=O)[C@H](C)O 7652AB [1,0,1,0,0,0|2,0,0]=4 26 B8R0.8 CN(C)C(=O)CCCCl 7775AD [1,0,1,0,0,0|2,0,0]=4 27 B8R0.25 CC(C)(C=O)CCC#N 9204AB [1,0,1,0,0,0|1,0,1]=4 28 B8R0.25 CCCCC(C)(C)CC 5875AL [1,0,1,0,0,0|1,0,1]=4 29 B8R0.24 CCC(C)CC(C)(C)C 5091AL [1,0,1,0,0,0|0,0,1]=3 30 B8R0.27 CN(C)C(=O)C(C)(C)C 3684AL [1,0,1,0,0,0|1,0,0]=3 31 B8R0.27 CN(C)C(=O)C(C)(C)N 7179AC [1,0,1,0,0,0|2,0,0]=4 32 B8R0.13 COC(=O)C(C)(C)CN 2027AB [1,0,1,0,0,0|2,0,0]=4 33 B8R0.34 CCC(C)(O)CC(C)C 5937AL [1,0,1,0,0,0|1,0,1]=4 34 B8R0.30 CCCC(C)(O)CCC 6603AL [1,0,1,0,0,0|1,0,1]=4 35 B8R1.4 CC1CCCC(N)C1 V8849 [2,0,0,0,0,0|1,0,1]=4 36 B8R1.4 CC1CCCC(N)C1 W7860 [2,0,0,0,0,0|1,0,1]=4 37 B8R1.4 CC1CCOC(C)O1 5310AL [2,0,0,0,0,0|2,0,0]=4 38 B8R1.4 CC1COCC(C)N1 4497AA [2,0,0,0,0,0|2,0,0]=4 39 B8R1.4 C[C@@H]1CCC[C@@H](C)C1 9192AL [2,0,0,0,0,0|0,0,1]=3 40 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 1079AL [2,0,0,0,0,0|2,0,0]=4 41 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 8828AA [2,0,0,0,0,0|2,0,0]=4 42 B8R1.4 C[C@H]1CCC[C@@H](C)C1 7412AL [2,0,0,0,0,0|0,0,1]=3 43 B8R1.4 C[C@H]1CNC[C@H](C)O1 8589AH [2,0,0,0,0,0|2,0,0]=4 44 B8R1.5 CC1CCCCC1C 4454AL [2,0,0,0,0,0|1,0,1]=4 45 B8R1.5 CC1COCCC1=O Z3955 [2,0,0,0,0,0|1,0,0]=3 46 B8R1.5 CC1NCCNC1=O 1693AB [2,0,0,0,0,0|2,0,0]=4 47 B8R1.5 CC1OCCNC1=O 5590AJ [2,0,0,0,0,0|2,0,0]=4 48 B8R1.5 CN1CCNCC1=O 7723AJ [2,0,0,0,0,0|2,0,0]=4 49 B8R1.5 C[C@@H]1CCCC[C@@H]1O 7425AL [2,0,0,0,0,0|0,0,2]=4 50 B8R1.5 C[C@H]1CCCC[C@@H]1C 9189AL [2,0,0,0,0,0|1,0,1]=4 51 B8R1.5 C[C@H]1CCCC[C@H]1C 7956AF [2,0,0,0,0,0|1,0,1]=4 52 B8R1.5 C[C@H]1CCCC[C@H]1N 8371AH [2,0,0,0,0,0|1,0,1]=4 53 B8R1.5 NN1CCCCC1=O Z4590 [2,0,0,0,0,0|2,0,0]=4 54 B8R1.5 N[C@@H]1CCCNC1=O 4620AC [2,0,0,0,0,0|2,0,0]=4 55 B8R1.5 N[C@H]1CCCNC1=O 4844AJ [2,0,0,0,0,0|2,0,0]=4 56 B8R1.5 O=C1CCCCC1Br X5630 [2,0,0,0,0,0|1,0,0]=3 57 B8R1.5 O=C1CCCCC1Cl 7902AJ [2,0,0,0,0,0|1,0,0]=3 58 B8R1.5 O=C1CCOCC1F W7452 [2,0,0,0,0,0|2,0,0]=4 59 B8R1.5 O=C1NCCCC1Br 4146AB [2,0,0,0,0,0|2,0,0]=4 60 B8R1.72 CC1(C)CCNCC1 5453AB [2,0,0,0,0,0|1,0,1]=4 61 B8R1.72 CC1(C)CNCCN1 1323AJ [2,0,0,0,0,0|2,0,0]=4 62 B8R1.72 CC1(C)CNCCO1 5391AD [2,0,0,0,0,0|2,0,0]=4 63 B8R1.72 CC1(C)COCCN1 2066AJ [2,0,0,0,0,0|2,0,0]=4 64 B8R1.72 CC1(N)CCCCC1 X6756 [2,0,0,0,0,0|1,0,1]=4 65 B10R0.56 COC(=O)C(C)C(=O)C(C)C X7165 [0,1,1,0,0,0|1,0,1]=4 66 B10R0.81 CCCCN(C)C(=O)C(C)N 2893AD [0,1,1,0,0,0|2,0,0]=4 67 B10R0.100 CN(CCO)C(=O)C(C)(C)N 2314AD [0,1,1,0,0,0|2,0,0]=4 68 B10R0.124 COC(=O)C(C)(C)CCCCl 1410AC [0,1,1,0,0,0|1,0,0]=3 69 B10R1.2 CNC1CCCC(C)C1C 3078AE [1,1,0,0,0,0|1,0,1]=4 70 B10R1.171 CC1(C)CC(CO)CCO1 8441AH [1,1,0,0,0,0|1,0,1]=4 71 B10R1.329 CC1CC(C)CC(C)(C)C1 4336AL [1,1,0,0,0,0|0,0,1]=3 72 B10R1.329 C[C@@H]1C[C@@H](O)CC(C)(C)C1 9216AL [1,1,0,0,0,0|0,0,1]=3 73 B10R1.23 CC(Cl)C(=O)N1CCCC1 9197AE [0,0,1,1,0,0|2,0,0]=4 74 B10R1.23 CC(N)C(=O)N1CCCC1 8150AD [0,0,1,1,0,0|2,0,0]=4 75 B10R1.23 C[C@H](O)C(=O)N1CCCC1 4218AA [0,0,1,1,0,0|2,0,0]=4 76 B10R1.81 CC(C)C(=O)N1CC(O)C1 4939AJ [0,0,1,1,0,0|2,0,0]=4 77 B10R1.275 CN1CCCC[C@H](N)C1=O W4393 [0,0,1,1,0,0|2,0,0]=4 78 B10R1.411 COC(=O)C1(C)CCCC1 4021AE [0,0,1,1,0,0|1,0,0]=3 79 B10R1.411 COC(=O)C1(C)CCCN1 4594AE [0,0,1,1,0,0|2,0,0]=4 80 B10R2.25 O=C1C2CCC(C2)C1Cl 1094AQ [1,0,0,1,0,0|1,0,0]=3 81 B12R2.2863 [C@@H]12C[C@@H](B)[C@H](C)[C@@H](C1)C2(C)C 3957AL [0,1,0,1,0,0|1,0,1]=4 82 B12R2.2863 [C@H]12C[C@H](B)[C@@H](C)[C@H](C1)C2(C)C 3938AL [0,1,0,1,0,0|1,0,1]=4 83 B8R0.9 CCC(C)CCC(C)C 5380AL [0,0,1,0,1,0|1,0,1]=4 84 B8R1.50 CN1CCC(Br)C1=O 0624AE [1,0,0,0,1,0|2,0,0]=4 85 B8R1.19 CC1(C)CCCC1N 1318AJ [1,0,0,0,1,0|1,0,1]=4 86 B8R1.51 CC1(C)CCC(N)C1 2064AJ [1,0,0,0,1,0|1,0,1]=4 87 B8R1.51 CC1COC(C)(C)O1 5088AL [1,0,0,0,1,0|2,0,0]=4 88 B10R0.37 CN[C@H](C)C(=O)OC(C)(C)C Z5864 [0,0,1,0,0,1|1,0,0]=3 89 B10R0.52 CCC(C)NC(=O)C(C)(C)N 2056AD [0,0,1,0,0,1|1,0,0]=3 90 B10R0.67 CC(N)C(=O)NC(C)(C)CO 2810AD [0,0,1,0,0,1|2,0,0]=4