0 B11R2.204 C=C1C2CCC(C2)C1(C)C MCULE-1011863584 [0,0,0,0,0,0|0,0,0]=0 1 B11R2.204 C=C1[C@H]2CC[C@H](C2)C1(C)C MCULE-4002698927 [0,0,0,0,0,0|0,0,0]=0 2 B11R2.204 CC1(C(=O)C2CCC1C2)C MCULE-7397179916 [0,0,0,0,0,0|1,0,0]=1 3 B11R2.204 CC1(C2CCC(C2)C1N)C MCULE-4035727678 [0,0,0,0,0,0|1,0,1]=2 4 B11R2.204 CC1(C2CCC(C2)C1N)C MCULE-9038241743 [0,0,0,0,0,0|1,0,1]=2 5 B11R2.204 CC1C2CCC(C2)C1(C)N MCULE-2493131199 [0,0,0,0,0,0|1,0,2]=3 6 B11R2.204 [C@H]12CC[C@H](C1)C(C2=C)(C)C MCULE-2483877354 [0,0,0,0,0,0|0,0,0]=0 7 B10R2.25 C=C1C(=O)C2CCC1C2 MCULE-6446104918 [1,0,0,0,0,0|1,0,1]=3 8 B10R2.25 CC1=C(C2CCC1C2)C MCULE-4590593924 [1,0,0,0,0,0|0,0,2]=3 9 B10R2.25 O=C1C2CCC(C2)C1Cl MCULE-5605308647 [1,0,0,0,0,0|2,0,0]=3 10 B10R2.25 [C@H]12CC[C@H](C1)C(=C)C2=O MCULE-3111478302 [1,0,0,0,0,0|1,0,1]=3 11 B10R2.25 [C@H]12CC[C@H](C1)C(=C)C2=O MCULE-7597877958 [1,0,0,0,0,0|1,0,1]=3 12 B10R2.25 [C@H]12CC[C@H](C1)C(C2=O)Cl MCULE-3759432797 [1,0,0,0,0,0|2,0,0]=3 13 B10R2.28 CC1(CC2CCC1C2)O MCULE-8233333167 [1,0,0,0,0,0|1,0,1]=3 14 B10R2.28 ClC1(CC2CCC1C2)Cl MCULE-2079435104 [1,0,0,0,0,0|2,0,1]=4 15 B12R2.509 CC1(C(=O)[C@@]2(CC[C@H]1C2)C)C MCULE-7977388387 [0,1,0,0,0,0|1,0,0]=2 16 B12R2.509 CC1(C(=O)[C@@]2(CC[C@H]1C2)C)C MCULE-9057797219 [0,1,0,0,0,0|1,0,0]=2 17 B12R2.509 CC1(C(=O)[C@]2(CC[C@@H]1C2)C)C MCULE-2746796380 [0,1,0,0,0,0|1,0,0]=2 18 B12R2.509 CC1(C(=O)[C@]2(CC[C@@H]1C2)C)C MCULE-5647901120 [0,1,0,0,0,0|1,0,0]=2 19 B12R2.509 CC1([C@H]([C@]2(CC[C@@H]1C2)C)O)C MCULE-6621779699 [0,1,0,0,0,0|1,0,1]=3 20 B12R2.509 CC12CCC(C1)C(C2=O)(C)C MCULE-7563797223 [0,1,0,0,0,0|1,0,0]=2 21 B12R2.509 CC12CCC(C1)C(C2N)(C)C MCULE-2996424677 [0,1,0,0,0,0|1,0,1]=3 22 B12R2.509 CC12CCC(C1)C(C2N)(C)C MCULE-3989898726 [0,1,0,0,0,0|1,0,1]=3 23 B12R2.509 CC12CCC(C1)C(C2O)(C)C MCULE-1749201613 [0,1,0,0,0,0|1,0,1]=3 24 B12R2.2264 CC1(C2CCC(C2)C1CN)C MCULE-7759725503 [0,1,0,0,0,0|0,0,2]=3 25 B12R2.2264 CC1(C2CCC(C2)C1CO)C MCULE-6170580433 [0,1,0,0,0,0|0,0,2]=3 26 B12R2.2264 CNC1C2CCC(C2)C1(C)C MCULE-1600352969 [0,1,0,0,0,0|0,0,2]=3 27 B12R2.4015 CNC1(C2CCC(C2)C1C)C MCULE-7374309726 [0,1,0,0,0,0|0,0,2]=3 28 B10R1.6 C=CS(=O)(=O)C1CCCC1 MCULE-9842024283 [0,0,1,0,0,0|3,0,0]=4 29 B10R1.6 CC(C)(C=O)N1CCCC1 MCULE-1604150948 [0,0,1,0,0,0|2,0,0]=3 30 B10R1.6 CC(C)(CN)C1CCCC1 MCULE-1648817730 [0,0,1,0,0,0|1,0,1]=3 31 B10R1.6 CC(C)(CN)C1CCCO1 MCULE-4163154426 [0,0,1,0,0,0|2,0,1]=4 32 B10R1.6 CC(C)(CN)C1CCCO1 MCULE-8592013856 [0,0,1,0,0,0|2,0,1]=4 33 B10R1.6 CC(C)(CN)N1CCCC1 MCULE-3999395807 [0,0,1,0,0,0|2,0,1]=4 34 B10R1.6 CC(C)(CN)N1CCCC1 MCULE-7314751213 [0,0,1,0,0,0|2,0,1]=4 35 B10R1.6 CC(C)(CO)C1CCCC1 MCULE-3512331789 [0,0,1,0,0,0|1,0,1]=3 36 B10R1.6 CC(C)(CO)C1CCCN1 MCULE-7296140133 [0,0,1,0,0,0|2,0,1]=4 37 B10R1.6 CC(C)(CO)C1CCCO1 MCULE-1826139434 [0,0,1,0,0,0|2,0,1]=4 38 B10R1.6 CC(C)(CO)C1CCOC1 MCULE-9562143086 [0,0,1,0,0,0|2,0,1]=4 39 B10R1.6 CC(C)(CO)N1CCCC1 MCULE-6836575748 [0,0,1,0,0,0|2,0,1]=4 40 B10R1.6 CCC(C)(C)C1CCCN1 MCULE-7525604057 [0,0,1,0,0,0|1,0,2]=4 41 B10R1.6 COC(C)(C)C1CCCN1 MCULE-4060570797 [0,0,1,0,0,0|2,0,1]=4 42 B10R1.6 COC(C)(C)[C@@H]1CCCN1 MCULE-2426303241 [0,0,1,0,0,0|2,0,1]=4 43 B10R1.6 COC(C)(C)[C@@H]1CCCN1 MCULE-6397413977 [0,0,1,0,0,0|2,0,1]=4 44 B10R1.6 COC(C)(C)[C@H]1CCCN1 MCULE-6192514226 [0,0,1,0,0,0|2,0,1]=4 45 B10R1.23 C1(CCCN1)C(=O)N(C)C MCULE-4398631648 [0,0,1,0,0,0|3,0,0]=4 46 B10R1.23 CC(Br)C(=O)N1CCCC1 MCULE-9775226488 [0,0,1,0,0,0|3,0,0]=4 47 B10R1.23 CC(C)N(C)C1CCNC1 MCULE-2410464983 [0,0,1,0,0,0|2,0,1]=4 48 B10R1.23 CC(C)N(C)C1CCNC1 MCULE-3713187575 [0,0,1,0,0,0|2,0,1]=4 49 B10R1.23 CC(C)N(C)[C@@H]1CCNC1 MCULE-7749378703 [0,0,1,0,0,0|2,0,1]=4 50 B10R1.23 CC(C)N(C)[C@H]1CCNC1 MCULE-8225806413 [0,0,1,0,0,0|2,0,1]=4 51 B10R1.23 CC(C)N(C)[C@H]1CCNC1 MCULE-8617659192 [0,0,1,0,0,0|2,0,1]=4 52 B10R1.23 CC(Cl)C(=O)N1CCCC1 MCULE-4690355147 [0,0,1,0,0,0|3,0,0]=4 53 B10R1.23 CC(N)C(=O)N1CCCC1 MCULE-4807940332 [0,0,1,0,0,0|3,0,0]=4 54 B10R1.23 CC(N)C(=O)N1CCCC1 MCULE-5368393170 [0,0,1,0,0,0|3,0,0]=4 55 B10R1.23 CC(N)C(=S)N1CCCC1 MCULE-6918037673 [0,0,1,0,0,0|3,0,0]=4 56 B10R1.23 CC(N)C(=S)N1CCCC1 MCULE-9539643894 [0,0,1,0,0,0|3,0,0]=4 57 B10R1.23 CC(O)C(=O)N1CCCC1 MCULE-9549425210 [0,0,1,0,0,0|3,0,0]=4 58 B10R1.23 CN(C)C(=O)C1CCCN1 MCULE-3770487541 [0,0,1,0,0,0|3,0,0]=4 59 B10R1.23 CN(C)C(=O)C1CCCN1 MCULE-8209945306 [0,0,1,0,0,0|3,0,0]=4 60 B10R1.23 CN(C)C(=O)C1CCNC1 MCULE-5159646055 [0,0,1,0,0,0|3,0,0]=4 61 B10R1.23 CN(C)C(=O)C1CCNC1 MCULE-7938367497 [0,0,1,0,0,0|3,0,0]=4 62 B10R1.23 CN(C)C(=O)[C@@H]1CCCN1 MCULE-1153083907 [0,0,1,0,0,0|3,0,0]=4 63 B10R1.23 CN(C)C(=O)[C@@H]1CCCN1 MCULE-1309130426 [0,0,1,0,0,0|3,0,0]=4 64 B10R1.23 CN(C)C(=O)[C@@H]1CCCN1 MCULE-6539699612 [0,0,1,0,0,0|3,0,0]=4 65 B10R1.23 CN(C)C(=O)[C@@H]1CCCN1 MCULE-8730769529 [0,0,1,0,0,0|3,0,0]=4 66 B10R1.23 CN(C)C(=O)[C@@H]1CCNC1 MCULE-7093160030 [0,0,1,0,0,0|3,0,0]=4 67 B10R1.23 CN(C)C(=O)[C@@H]1CCNC1 MCULE-9738187208 [0,0,1,0,0,0|3,0,0]=4 68 B10R1.23 CN(C)C(=O)[C@H]1CCCN1 MCULE-6128551220 [0,0,1,0,0,0|3,0,0]=4 69 B10R1.23 CN(C)C(=O)[C@H]1CCCN1 MCULE-7525000496 [0,0,1,0,0,0|3,0,0]=4 70 B10R1.23 CN(C)C(=O)[C@H]1CCNC1 MCULE-1608074456 [0,0,1,0,0,0|3,0,0]=4 71 B10R1.23 CN(C)C(=O)[C@H]1CCNC1 MCULE-1981798289 [0,0,1,0,0,0|3,0,0]=4 72 B10R1.23 CN(C)C(=O)[C@H]1CCNC1 MCULE-2065502539 [0,0,1,0,0,0|3,0,0]=4 73 B10R1.23 CN(C)C(=O)[C@H]1CCNC1 MCULE-5826189068 [0,0,1,0,0,0|3,0,0]=4 74 B10R1.23 C[C@@H](O)C(=O)N1CCCC1 MCULE-3894981934 [0,0,1,0,0,0|3,0,0]=4 75 B10R1.23 C[C@H](N)C(=O)N1CCCC1 MCULE-3507269195 [0,0,1,0,0,0|3,0,0]=4 76 B10R1.23 C[C@H](N)C(=O)N1CCCC1 MCULE-7219811454 [0,0,1,0,0,0|3,0,0]=4 77 B10R1.23 C[C@H](N)C(=S)N1CCCC1 MCULE-1933303645 [0,0,1,0,0,0|3,0,0]=4 78 B10R1.23 C[C@H](N)C(=S)N1CCCC1 MCULE-4939021403 [0,0,1,0,0,0|3,0,0]=4 79 B10R1.23 C[C@H](N)C(=S)N1CCCC1 MCULE-6122702846 [0,0,1,0,0,0|3,0,0]=4 80 B10R1.23 C[C@H](N)C(=S)N1CCCC1 MCULE-7808264705 [0,0,1,0,0,0|3,0,0]=4 81 B10R1.23 C[C@H](O)C(=O)N1CCCC1 MCULE-1620243447 [0,0,1,0,0,0|3,0,0]=4 82 B10R1.23 C[C@H](O)C(=O)N1CCCC1 MCULE-4137961578 [0,0,1,0,0,0|3,0,0]=4 83 B10R1.31 CC(C)N1CCC(C1)CBr MCULE-2064070979 [0,0,1,0,0,0|2,0,1]=4 84 B10R1.31 CC(C)N1CCC(C1)CBr MCULE-8920951137 [0,0,1,0,0,0|2,0,1]=4 85 B10R1.31 CC(C)N1CCC(C1)CCl MCULE-2427512655 [0,0,1,0,0,0|2,0,1]=4 86 B10R1.31 CC(C)N1CCC(C1)CCl MCULE-8410065842 [0,0,1,0,0,0|2,0,1]=4 87 B10R1.31 CC(C)N1CCC(C1)CN MCULE-1139955278 [0,0,1,0,0,0|2,0,1]=4 88 B10R1.31 CC(C)N1CCC(C1)CO MCULE-3847518627 [0,0,1,0,0,0|2,0,1]=4 89 B10R1.31 CC(C)N1CC[C@@H](C1)CN MCULE-1706258431 [0,0,1,0,0,0|2,0,1]=4 90 B10R1.31 CNC1CCN(C1)C(C)C MCULE-2478703231 [0,0,1,0,0,0|2,0,1]=4 91 B10R1.114 CC1(C(=O)CCCC1=O)C MCULE-4343136214 [0,0,1,0,0,0|2,0,1]=4 92 B10R1.114 CC1(C(=O)CCCC1O)C MCULE-9124104325 [0,0,1,0,0,0|2,0,0]=3 93 B10R1.114 CC1(C(=O)CCC[C@@H]1O)C MCULE-8665792986 [0,0,1,0,0,0|2,0,0]=3 94 B10R1.114 CN1CCNC(=O)C1(C)C MCULE-2751590867 [0,0,1,0,0,0|3,0,0]=4 95 B10R1.220 CC1(CCC(C1=O)C#N)C MCULE-3656428249 [0,0,1,0,0,0|2,0,1]=4 96 B10R1.301 CC1(CCCC(C1=O)Cl)C MCULE-6998065064 [0,0,1,0,0,0|2,0,0]=3 97 B10R1.301 CC1(CCCC(C1=O)F)C MCULE-9527807140 [0,0,1,0,0,0|2,0,0]=3 98 B10R1.301 CC1CCCC(C1=O)(C)C MCULE-3194713697 [0,0,1,0,0,0|1,0,0]=2 99 B10R1.301 CN1CCNC(C1=O)(C)C MCULE-6222875384 [0,0,1,0,0,0|3,0,0]=4 100 B10R1.301 CN1CCNC(C1=O)(C)C MCULE-9556354162 [0,0,1,0,0,0|3,0,0]=4 101 B12R3.4045 CC1(C2CC3C1(C3C2)C)C MCULE-4610187608 [0,0,0,1,0,0|0,0,2]=3 102 B12R2.226 CC1NC2CCC(C2)C1(C)C MCULE-7125553982 [0,0,0,0,0,1|0,0,2]=3 103 B12R2.3019 CC1NC(C2CCC1C2)(C)C MCULE-5499635497 [0,0,0,0,0,1|0,0,2]=3 104 B9R1.11 C=CC(O)C1CCCC1 MCULE-8096299119 [1,0,1,0,0,0|1,0,0]=3 105 B9R1.11 CC(CBr)C1CCCC1 MCULE-7239123079 [1,0,1,0,0,0|1,0,1]=4 106 B9R1.11 CCC(=O)C1CCCC1 MCULE-4431631098 [1,0,1,0,0,0|1,0,0]=3 107 B9R1.11 CCC(=O)C1CCOC1 MCULE-1322014645 [1,0,1,0,0,0|2,0,0]=4 108 B9R1.11 CCC(=O)[C@@H]1CCCN1 MCULE-1661804964 [1,0,1,0,0,0|2,0,0]=4 109 B9R1.11 CCC(=O)[C@@H]1CCCN1 MCULE-8456135152 [1,0,1,0,0,0|2,0,0]=4 110 B9R1.11 CCC(N)C1CCCC1 MCULE-2018376160 [1,0,1,0,0,0|1,0,1]=4 111 B9R1.11 CNC(=O)C1CCCC1 MCULE-1170525718 [1,0,1,0,0,0|2,0,0]=4 112 B9R1.11 COC(=N)C1CCCC1 MCULE-3923627958 [1,0,1,0,0,0|2,0,0]=4 113 B9R1.11 COC(=N)C1CCCC1 MCULE-5894752285 [1,0,1,0,0,0|2,0,0]=4 114 B9R1.11 COC(=O)C1CCCC1 MCULE-6212031690 [1,0,1,0,0,0|2,0,0]=4 115 B9R1.11 NCC(=O)C1CCCC1 MCULE-2498486150 [1,0,1,0,0,0|2,0,0]=4 116 B9R1.11 NCC(=O)C1CCCC1 MCULE-5406973286 [1,0,1,0,0,0|2,0,0]=4 117 B9R1.11 O=C(CBr)C1CCCC1 MCULE-4985111490 [1,0,1,0,0,0|2,0,0]=4 118 B9R1.11 O=C(CCl)C1CCCC1 MCULE-7395779538 [1,0,1,0,0,0|2,0,0]=4 119 B9R1.19 C1(CCNC1)C(C)(C)O MCULE-2335808122 [1,0,1,0,0,0|2,0,0]=4 120 B9R1.19 CC(C)(C)C1CCCN1 MCULE-2769778811 [1,0,1,0,0,0|1,0,1]=4 121 B9R1.19 CC(C)(C)C1CCCN1 MCULE-8806345824 [1,0,1,0,0,0|1,0,1]=4 122 B9R1.19 CC(C)(C)C1CCNC1 MCULE-1985746769 [1,0,1,0,0,0|1,0,1]=4 123 B9R1.19 CC(C)(C)C1CCNC1 MCULE-6963572670 [1,0,1,0,0,0|1,0,1]=4 124 B9R1.19 CC(C)(F)C1CCNC1 MCULE-2628240856 [1,0,1,0,0,0|2,0,0]=4 125 B9R1.19 CC(C)(F)C1CCNC1 MCULE-7031501108 [1,0,1,0,0,0|2,0,0]=4 126 B9R1.19 CC(C)(N)C1CCCC1 MCULE-6352281030 [1,0,1,0,0,0|1,0,0]=3 127 B9R1.19 CC(C)(N)C1CCCC1 MCULE-7051408379 [1,0,1,0,0,0|1,0,0]=3 128 B9R1.19 CC(C)(N)[C@@H]1CCNC1 MCULE-3284166088 [1,0,1,0,0,0|2,0,0]=4 129 B9R1.19 CC(C)(O)C1CCCC1 MCULE-5080602177 [1,0,1,0,0,0|1,0,0]=3 130 B9R1.19 CC(C)(O)C1CCCN1 MCULE-3058549783 [1,0,1,0,0,0|2,0,0]=4 131 B9R1.19 CC(C)(O)C1CCCN1 MCULE-7282873348 [1,0,1,0,0,0|2,0,0]=4 132 B9R1.19 CC(C)(O)C1CCNC1 MCULE-6641993906 [1,0,1,0,0,0|2,0,0]=4 133 B9R1.19 CC(C)(O)C1CCNC1 MCULE-7962965541 [1,0,1,0,0,0|2,0,0]=4 134 B9R1.19 CC(C)(O)[C@@H]1CCCN1 MCULE-2324069180 [1,0,1,0,0,0|2,0,0]=4 135 B9R1.19 CC(C)(O)[C@@H]1CCCN1 MCULE-3595619735 [1,0,1,0,0,0|2,0,0]=4 136 B9R1.19 CC(C)(O)[C@@H]1CCCN1 MCULE-3842553890 [1,0,1,0,0,0|2,0,0]=4 137 B9R1.19 CC(C)(O)[C@@H]1CCNC1 MCULE-2734899119 [1,0,1,0,0,0|2,0,0]=4 138 B9R1.19 CC(C)(O)[C@@H]1CCNC1 MCULE-4295897789 [1,0,1,0,0,0|2,0,0]=4 139 B9R1.19 CC(C)(O)[C@@H]1CCNC1 MCULE-7600351767 [1,0,1,0,0,0|2,0,0]=4 140 B9R1.19 CC(C)(O)[C@@H]1CCNC1 MCULE-9314777744 [1,0,1,0,0,0|2,0,0]=4 141 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-1082062321 [1,0,1,0,0,0|2,0,0]=4 142 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-5364741590 [1,0,1,0,0,0|2,0,0]=4 143 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-8737105400 [1,0,1,0,0,0|2,0,0]=4 144 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-9021200021 [1,0,1,0,0,0|2,0,0]=4 145 B9R1.19 CC(C)(O)[C@H]1CCNC1 MCULE-3360210192 [1,0,1,0,0,0|2,0,0]=4 146 B9R1.19 CC(C)(O)[C@H]1CCNC1 MCULE-6542450494 [1,0,1,0,0,0|2,0,0]=4 147 B9R1.19 CC(C)(O)[C@H]1CCNC1 MCULE-6716834842 [1,0,1,0,0,0|2,0,0]=4 148 B9R1.19 CC(C)(O)[C@H]1CCNC1 MCULE-9327175954 [1,0,1,0,0,0|2,0,0]=4 149 B9R1.13 CC(C)CC1CCCN1 MCULE-1997095742 [1,0,1,0,0,0|1,0,1]=4 150 B9R1.13 CC(C)CC1CCCN1 MCULE-6128010231 [1,0,1,0,0,0|1,0,1]=4 151 B9R1.13 CC(C)CC1CCNC1 MCULE-5350353606 [1,0,1,0,0,0|1,0,1]=4 152 B9R1.13 CC(C)CC1CCNC1 MCULE-9967174010 [1,0,1,0,0,0|1,0,1]=4 153 B9R1.13 CC(C)NC1CCCC1 MCULE-4690363657 [1,0,1,0,0,0|1,0,0]=3 154 B9R1.13 CC(C)NC1CCCC1 MCULE-4763641972 [1,0,1,0,0,0|1,0,0]=3 155 B9R1.13 CC(C)NC1CCOC1 MCULE-4775162766 [1,0,1,0,0,0|2,0,0]=4 156 B9R1.13 CC(C)OC1CCNC1 MCULE-4190937360 [1,0,1,0,0,0|2,0,0]=4 157 B9R1.13 CC(C)O[C@@H]1CCNC1 MCULE-2396881715 [1,0,1,0,0,0|2,0,0]=4 158 B9R1.13 CC(C)O[C@H]1CCNC1 MCULE-1493924020 [1,0,1,0,0,0|2,0,0]=4 159 B9R1.13 CC(C)O[C@H]1CCNC1 MCULE-2047031704 [1,0,1,0,0,0|2,0,0]=4 160 B9R1.13 CC(N)CC1CCCC1 MCULE-7070144052 [1,0,1,0,0,0|1,0,1]=4 161 B9R1.35 C1(CCN(C1)C(C)C)N MCULE-8432621714 [1,0,1,0,0,0|2,0,0]=4 162 B9R1.35 CC(C)C1CCC(=O)C1 MCULE-7380487072 [1,0,1,0,0,0|1,0,1]=4 163 B9R1.35 CC(C)N1CCC(C1)N MCULE-4749468486 [1,0,1,0,0,0|2,0,0]=4 164 B9R1.35 CC(C)N1CCC(C1)N MCULE-5852371664 [1,0,1,0,0,0|2,0,0]=4 165 B9R1.35 CC(C)N1CCC(C1)O MCULE-3720057489 [1,0,1,0,0,0|2,0,0]=4 166 B9R1.35 CC(C)N1CC[C@@H](C1)N MCULE-6471539493 [1,0,1,0,0,0|2,0,0]=4 167 B9R1.35 CC(C)N1CC[C@@H](C1)N MCULE-7015939394 [1,0,1,0,0,0|2,0,0]=4 168 B9R1.35 CC(C)N1CC[C@@H](C1)N MCULE-8110134912 [1,0,1,0,0,0|2,0,0]=4 169 B9R1.35 CC(C)N1CC[C@@H](C1)N MCULE-9609049573 [1,0,1,0,0,0|2,0,0]=4 170 B9R1.35 CC(C)N1CC[C@H](C1)N MCULE-1530775951 [1,0,1,0,0,0|2,0,0]=4 171 B9R1.35 CC(C)N1CC[C@H](C1)N MCULE-4951466014 [1,0,1,0,0,0|2,0,0]=4 172 B9R1.35 CC(C)N1CC[C@H](C1)N MCULE-6582430244 [1,0,1,0,0,0|2,0,0]=4 173 B9R1.35 CC(C)N1CC[C@H](C1)N MCULE-7778446867 [1,0,1,0,0,0|2,0,0]=4 174 B9R1.35 CN(C)C1CCC(C1)N MCULE-2428179530 [1,0,1,0,0,0|2,0,0]=4 175 B9R1.35 CN(C)[C@@H]1CC[C@@H](C1)N MCULE-9805171009 [1,0,1,0,0,0|2,0,0]=4 176 B9R1.3 CC1CCCC(=O)C1C MCULE-1705022712 [1,0,1,0,0,0|1,0,0]=3 177 B9R1.3 CC1CCCC(C1=O)C MCULE-4896844140 [1,0,1,0,0,0|1,0,0]=3 178 B9R1.3 CC1CCCC(C1C)C MCULE-9375072995 [1,0,1,0,0,0|0,0,2]=4 179 B9R1.3 CC1CCCC(C1C)N MCULE-7085283833 [1,0,1,0,0,0|1,0,1]=4 180 B9R1.3 CC1CCCC(C1C)O MCULE-1285216829 [1,0,1,0,0,0|1,0,1]=4 181 B9R1.3 CC1CCCC(C1N)C MCULE-4904455493 [1,0,1,0,0,0|1,0,1]=4 182 B9R1.3 CC1CCCC(C1N)C MCULE-9589109711 [1,0,1,0,0,0|1,0,1]=4 183 B9R1.3 CC1CCCC(C1O)C MCULE-8568932421 [1,0,1,0,0,0|1,0,1]=4 184 B9R1.3 CC1CCCC(N1N)C MCULE-5765452870 [1,0,1,0,0,0|2,0,0]=4 185 B9R1.3 CC1COCC(C1=O)C MCULE-6746359512 [1,0,1,0,0,0|2,0,0]=4 186 B9R1.40 CC1(CCCCC1=O)C MCULE-8496149275 [1,0,1,0,0,0|1,0,0]=3 187 B9R1.40 CC1(CCCCC1=O)Cl MCULE-4801960774 [1,0,1,0,0,0|2,0,0]=4 188 B9R1.40 CC1(CCCCC1N)C MCULE-5951764286 [1,0,1,0,0,0|1,0,1]=4 189 B9R1.40 CC1(CCCCC1O)C MCULE-1365001070 [1,0,1,0,0,0|1,0,1]=4 190 B9R1.40 CC1(CCCNC1=O)C MCULE-4245207122 [1,0,1,0,0,0|2,0,0]=4 191 B9R1.40 CC1(CCCOC1=O)C MCULE-9200729474 [1,0,1,0,0,0|2,0,0]=4 192 B9R1.40 CC1(CCNCC1=O)C MCULE-8773076138 [1,0,1,0,0,0|2,0,0]=4 193 B9R1.40 CC1(CNCCC1=O)C MCULE-5070569514 [1,0,1,0,0,0|2,0,0]=4 194 B9R1.40 CC1(CNCCC1=O)C MCULE-7248994046 [1,0,1,0,0,0|2,0,0]=4 195 B9R1.40 CC1(COCCC1=O)C MCULE-2901452802 [1,0,1,0,0,0|2,0,0]=4 196 B9R1.40 CC1(OCCCC1=O)C MCULE-1810586504 [1,0,1,0,0,0|2,0,0]=4 197 B9R1.40 CC1CCCCC1(C)N MCULE-4488389841 [1,0,1,0,0,0|1,0,1]=4 198 B9R1.40 CC1CCNCC1(C)C MCULE-9805063465 [1,0,1,0,0,0|1,0,1]=4 199 B9R1.40 CC1NCCCC1(C)C MCULE-8207946127 [1,0,1,0,0,0|1,0,1]=4 200 B9R1.40 CC1NCCOC1(C)C MCULE-6809266351 [1,0,1,0,0,0|2,0,0]=4 201 B9R1.133 CC1(CCC(C1)CBr)C MCULE-6516555782 [1,0,1,0,0,0|1,0,1]=4 202 B9R1.133 CC1(CCC(C1)CN)C MCULE-3947571035 [1,0,1,0,0,0|1,0,1]=4 203 B9R1.133 CC1(CCC(C1)CN)C MCULE-9482404028 [1,0,1,0,0,0|1,0,1]=4 204 B9R1.133 CC1(CCC(O1)CBr)C MCULE-7975653586 [1,0,1,0,0,0|2,0,0]=4 205 B9R1.133 CC1(CCC(O1)CN)C MCULE-7867684034 [1,0,1,0,0,0|2,0,0]=4 206 B9R1.133 CC1(CCC(O1)CN)C MCULE-9199821671 [1,0,1,0,0,0|2,0,0]=4 207 B9R1.133 CC1(CCC(O1)CO)C MCULE-1774872507 [1,0,1,0,0,0|2,0,0]=4 208 B9R1.133 CC1(CC[C@@H](O1)CN)C MCULE-1087286567 [1,0,1,0,0,0|2,0,0]=4 209 B9R1.133 CC1(CC[C@@H](O1)CO)C MCULE-5585962757 [1,0,1,0,0,0|2,0,0]=4 210 B9R1.133 CC1(CC[C@H](O1)CO)C MCULE-2305370714 [1,0,1,0,0,0|2,0,0]=4 211 B9R1.133 CC1(CC[C@H](O1)CO)C MCULE-8266167352 [1,0,1,0,0,0|2,0,0]=4 212 B9R1.133 CNC1CCC(C1)(C)C MCULE-7703398936 [1,0,1,0,0,0|1,0,1]=4 213 B9R1.133 CNC1CCC(C1)(C)C MCULE-8816913280 [1,0,1,0,0,0|1,0,1]=4 214 B9R1.138 CC1(CCC(C1=O)Br)C MCULE-1239203799 [1,0,1,0,0,0|2,0,0]=4 215 B9R1.138 CC1(CCC(C1=O)Cl)C MCULE-9064906453 [1,0,1,0,0,0|2,0,0]=4 216 B9R1.24 CC1(CCCC1CN)C MCULE-2825475131 [1,0,1,0,0,0|1,0,1]=4 217 B9R1.24 CC1(CCCC1CO)C MCULE-4941414251 [1,0,1,0,0,0|1,0,1]=4 218 B9R1.24 CC1(NCCC1CO)C MCULE-4504449817 [1,0,1,0,0,0|2,0,0]=4 219 B9R1.24 CC1(OCCC1CN)C MCULE-1914802478 [1,0,1,0,0,0|2,0,0]=4 220 B9R1.24 CC1(OCCC1CN)C MCULE-4708380867 [1,0,1,0,0,0|2,0,0]=4 221 B9R1.24 CC1(OCCC1CO)C MCULE-6604005971 [1,0,1,0,0,0|2,0,0]=4 222 B9R1.24 CC1(SCCC1CN)C MCULE-7087059657 [1,0,1,0,0,0|2,0,0]=4 223 B9R1.24 CC1(SCCC1CO)C MCULE-5045966886 [1,0,1,0,0,0|2,0,0]=4 224 B9R1.24 COC1CCNC1(C)C MCULE-7820848652 [1,0,1,0,0,0|2,0,0]=4 225 B9R1.24 COC1CCNC1(C)C MCULE-9774935285 [1,0,1,0,0,0|2,0,0]=4 226 B9R1.106 CC1(C(=O)CCC1O)C MCULE-3636393805 [1,0,1,0,0,0|2,0,0]=4 227 B9R1.106 CN1CCC(=O)C1(C)C MCULE-4067305018 [1,0,1,0,0,0|2,0,0]=4 228 B9R1.66 CC1(CCCC(C1)N)C MCULE-1882717078 [1,0,1,0,0,0|1,0,1]=4 229 B9R1.66 CC1(CCCC(C1)N)C MCULE-8036702375 [1,0,1,0,0,0|1,0,1]=4 230 B9R1.66 CC1(CCCC(C1)O)C MCULE-3782371278 [1,0,1,0,0,0|1,0,1]=4 231 B9R1.66 CC1(CCC[C@@H](C1)N)C MCULE-1518307544 [1,0,1,0,0,0|1,0,1]=4 232 B9R1.66 CC1(CCC[C@@H](C1)N)C MCULE-7855800021 [1,0,1,0,0,0|1,0,1]=4 233 B9R1.66 CC1(CCC[C@@H](C1)N)C MCULE-8858670078 [1,0,1,0,0,0|1,0,1]=4 234 B9R1.66 CC1(CCC[C@@H](C1)N)C MCULE-9021437451 [1,0,1,0,0,0|1,0,1]=4 235 B9R1.66 CC1(CCC[C@H](C1)N)C MCULE-1374259179 [1,0,1,0,0,0|1,0,1]=4 236 B9R1.66 CC1(CCC[C@H](C1)N)C MCULE-8829716498 [1,0,1,0,0,0|1,0,1]=4 237 B9R1.66 CC1CCCC(C1)(C)C MCULE-9663238909 [1,0,1,0,0,0|0,0,1]=3 238 B9R1.66 CC1CCCC(N1)(C)C MCULE-3847815456 [1,0,1,0,0,0|1,0,0]=3 239 B9R1.66 CC1CCCC(N1)(C)C MCULE-7831646614 [1,0,1,0,0,0|1,0,0]=3 240 B9R1.66 CC1CNCC(C1)(C)C MCULE-6968910238 [1,0,1,0,0,0|1,0,1]=4 241 B9R1.66 CC1CNCC(O1)(C)C MCULE-6563845081 [1,0,1,0,0,0|2,0,0]=4 242 B9R1.66 CC1COCC(N1)(C)C MCULE-2107651949 [1,0,1,0,0,0|2,0,0]=4 243 B9R1.66 C[C@H]1COCC(N1)(C)C MCULE-5246321018 [1,0,1,0,0,0|2,0,0]=4 244 B9R2.39 BrC1=CC2CCC1C2 MCULE-1542178097 [2,0,0,0,0,0|1,0,1]=4 245 B9R2.39 BrC1CC2CCC1C2 MCULE-2525306417 [2,0,0,0,0,0|1,0,1]=4 246 B9R2.39 BrC1C[C@H]2CC[C@@H]1C2 MCULE-5339713795 [2,0,0,0,0,0|1,0,1]=4 247 B9R2.39 C1(NC2CCC1C2)Cl MCULE-5142742287 [2,0,0,0,0,0|2,0,0]=4 248 B9R2.39 ClC1CC2CCC1C2 MCULE-2627012901 [2,0,0,0,0,0|1,0,1]=4 249 B9R2.39 NC1CC2CCC1C2 MCULE-1646830516 [2,0,0,0,0,0|1,0,1]=4 250 B9R2.39 NC1CC2CCC1C2 MCULE-4489292957 [2,0,0,0,0,0|1,0,1]=4 251 B9R2.39 NC1C[C@@H]2CC[C@H]1C2 MCULE-4406518687 [2,0,0,0,0,0|1,0,1]=4 252 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-1907155621 [2,0,0,0,0,0|1,0,1]=4 253 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-3506388726 [2,0,0,0,0,0|1,0,1]=4 254 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-3640859726 [2,0,0,0,0,0|1,0,1]=4 255 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-4236102525 [2,0,0,0,0,0|1,0,1]=4 256 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-3600979102 [2,0,0,0,0,0|1,0,1]=4 257 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-4880538936 [2,0,0,0,0,0|1,0,1]=4 258 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-5004847824 [2,0,0,0,0,0|1,0,1]=4 259 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-5227933535 [2,0,0,0,0,0|1,0,1]=4 260 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-5286948756 [2,0,0,0,0,0|1,0,1]=4 261 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-7553153313 [2,0,0,0,0,0|1,0,1]=4 262 B9R2.39 O=C1CC2CC1CN2 MCULE-1513637451 [2,0,0,0,0,0|2,0,0]=4 263 B9R2.39 O=C1CC2CC1CN2 MCULE-8245110165 [2,0,0,0,0,0|2,0,0]=4 264 B9R2.39 O=C1CC2CCC1C2 MCULE-2467634489 [2,0,0,0,0,0|1,0,0]=3 265 B9R2.39 O=C1CC2CCC1N2 MCULE-2060564396 [2,0,0,0,0,0|2,0,0]=4 266 B9R2.39 O=C1CC2CCC1N2 MCULE-3298355504 [2,0,0,0,0,0|2,0,0]=4 267 B9R2.39 O=C1CC2CCC1O2 MCULE-3122768457 [2,0,0,0,0,0|2,0,0]=4 268 B9R2.39 O=C1CC2CNC1C2 MCULE-1302527504 [2,0,0,0,0,0|2,0,0]=4 269 B9R2.39 O=C1CC2CNC1C2 MCULE-3367580397 [2,0,0,0,0,0|2,0,0]=4 270 B9R2.39 O=C1CN2CCC1C2 MCULE-2930167084 [2,0,0,0,0,0|2,0,0]=4 271 B9R2.39 O=C1CN2CCC1C2 MCULE-6962814008 [2,0,0,0,0,0|2,0,0]=4 272 B9R2.39 O=C1C[C@@H]2CC[C@H]1C2 MCULE-9992741520 [2,0,0,0,0,0|1,0,0]=3 273 B9R2.39 O=C1C[C@H]2CC[C@@H]1C2 MCULE-2228698965 [2,0,0,0,0,0|1,0,0]=3 274 B9R2.39 O=C1NC2CCC1C2 MCULE-2050587567 [2,0,0,0,0,0|2,0,0]=4 275 B9R2.39 O=C1N[C@@H]2CC[C@H]1C2 MCULE-2601085316 [2,0,0,0,0,0|2,0,0]=4 276 B9R2.39 O=C1N[C@H]2CC[C@@H]1C2 MCULE-6863863448 [2,0,0,0,0,0|2,0,0]=4 277 B9R2.39 OC1CC2CCC1C2 MCULE-6414891759 [2,0,0,0,0,0|1,0,1]=4 278 B9R2.39 OC1C[C@@H]2CC[C@H]1C2 MCULE-9639323400 [2,0,0,0,0,0|1,0,1]=4 279 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-4979276205 [2,0,0,0,0,0|1,0,1]=4 280 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1C2 MCULE-6071426979 [2,0,0,0,0,0|1,0,1]=4 281 B9R2.39 [C@@H]1(C[C@@H]2CC[C@H]1C2)O MCULE-6218681459 [2,0,0,0,0,0|1,0,1]=4 282 B9R2.39 [C@@H]12C=C([C@@H](C1)CC2)Br MCULE-1979441209 [2,0,0,0,0,0|1,0,1]=4 283 B9R2.39 [C@@H]12C=C([C@@H](C1)CC2)C MCULE-9983936985 [2,0,0,0,0,0|0,0,1]=3 284 B9R2.39 [C@@H]12C=C[C@@H](C1)C(=C)C2 MCULE-9536433682 [2,0,0,0,0,0|0,0,2]=4 285 B9R2.39 [C@H]12CCN(C1)CC2=O MCULE-4642920839 [2,0,0,0,0,0|2,0,0]=4 286 B9R2.39 [C@H]12CC[C@H](C1)C(=O)N2 MCULE-3838940137 [2,0,0,0,0,0|2,0,0]=4 287 B9R2.39 [C@H]12CC[C@H](C1)CC2=O MCULE-1488894938 [2,0,0,0,0,0|1,0,0]=3 288 B9R2.39 [C@H]12CC[C@H](C1)CC2N MCULE-3255653886 [2,0,0,0,0,0|1,0,1]=4 289 B9R2.39 [C@H]12CC[C@H](C1)CC2O MCULE-7175651186 [2,0,0,0,0,0|1,0,1]=4 290 B9R2.39 [C@H]12CC[C@H](C1)C[C@@H]2Br MCULE-5055207580 [2,0,0,0,0,0|1,0,1]=4 291 B9R2.39 [C@H]12CC[C@H](C1)C[C@@H]2Br MCULE-6523129084 [2,0,0,0,0,0|1,0,1]=4 292 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)N MCULE-6992871131 [2,0,0,0,0,0|1,0,1]=4 293 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)N MCULE-7207127845 [2,0,0,0,0,0|1,0,1]=4 294 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)N MCULE-7451668129 [2,0,0,0,0,0|1,0,1]=4 295 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)N MCULE-9963967295 [2,0,0,0,0,0|1,0,1]=4 296 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)O MCULE-4118507960 [2,0,0,0,0,0|1,0,1]=4 297 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)O MCULE-9141970579 [2,0,0,0,0,0|1,0,1]=4 298 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)N MCULE-9389098423 [2,0,0,0,0,0|1,0,1]=4 299 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)N MCULE-9481703506 [2,0,0,0,0,0|1,0,1]=4 300 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)O MCULE-4746309717 [2,0,0,0,0,0|1,0,1]=4 301 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)O MCULE-5454625797 [2,0,0,0,0,0|1,0,1]=4 302 B11R1.173 CC(C)(C(=O)N)N1CCCC1 MCULE-5097770694 [0,1,1,0,0,0|2,0,0]=4 303 B11R1.173 CC(C)(C(=O)O)C1CCCC1 MCULE-5248636717 [0,1,1,0,0,0|1,0,0]=3 304 B11R1.173 CC(C)(C(=O)O)C1CCCO1 MCULE-3286369410 [0,1,1,0,0,0|2,0,0]=4 305 B11R1.173 CC(C)(C(=O)O)N1CCCC1 MCULE-2646832399 [0,1,1,0,0,0|2,0,0]=4 306 B11R1.173 CC(C)(C(=O)O)N1CCCC1 MCULE-5606046525 [0,1,1,0,0,0|2,0,0]=4 307 B11R1.623 CC(C)(CN)C1(CCCC1)O MCULE-1468978622 [0,1,1,0,0,0|1,0,1]=4 308 B11R1.31 CNC(C)C(=O)N1CCCC1 MCULE-9874740444 [0,1,1,0,0,0|2,0,0]=4 309 B11R1.31 CON(C)C(=O)C1CCCC1 MCULE-7747705289 [0,1,1,0,0,0|2,0,0]=4 310 B11R1.89 CC(C)N(C)[C@@H]1CCC[C@H]1O MCULE-9754690915 [0,1,1,0,0,0|1,0,1]=4 311 B11R1.314 CC(C)C(=O)N1CCC(C1)N MCULE-3210395030 [0,1,1,0,0,0|2,0,0]=4 312 B11R1.314 CC(C)C(=O)N1CCC(C1)N MCULE-8680530030 [0,1,1,0,0,0|2,0,0]=4 313 B11R1.314 CC(C)C(=O)N1CC[C@@H](C1)N MCULE-2283681322 [0,1,1,0,0,0|2,0,0]=4 314 B11R1.314 CC(C)C(=O)N1CC[C@@H](C1)N MCULE-5478473153 [0,1,1,0,0,0|2,0,0]=4 315 B11R1.314 CC(C)C(=O)N1CC[C@H](C1)N MCULE-4676550885 [0,1,1,0,0,0|2,0,0]=4 316 B11R1.314 CC(C)C(=O)N1CC[C@H](C1)N MCULE-6183459199 [0,1,1,0,0,0|2,0,0]=4 317 B11R1.314 CN(C)C(=O)[C@@H]1CC[C@@H](C1)N MCULE-5905989204 [0,1,1,0,0,0|2,0,0]=4 318 B11R1.314 CN(C)C(=O)[C@@H]1CC[C@@H](C1)N MCULE-6712067487 [0,1,1,0,0,0|2,0,0]=4 319 B11R1.357 CC(C)(Br)C(=O)N1CCCC1 MCULE-3800646656 [0,1,1,0,0,0|2,0,0]=4 320 B11R1.357 CC(C)(C)C(=O)N1CCCC1 MCULE-3052985977 [0,1,1,0,0,0|2,0,0]=4 321 B11R1.357 CC(C)(C)C(O)C1CCCC1 MCULE-8010379352 [0,1,1,0,0,0|1,0,1]=4 322 B11R1.357 CC(C)(N)C(=O)N1CCCC1 MCULE-7529281086 [0,1,1,0,0,0|2,0,0]=4 323 B11R1.357 CC(C)(N)C(=O)N1CCCC1 MCULE-8940768890 [0,1,1,0,0,0|2,0,0]=4 324 B11R1.1105 CN(C)C(=O)C1(CCCC1)N MCULE-6192804655 [0,1,1,0,0,0|2,0,0]=4 325 B11R1.175 CC(C)N1CCC(C1)C(=O)O MCULE-8639127114 [0,1,1,0,0,0|2,0,0]=4 326 B11R1.553 CC1CC(=O)C(N(C1)C)(C)C MCULE-5123077543 [0,1,1,0,0,0|2,0,0]=4 327 B11R1.553 CC1CC(=O)C(N(C1)C)(C)C MCULE-8421473217 [0,1,1,0,0,0|2,0,0]=4 328 B11R1.126 CNCC1CCN(C1(C)C)C MCULE-5972350724 [0,1,1,0,0,0|1,0,1]=4 329 B11R1.325 CC1CC(=O)CC(C1=O)(C)C MCULE-1145217211 [0,1,1,0,0,0|1,0,1]=4 330 B11R1.325 CC1CC(CC(C1=O)(C)C)O MCULE-6456634015 [0,1,1,0,0,0|1,0,0]=3 331 B11R1.424 CC1=C(C(CCC1)(C)C)C=O MCULE-7819289735 [0,1,1,0,0,0|0,0,1]=3 332 B11R1.424 CC1=C(C(CCC1)(C)C)CBr MCULE-9026935253 [0,1,1,0,0,0|0,0,2]=4 333 B11R1.424 CC1=C(C(CCC1)(C)C)CO MCULE-2011068282 [0,1,1,0,0,0|0,0,2]=4 334 B11R1.680 CC1C(=O)CCC(C1=O)(C)C MCULE-7007078724 [0,1,1,0,0,0|1,0,1]=4 335 B11R1.1322 CC1(CCCC(C1=O)(C)C)C MCULE-3860651016 [0,1,1,0,0,0|1,0,0]=3 336 B11R1.1322 CC1(CCCC(N1Cl)(C)C)C MCULE-6764857487 [0,1,1,0,0,0|2,0,0]=4 337 B11R1.1322 CC1(CCCC(N1O)(C)C)C MCULE-7714374072 [0,1,1,0,0,0|2,0,0]=4 338 B11R1.1322 CC1(CCCC(S1=O)(C)C)C MCULE-8245958169 [0,1,1,0,0,0|2,0,0]=4 339 B11R1.1322 CN1C(CCCC1(C)C)(C)C MCULE-2867340834 [0,1,1,0,0,0|1,0,1]=4 340 B11R1.1322 CN1C(CCCC1(C)C)(C)C MCULE-5129903172 [0,1,1,0,0,0|1,0,1]=4 341 B11R2.28 NC1C2CCC(C2)C1CO MCULE-1725281831 [1,1,0,0,0,0|1,0,1]=4 342 B11R2.28 NC1C2CCC(C2)C1CO MCULE-3684102264 [1,1,0,0,0,0|1,0,1]=4 343 B11R2.28 N[C@H]1[C@@H]2CC[C@@H](C2)[C@H]1CO MCULE-2098065894 [1,1,0,0,0,0|1,0,1]=4 344 B11R2.28 N[C@H]1[C@@H]2CC[C@@H](C2)[C@H]1CO MCULE-2758013761 [1,1,0,0,0,0|1,0,1]=4 345 B11R2.228 CC1(CC2CCC1C2)CN MCULE-6321953937 [1,1,0,0,0,0|0,0,1]=3 346 B11R2.228 CC1(CC2CCC1O2)CN MCULE-1210920318 [1,1,0,0,0,0|1,0,1]=4 347 B11R2.228 CC1(CC2CCC1O2)CN MCULE-7586266194 [1,1,0,0,0,0|1,0,1]=4 348 B11R2.228 CNC1(CC2CCC1C2)C MCULE-3638598443 [1,1,0,0,0,0|0,0,1]=3 349 B13R2.11621 CC1C2CCC(C2)C(N1C)(C)C MCULE-5290786974 [0,1,0,0,0,1|1,0,1]=4 350 B13R2.11621 CC1N(C2CCC(C2)C1(C)C)C MCULE-2280315328 [0,1,0,0,0,1|0,0,2]=4 351 B13R2.2794 CC1(C(=NO)[C@]2(CC[C@H]1C2)C)C MCULE-4474346494 [0,2,0,0,0,0|1,0,0]=3 352 B13R2.2794 CC12CCC(C1)C(C2=NO)(C)C MCULE-5051712402 [0,2,0,0,0,0|1,0,0]=3 353 B13R2.2794 [C@@H]12CC[C@@](C1)(C(=NO)C2(C)C)C MCULE-6459997304 [0,2,0,0,0,0|1,0,0]=3 354 B13R2.27149 CC12CCC(C1)(C(=O)C2(C)C)Br MCULE-3096535370 [0,2,0,0,0,0|1,0,0]=3 355 B13R2.2560 CNC1(C2CCC(C2)C1(C)C)C MCULE-5035897059 [0,2,0,0,0,0|0,0,2]=4 356 B13R2.2560 CNC1(C2CCC(C2)C1(C)C)C MCULE-5547717559 [0,2,0,0,0,0|0,0,2]=4 357 B13R2.2560 CN[C@@]1([C@H]2CC[C@H](C2)C1(C)C)C MCULE-2410512376 [0,2,0,0,0,0|0,0,2]=4 358 B13R2.2560 CN[C@@]1([C@H]2CC[C@H](C2)C1(C)C)C MCULE-4501166886 [0,2,0,0,0,0|0,0,2]=4 359 B13R2.2560 CN[C@]1([C@@H]2CC[C@@H](C2)C1(C)C)C MCULE-8169123248 [0,2,0,0,0,0|0,0,2]=4 360 B13R2.2560 CN[C@]1([C@@H]2CC[C@@H](C2)C1(C)C)C MCULE-9478920090 [0,2,0,0,0,0|0,0,2]=4 361 B13R2.2560 [C@H]12CC[C@H](C1)C(C2(C)NC)(C)C MCULE-3449898380 [0,2,0,0,0,0|0,0,2]=4 362 B13R2.2560 [C@H]12CC[C@H](C1)C(C2(C)NC)(C)C MCULE-5213181241 [0,2,0,0,0,0|0,0,2]=4 363 B13R2.2560 [C@H]12CC[C@H](C1)C(C2(C)NC)(C)C MCULE-5312515860 [0,2,0,0,0,0|0,0,2]=4 364 B13R2.2560 [C@H]12CC[C@H](C1)C(C2(C)NC)(C)C MCULE-7781413483 [0,2,0,0,0,0|0,0,2]=4 365 B13R2.2344 CC1C2CCC(C2)C1(C)N(C)C MCULE-4471674974 [0,2,0,0,0,0|0,0,2]=4 366 B9R0.19 CCCC(O)C(C)(C)C=O MCULE-4408009121 [0,0,2,0,0,0|2,0,0]=4 367 B9R0.20 CCCCCC(C)(C)C=O MCULE-9322679488 [0,0,2,0,0,0|1,0,0]=3 368 B9R0.20 CCCCCC(C)(C)CC MCULE-1624392380 [0,0,2,0,0,0|0,0,2]=4 369 B9R0.20 CCCCCC(C)(C)CN MCULE-5282463066 [0,0,2,0,0,0|1,0,1]=4 370 B9R0.20 CCOCCC(C)(C)C=O MCULE-2777298648 [0,0,2,0,0,0|2,0,0]=4 371 B9R0.6 CCCC(C)C(=O)C(C)C MCULE-1550454602 [0,0,2,0,0,0|1,0,0]=3 372 B9R0.6 CCCC(C)C(O)C(C)C MCULE-8969797324 [0,0,2,0,0,0|1,0,1]=4 373 B9R0.47 C=CCCCC(C)C(=O)C MCULE-3594332716 [0,0,2,0,0,0|1,0,1]=4 374 B9R0.47 CCCCCC(=O)N(C)C MCULE-8721349489 [0,0,2,0,0,0|2,0,0]=4 375 B9R0.47 CCCCCC(C)C(C)C MCULE-2636833283 [0,0,2,0,0,0|0,0,2]=4 376 B9R0.47 CCCCCC(O)C(C)C MCULE-1365333754 [0,0,2,0,0,0|1,0,1]=4 377 B9R0.47 CCCCOC(=O)C(C)C MCULE-8044191721 [0,0,2,0,0,0|2,0,0]=4 378 B9R0.1 CC(C)CCCC(C)CO MCULE-8737374566 [0,0,2,0,0,0|1,0,1]=4 379 B9R0.1 CCC(C)CCCC(C)C MCULE-1067814067 [0,0,2,0,0,0|0,0,2]=4 380 B9R0.32 CC(C)C(=O)C(C)(C)CO MCULE-3368124870 [0,0,2,0,0,0|2,0,0]=4 381 B11R2.1031 O=C(C1CCCC1)C2CC2 MCULE-7638041005 [0,0,1,1,0,0|1,0,0]=3 382 B11R2.533 CC1CCC2CC1C2(C)C MCULE-5302428878 [0,0,1,1,0,0|0,0,2]=4 383 B11R2.533 [C@H]12CCC([C@H](C1)C2(C)C)C MCULE-8836227484 [0,0,1,1,0,0|0,0,2]=4 384 B11R3.107 C1CC2CC1C3C2NC3 MCULE-1493248135 [1,0,0,1,0,0|1,0,1]=4 385 B9R1.62 CC(C)(CN)C1CCC1 MCULE-8259290025 [0,0,1,0,1,0|1,0,1]=4 386 B9R1.62 CC(C)(CN)C1CCC1 MCULE-9714003350 [0,0,1,0,1,0|1,0,1]=4 387 B9R1.62 CC(C)(CO)C1CCC1 MCULE-4617502237 [0,0,1,0,1,0|1,0,1]=4 388 B9R1.110 CC(C)C(N)C1CCC1 MCULE-3337597801 [0,0,1,0,1,0|1,0,1]=4 389 B9R1.95 CC(C)C1CC(C1)CO MCULE-8967711451 [0,0,1,0,1,0|1,0,1]=4 390 B9R1.107 COC1CC(=O)C1(C)C MCULE-8233585132 [0,0,1,0,1,0|2,0,0]=4 391 B11R1.7 CC(C)(C#N)C1CCCCC1 MCULE-4450905733 [0,0,1,0,0,1|1,0,1]=4 392 B11R1.7 CC(C)(C#N)C1CCNCC1 MCULE-4098104494 [0,0,1,0,0,1|1,0,1]=4 393 B11R1.7 CC(C)(C#N)C1CCNCC1 MCULE-6211341471 [0,0,1,0,0,1|1,0,1]=4 394 B11R1.7 CC(C)(C=O)C1CCCCO1 MCULE-8199743628 [0,0,1,0,0,1|1,0,0]=3 395 B11R1.7 CC(C)(C=O)C1CCOCC1 MCULE-9132417790 [0,0,1,0,0,1|1,0,0]=3 396 B11R1.7 CC(C)(C=O)N1CCCCC1 MCULE-4690856825 [0,0,1,0,0,1|2,0,0]=4 397 B11R1.7 CC(C)(C=O)N1CCOCC1 MCULE-4245842825 [0,0,1,0,0,1|2,0,0]=4 398 B11R1.7 CC(C)(CN)C1CCCCC1 MCULE-7524157111 [0,0,1,0,0,1|1,0,1]=4 399 B11R1.7 CC(C)(CN)C1CCOCC1 MCULE-4521826311 [0,0,1,0,0,1|1,0,1]=4 400 B11R1.7 CC(C)(CO)C1CCNCC1 MCULE-7984200795 [0,0,1,0,0,1|1,0,1]=4 401 B11R1.7 CC(C)(CO)C1CCOCC1 MCULE-4008950912 [0,0,1,0,0,1|1,0,1]=4 402 B11R1.7 COC(C)(C)C1CCNCC1 MCULE-4208662684 [0,0,1,0,0,1|1,0,1]=4 403 B11R1.7 COC(C)(C)C1CCNCC1 MCULE-4323920441 [0,0,1,0,0,1|1,0,1]=4 404 B11R1.136 CC(C)(C=O)CN1CCCC1 MCULE-9568826274 [0,0,1,0,0,1|2,0,0]=4 405 B11R1.35 CC(Br)C(=O)NC1CCCC1 MCULE-8994601074 [0,0,1,0,0,1|2,0,0]=4 406 B11R1.35 CC(C)C(=O)NC1CCCC1 MCULE-8930764724 [0,0,1,0,0,1|1,0,0]=3 407 B11R1.35 CC(C)C(=O)NC1CCNC1 MCULE-2693735000 [0,0,1,0,0,1|2,0,0]=4 408 B11R1.35 CC(C)C(=O)NC1CCNC1 MCULE-4545402182 [0,0,1,0,0,1|2,0,0]=4 409 B11R1.35 CC(C)C(=O)OC1CCNC1 MCULE-1897039175 [0,0,1,0,0,1|2,0,0]=4 410 B11R1.35 CC(C)C(=O)OC1CCNC1 MCULE-4688053506 [0,0,1,0,0,1|2,0,0]=4 411 B11R1.35 CC(Cl)C(=O)NC1CCCC1 MCULE-6179679420 [0,0,1,0,0,1|2,0,0]=4 412 B11R1.35 CC(N)C(=O)NC1CCCC1 MCULE-4460989998 [0,0,1,0,0,1|2,0,0]=4 413 B11R1.35 CC(N)C(=O)NC1CCCC1 MCULE-9769149357 [0,0,1,0,0,1|2,0,0]=4 414 B11R1.35 CC(N)C(=O)OC1CCCC1 MCULE-1385083148 [0,0,1,0,0,1|2,0,0]=4 415 B11R1.35 CC(N)C(=O)OC1CCCC1 MCULE-2778018010 [0,0,1,0,0,1|2,0,0]=4 416 B11R1.35 C[C@H](N)C(=O)OC1CCCC1 MCULE-1052483898 [0,0,1,0,0,1|2,0,0]=4 417 B11R1.35 C[C@H](N)C(=O)OC1CCCC1 MCULE-3650247487 [0,0,1,0,0,1|2,0,0]=4 418 B11R1.35 C[C@H](N)C(=O)OC1CCCC1 MCULE-4734611634 [0,0,1,0,0,1|2,0,0]=4 419 B11R1.35 C[C@H](N)C(=O)OC1CCCC1 MCULE-8772465030 [0,0,1,0,0,1|2,0,0]=4 420 B11R1.36 CC(Br)C(=O)C1CCCCC1 MCULE-4484974923 [0,0,1,0,0,1|2,0,0]=4 421 B11R1.36 CC(Br)C(=O)C1CCOCC1 MCULE-2454801143 [0,0,1,0,0,1|2,0,0]=4 422 B11R1.36 CC(C)C(=O)C1CCCCC1 MCULE-1345110870 [0,0,1,0,0,1|1,0,0]=3 423 B11R1.36 CC(C)C(=O)N1CCNCC1 MCULE-5657903890 [0,0,1,0,0,1|2,0,0]=4 424 B11R1.36 CC(C)C(=O)N1CCNCC1 MCULE-5777224741 [0,0,1,0,0,1|2,0,0]=4 425 B11R1.36 CC(C)C(=O)N1CCOCC1 MCULE-5428533096 [0,0,1,0,0,1|2,0,0]=4 426 B11R1.36 CC(C)C(Br)C1CCCCC1 MCULE-1793358410 [0,0,1,0,0,1|1,0,1]=4 427 B11R1.36 CC(C)C(N)C1CCOCC1 MCULE-3097835196 [0,0,1,0,0,1|1,0,1]=4 428 B11R1.36 CC(C)C(O)C1CCCCC1 MCULE-6415047729 [0,0,1,0,0,1|1,0,1]=4 429 B11R1.36 CC(C)C(O)C1CCNCC1 MCULE-2061650451 [0,0,1,0,0,1|1,0,1]=4 430 B11R1.36 CC(C)C(O)C1CCNCC1 MCULE-3233317724 [0,0,1,0,0,1|1,0,1]=4 431 B11R1.36 CC(C)N(C)C1CCCNC1 MCULE-6611203397 [0,0,1,0,0,1|1,0,1]=4 432 B11R1.36 CC(C)N(C)C1CCNCC1 MCULE-2376083243 [0,0,1,0,0,1|1,0,1]=4 433 B11R1.36 CC(C)N(C)C1CCNCC1 MCULE-4049096932 [0,0,1,0,0,1|1,0,1]=4 434 B11R1.36 CC(C)N(C)[C@@H]1CCCNC1 MCULE-3549919139 [0,0,1,0,0,1|1,0,1]=4 435 B11R1.36 CC(C)N(C)[C@H]1CCCNC1 MCULE-3020559482 [0,0,1,0,0,1|1,0,1]=4 436 B11R1.36 CC(Cl)C(=O)C1CCOCC1 MCULE-8997626497 [0,0,1,0,0,1|2,0,0]=4 437 B11R1.36 CN(C)C(=O)C1CCCCC1 MCULE-8875175423 [0,0,1,0,0,1|2,0,0]=4 438 B11R1.36 CN(C)C(=O)C1CCCCN1 MCULE-2931387869 [0,0,1,0,0,1|2,0,0]=4 439 B11R1.36 CN(C)C(=O)C1CCCCN1 MCULE-5624191614 [0,0,1,0,0,1|2,0,0]=4 440 B11R1.36 CN(C)C(=O)C1CCCNC1 MCULE-1424692683 [0,0,1,0,0,1|2,0,0]=4 441 B11R1.36 CN(C)C(=O)C1CCCNC1 MCULE-4670348062 [0,0,1,0,0,1|2,0,0]=4 442 B11R1.36 CN(C)C(=O)C1CCCNC1 MCULE-7340503446 [0,0,1,0,0,1|2,0,0]=4 443 B11R1.36 CN(C)C(=O)C1CCNCC1 MCULE-2368712308 [0,0,1,0,0,1|2,0,0]=4 444 B11R1.36 CN(C)C(=O)C1CCNCC1 MCULE-2721627153 [0,0,1,0,0,1|2,0,0]=4 445 B11R1.36 CN(C)C(=O)C1CCNCC1 MCULE-6317505237 [0,0,1,0,0,1|2,0,0]=4 446 B11R1.36 CN(C)C(=O)C1CCOCC1 MCULE-2130423105 [0,0,1,0,0,1|2,0,0]=4 447 B11R1.36 CN(C)C(=O)[C@@H]1CCCCN1 MCULE-7323988240 [0,0,1,0,0,1|2,0,0]=4 448 B11R1.36 CN(C)C(=O)[C@H]1CCCNC1 MCULE-7923391805 [0,0,1,0,0,1|2,0,0]=4 449 B11R1.77 CC(C)NC(=O)C1CCCC1 MCULE-6018445504 [0,0,1,0,0,1|1,0,0]=3 450 B11R1.77 CC(C)NC(=O)C1CCCN1 MCULE-2236172771 [0,0,1,0,0,1|2,0,0]=4 451 B11R1.77 CC(C)NC(=O)C1CCCN1 MCULE-3947942467 [0,0,1,0,0,1|2,0,0]=4 452 B11R1.77 CC(C)NC(=O)C1CCNC1 MCULE-7074166356 [0,0,1,0,0,1|2,0,0]=4 453 B11R1.77 CC(C)NC(=O)C1CCNC1 MCULE-8598639849 [0,0,1,0,0,1|2,0,0]=4 454 B11R1.77 CC(C)NC(=O)N1CCCC1 MCULE-2067855149 [0,0,1,0,0,1|2,0,0]=4 455 B11R1.77 CC(C)OC(=O)[C@@H]1CCCN1 MCULE-1820411827 [0,0,1,0,0,1|2,0,0]=4 456 B11R1.77 CC(C)OC(=O)[C@H]1CCCN1 MCULE-2054417002 [0,0,1,0,0,1|2,0,0]=4 457 B11R1.77 CC(C)OC(=O)[C@H]1CCCN1 MCULE-3399993830 [0,0,1,0,0,1|2,0,0]=4 458 B11R1.3 C#CC1CCC(CC1)C(C)C MCULE-5027592966 [0,0,1,0,0,1|0,0,2]=4 459 B11R1.3 C#C[C@H]1CC[C@@H](CC1)C(C)C MCULE-3426727450 [0,0,1,0,0,1|0,0,2]=4 460 B11R1.3 C=C[C@H]1CC[C@@H](CC1)C(C)C MCULE-1293150071 [0,0,1,0,0,1|0,0,0]=2 461 B11R1.3 CC(C)C1=CCC(CC1)C=O MCULE-3713295993 [0,0,1,0,0,1|1,0,1]=4 462 B11R1.3 CC(C)C1CCC(CC1)C#N MCULE-6616550414 [0,0,1,0,0,1|1,0,1]=4 463 B11R1.3 CC(C)C1CCC(CC1)CN MCULE-3653505408 [0,0,1,0,0,1|1,0,1]=4 464 B11R1.3 CC(C)C1CCC(CC1)CO MCULE-4715905622 [0,0,1,0,0,1|1,0,1]=4 465 B11R1.3 CC(C)N1CCC(CC1)C=O MCULE-7089062210 [0,0,1,0,0,1|2,0,0]=4 466 B11R1.3 CC(C)N1CCC(CC1)C=O MCULE-8068059357 [0,0,1,0,0,1|2,0,0]=4 467 B11R1.3 CC(C)[C@H]1CC[C@@H](CC1)C=O MCULE-8617365920 [0,0,1,0,0,1|1,0,0]=3 468 B11R1.3 CC(C)[C@H]1CC[C@@H](CC1)CO MCULE-7392939602 [0,0,1,0,0,1|1,0,1]=4 469 B11R1.3 CC(C)[C@H]1CC[C@H](CC1)CO MCULE-1772765372 [0,0,1,0,0,1|1,0,1]=4 470 B11R1.3 CNC1CCC(CC1)C(C)C MCULE-7421182612 [0,0,1,0,0,1|1,0,1]=4 471 B11R1.3 CNC1CCC(CC1)C(C)C MCULE-9580863303 [0,0,1,0,0,1|1,0,1]=4 472 B11R1.266 CC(C)C1CC(CCO1)CN MCULE-3153217780 [0,0,1,0,0,1|1,0,1]=4 473 B11R1.266 CC(C)C1CC(CCO1)CN MCULE-7955998406 [0,0,1,0,0,1|1,0,1]=4 474 B11R1.266 CC(C)C1CC(CCO1)CO MCULE-6145121225 [0,0,1,0,0,1|1,0,1]=4 475 B11R1.281 CCN1CCC(=O)C(C1)(C)C MCULE-2809026561 [0,0,1,0,0,1|2,0,0]=4 476 B11R2.367 CC1C(=O)C2CCN1CC2 MCULE-2746563340 [1,0,0,0,0,1|2,0,0]=4 477 B11R2.367 CC1C(=O)C2CCN1CC2 MCULE-9976772785 [1,0,0,0,0,1|2,0,0]=4 478 B11R2.508 CC1(CC2CCC1CC2)O MCULE-1647581906 [1,0,0,0,0,1|1,0,1]=4