0 B10R1.329 CC1CC(=O)CC(C)(C)C1 P44666 [0,0,0,0,0,0|0,0,2]=2 1 B10R1.329 CC1CC(N)CC(C)(C)C1 P47827 [0,0,0,0,0,0|1,0,0]=1 2 B10R1.329 CN1CC(N)CC(F)(F)C1 Q63694 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.329 CN1CC(O)CC(F)(F)C1 Q62889 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.329 C[C@H]1C[C@@H](N)CC(C)(C)C1 P46946 [0,0,0,0,0,0|1,0,0]=1 5 B9R1.34 CC1CC(=O)CC(C)N1 O29876 [1,0,0,0,0,0|1,0,2]=4 6 B9R1.34 CC1CC(=O)CC(C)O1 F-4696 [1,0,0,0,0,0|1,0,2]=4 7 B9R1.34 CC1CC(Br)CC(C)O1 Q57698 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.34 CC1CC(N)CC(C)O1 Q54459 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.34 CN1CC(N)CC(F)C1 Q63697 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)O1 Q55059 [1,0,0,0,0,0|1,0,2]=4 11 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)O1 Q55809 [1,0,0,0,0,0|1,0,2]=4 12 B9R1.34 C[C@@H]1C[C@H](O)C[C@H](C)C1 P45201 [1,0,0,0,0,0|0,0,0]=1 13 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)N1 L13865 [1,0,0,0,0,0|1,0,2]=4 14 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)N1 Q55528 [1,0,0,0,0,0|1,0,2]=4 15 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)O1 L14381 [1,0,0,0,0,0|1,0,2]=4 16 B9R1.34 C[C@H]1CC(=O)C[C@H](C)O1 Q55060 [1,0,0,0,0,0|1,0,2]=4 17 B9R1.34 C[C@H]1CC(Br)C[C@@H](C)O1 Q57870 [1,0,0,0,0,0|2,0,0]=3 18 B9R1.34 C[C@H]1CC(N)C[C@@H](C)O1 Q61447 [1,0,0,0,0,0|2,0,0]=3 19 B9R1.34 C[C@H]1CC(O)C[C@H](C)N1 Q61338 [1,0,0,0,0,0|1,0,0]=2 20 B9R1.34 C[C@H]1C[C@@H](O)C[C@@H](C)N1 Q61337 [1,0,0,0,0,0|1,0,0]=2 21 B9R1.34 N[C@@H]1C[C@H](F)C[C@H](N)C1 P46165 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.66 C=C1CCOC(C)(C)C1 Q54981 [1,0,0,0,0,0|1,0,2]=4 23 B9R1.66 CC1(C)CC(=O)CCN1 O34587 [1,0,0,0,0,0|1,0,2]=4 24 B9R1.66 CC1(C)CC(=O)CCO1 F-4698 [1,0,0,0,0,0|1,0,2]=4 25 B9R1.66 CC1(C)CC(Br)CCO1 Q57806 [1,0,0,0,0,0|2,0,0]=3 26 B9R1.66 CC1(C)CC(N)CCO1 Q55597 [1,0,0,0,0,0|2,0,0]=3 27 B9R1.66 CC1(C)CC(O)CCN1 O34540 [1,0,0,0,0,0|1,0,0]=2 28 B9R1.66 CC1(C)CCCC(N)C1 P44411 [1,0,0,0,0,0|1,0,0]=2 29 B9R1.66 CC1(C)CCCC(N)C1 Q52202 [1,0,0,0,0,0|1,0,0]=2 30 B9R1.66 CC1(C)CCC[C@@H](N)C1 P44800 [1,0,0,0,0,0|1,0,0]=2 31 B9R1.66 CC1(C)CCC[C@H](N)C1 P44801 [1,0,0,0,0,0|1,0,0]=2 32 B9R1.66 CC1(C)COCC(=O)C1 Q61431 [1,0,0,0,0,0|1,0,2]=4 33 B9R1.66 CC1CC(C)(O)CCN1 Q65228 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.66 CC1CC(F)(F)CCN1 G-5529 [1,0,0,0,0,0|3,0,0]=4 35 B9R1.66 CN1CCCC(C)(N)C1 H-8147 [1,0,0,0,0,0|2,0,0]=3 36 B9R1.66 C[C@@H]1CC(F)(F)CCN1 Q63702 [1,0,0,0,0,0|3,0,0]=4 37 B9R1.66 C[C@@H]1CC(F)(F)CCN1 Q63703 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.66 C[C@@H]1CNCC(C)(C)N1 K12345 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.66 C[C@H]1CC(F)(F)CCN1 Q63700 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.66 C[C@H]1CC(F)(F)CCN1 Q63701 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.66 C[C@H]1CNCC(C)(C)N1 K12344 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.66 NC1CCCC(F)(F)C1 L21654 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.66 NC1CCCC(F)(F)C1 L22484 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.66 N[C@@H]1CCCC(F)(F)C1 P46161 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.66 N[C@H]1CCCC(F)(F)C1 P49405 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.66 O=S1(=O)CCCC(O)C1 Q57891 [1,0,0,0,0,0|3,0,0]=4 47 B9R1.66 OC1CCCC(F)(F)C1 P44779 [1,0,0,0,0,0|2,0,0]=3 48 B9R1.66 OC1CNCC(F)(F)C1 Q55177 [1,0,0,0,0,0|3,0,0]=4 49 B11R1.1362 CC1(C)CC(=O)CC(C)(C)O1 G-7637 [0,1,0,0,0,0|1,0,2]=4 50 B11R1.1362 CC1(C)CC(Br)CC(C)(C)O1 Q52291 [0,1,0,0,0,0|2,0,0]=3 51 B11R1.1362 CC1(C)CC(I)CC(C)(C)O1 Q52292 [0,1,0,0,0,0|2,0,0]=3 52 B11R1.1362 CC1(C)CC(N)CC(C)(C)N1 Q65295 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.1362 CC1(C)CC(N)CC(C)(C)O1 Q52290 [0,1,0,0,0,0|2,0,0]=3 54 B11R1.1362 CC1(C)CC(O)CC(C)(C)O1 L13707 [0,1,0,0,0,0|1,0,0]=2 55 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Q68973 [0,0,1,0,0,0|2,0,1]=4 56 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Q68975 [0,0,1,0,0,0|2,0,1]=4 57 B9R0.53 CC(C)C[C@H](N)CC(=O)O P39532 [0,0,1,0,0,0|2,0,1]=4 58 B9R0.53 CC(C)C[C@H](N)CC(=O)O Q68972 [0,0,1,0,0,0|2,0,1]=4 59 B11R2.526 CC1(O)CC2CCC(C1)N2 L18092 [0,0,0,1,0,0|3,0,0]=4 60 B11R2.526 CC1(O)CC2CCC(C1)N2 P45886 [0,0,0,1,0,0|3,0,0]=4 61 B11R2.526 C[C@@]1(O)C[C@@H]2CC[C@H](C1)N2 P45036 [0,0,0,1,0,0|3,0,0]=4 62 B9R1.36 CC1(C)CC(O)C(O)C1 Q61732 [0,0,0,0,1,0|1,0,0]=2 63 B9R1.36 CC1CC(C)(C)CC1=O Q61089 [0,0,0,0,1,0|0,0,2]=3 64 B9R1.36 O[C@@H]1CC(F)(F)C[C@H]1O Q57039 [0,0,0,0,1,0|3,0,0]=4 65 B9R1.36 O[C@H]1CC(F)(F)C[C@@H]1O Q57037 [0,0,0,0,1,0|3,0,0]=4 66 B9R1.36 O[C@H]1CC(F)(F)C[C@@H]1O Q57038 [0,0,0,0,1,0|3,0,0]=4 67 B9R1.38 CC1(C)NC(=O)CC1O Q64205 [0,0,0,0,1,0|2,0,1]=4 68 B9R1.38 CN1CC(O)C(F)(F)C1 Q62888 [0,0,0,0,1,0|3,0,0]=4 69 B8R1.4 CC1CC(Br)CCO1 Q57805 [2,0,0,0,0,0|2,0,0]=4 70 B8R1.4 CC1CC(N)CCO1 A-878 [2,0,0,0,0,0|2,0,0]=4 71 B8R1.4 CC1CC(O)CCN1 G-7300 [2,0,0,0,0,0|1,0,0]=3 72 B8R1.4 CC1CC(O)CCN1 L21311 [2,0,0,0,0,0|1,0,0]=3 73 B8R1.4 CC1CC(O)CCO1 A-877 [2,0,0,0,0,0|1,0,0]=3 74 B8R1.4 CC1CNCC(F)C1 Q54411 [2,0,0,0,0,0|2,0,0]=4 75 B8R1.4 CN1CCCC(N)C1 C-3293 [2,0,0,0,0,0|2,0,0]=4 76 B8R1.4 CN1CCCC(O)C1 C-3297 [2,0,0,0,0,0|1,0,0]=3 77 B8R1.4 CN1CCC[C@@H](N)C1 C-2766 [2,0,0,0,0,0|2,0,0]=4 78 B8R1.4 CN1CCC[C@@H](N)C1 I-9583 [2,0,0,0,0,0|2,0,0]=4 79 B8R1.4 CN1CCC[C@@H](O)C1 G-5242 [2,0,0,0,0,0|1,0,0]=3 80 B8R1.4 CN1CCC[C@H](N)C1 C-2767 [2,0,0,0,0,0|2,0,0]=4 81 B8R1.4 CN1CCC[C@H](N)C1 G-5241 [2,0,0,0,0,0|2,0,0]=4 82 B8R1.4 CN1CCC[C@H](O)C1 G-5243 [2,0,0,0,0,0|1,0,0]=3 83 B8R1.4 C[C@@H]1CCC[C@@H](C)N1 Q65231 [2,0,0,0,0,0|1,0,0]=3 84 B8R1.4 C[C@@H]1CCC[C@@H](C)N1 Q65232 [2,0,0,0,0,0|1,0,0]=3 85 B8R1.4 C[C@@H]1CCC[C@@H](N)C1 P49440 [2,0,0,0,0,0|1,0,0]=3 86 B8R1.4 C[C@@H]1CCC[C@@H](O)C1 P45249 [2,0,0,0,0,0|0,0,0]=2 87 B8R1.4 C[C@@H]1CCC[C@@H](O)C1 P45891 [2,0,0,0,0,0|0,0,0]=2 88 B8R1.4 C[C@@H]1CCC[C@H](N)C1 P45362 [2,0,0,0,0,0|1,0,0]=3 89 B8R1.4 C[C@@H]1CCC[C@H](N)C1 P49441 [2,0,0,0,0,0|1,0,0]=3 90 B8R1.4 C[C@@H]1CCC[C@H](O)C1 P45486 [2,0,0,0,0,0|0,0,0]=2 91 B8R1.4 C[C@@H]1CCC[C@H](O)C1 P45892 [2,0,0,0,0,0|0,0,0]=2 92 B8R1.4 C[C@@H]1CN(C)CCN1 L13059 [2,0,0,0,0,0|2,0,0]=4 93 B8R1.4 C[C@@H]1CN(C)CCN1 O33264 [2,0,0,0,0,0|2,0,0]=4 94 B8R1.4 C[C@@H]1CN(C)CCN1 P51464 [2,0,0,0,0,0|2,0,0]=4 95 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 10039 [2,0,0,0,0,0|2,0,0]=4 96 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 G-7092 [2,0,0,0,0,0|2,0,0]=4 97 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 I-9064 [2,0,0,0,0,0|2,0,0]=4 98 B8R1.4 C[C@@H]1COC[C@@H](C)N1 F-4699 [2,0,0,0,0,0|2,0,0]=4 99 B8R1.4 C[C@@H]1COC[C@@H](C)N1 H-8097 [2,0,0,0,0,0|2,0,0]=4 100 B8R1.4 C[C@@H]1COC[C@@H](C)N1 L21766 [2,0,0,0,0,0|2,0,0]=4 101 B8R1.4 C[C@@H]1C[C@H](F)CCN1 Q63705 [2,0,0,0,0,0|2,0,0]=4 102 B8R1.4 C[C@@H]1C[C@H](N)CCO1 Q61448 [2,0,0,0,0,0|2,0,0]=4 103 B8R1.4 C[C@@H]1C[C@H](O)CCN1 G-6431 [2,0,0,0,0,0|1,0,0]=3 104 B8R1.4 C[C@@H]1C[C@H](O)CCN1 Q56468 [2,0,0,0,0,0|1,0,0]=3 105 B8R1.4 C[C@H]1CCC[C@@H](N)C1 P45360 [2,0,0,0,0,0|1,0,0]=3 106 B8R1.4 C[C@H]1CCC[C@@H](O)C1 P45893 [2,0,0,0,0,0|0,0,0]=2 107 B8R1.4 C[C@H]1CCC[C@H](C)N1 Q65229 [2,0,0,0,0,0|1,0,0]=3 108 B8R1.4 C[C@H]1CCC[C@H](C)N1 Q65230 [2,0,0,0,0,0|1,0,0]=3 109 B8R1.4 C[C@H]1CCC[C@H](N)C1 P45361 [2,0,0,0,0,0|1,0,0]=3 110 B8R1.4 C[C@H]1CCC[C@H](O)C1 P45546 [2,0,0,0,0,0|0,0,0]=2 111 B8R1.4 C[C@H]1CN(C)CCN1 O34294 [2,0,0,0,0,0|2,0,0]=4 112 B8R1.4 C[C@H]1CNC[C@@H](C)N1 G-5759 [2,0,0,0,0,0|2,0,0]=4 113 B8R1.4 C[C@H]1CNC[C@H](C)N1 G-7093 [2,0,0,0,0,0|2,0,0]=4 114 B8R1.4 C[C@H]1CNC[C@H](C)N1 K12343 [2,0,0,0,0,0|2,0,0]=4 115 B8R1.4 C[C@H]1CNC[C@H](C)O1 G-6092 [2,0,0,0,0,0|2,0,0]=4 116 B8R1.4 C[C@H]1CNC[C@H](C)O1 H-8075 [2,0,0,0,0,0|2,0,0]=4 117 B8R1.4 C[C@H]1COC[C@@H](C)N1 G-7868 [2,0,0,0,0,0|2,0,0]=4 118 B8R1.4 C[C@H]1C[C@@H](F)CCN1 Q63704 [2,0,0,0,0,0|2,0,0]=4 119 B8R1.4 C[C@H]1C[C@@H](O)CCN1 G-6430 [2,0,0,0,0,0|1,0,0]=3 120 B8R1.4 C[C@H]1C[C@@H](O)CCN1 Q56467 [2,0,0,0,0,0|1,0,0]=3 121 B8R1.4 NC1CCCC(F)C1 P48941 [2,0,0,0,0,0|2,0,0]=4 122 B8R1.4 NC1CCCC(O)C1 F-4485 [2,0,0,0,0,0|1,0,0]=3 123 B8R1.4 NC1CCCC(O)C1 P51354 [2,0,0,0,0,0|1,0,0]=3 124 B8R1.4 NC1COCC(O)C1 O33183 [2,0,0,0,0,0|2,0,0]=4 125 B8R1.4 NC1COCC(O)C1 Q61082 [2,0,0,0,0,0|2,0,0]=4 126 B8R1.4 N[C@@H]1CCC[C@@H](N)C1 P45856 [2,0,0,0,0,0|2,0,0]=4 127 B8R1.4 N[C@@H]1CCC[C@@H](N)C1 P50869 [2,0,0,0,0,0|2,0,0]=4 128 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 L14375 [2,0,0,0,0,0|1,0,0]=3 129 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 P45284 [2,0,0,0,0,0|1,0,0]=3 130 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 P46977 [2,0,0,0,0,0|1,0,0]=3 131 B8R1.4 N[C@@H]1CCC[C@H](O)C1 P44060 [2,0,0,0,0,0|1,0,0]=3 132 B8R1.4 N[C@@H]1COC[C@@H](O)C1 Q54626 [2,0,0,0,0,0|2,0,0]=4 133 B8R1.4 N[C@@H]1COC[C@H](O)C1 Q54624 [2,0,0,0,0,0|2,0,0]=4 134 B8R1.4 N[C@@H]1COC[C@H](O)C1 Q54625 [2,0,0,0,0,0|2,0,0]=4 135 B8R1.4 N[C@H]1CCC[C@@H](F)C1 P48942 [2,0,0,0,0,0|2,0,0]=4 136 B8R1.4 N[C@H]1CCC[C@@H](F)C1 P50330 [2,0,0,0,0,0|2,0,0]=4 137 B8R1.4 N[C@H]1CCC[C@@H](N)C1 L14628 [2,0,0,0,0,0|2,0,0]=4 138 B8R1.4 N[C@H]1CCC[C@@H](N)C1 P45859 [2,0,0,0,0,0|2,0,0]=4 139 B8R1.4 N[C@H]1CCC[C@@H](N)C1 P48039 [2,0,0,0,0,0|2,0,0]=4 140 B8R1.4 N[C@H]1CCC[C@@H](O)C1 K10840 [2,0,0,0,0,0|1,0,0]=3 141 B8R1.4 N[C@H]1CCC[C@@H](O)C1 P44061 [2,0,0,0,0,0|1,0,0]=3 142 B8R1.4 N[C@H]1CCC[C@@H](O)C1 P45304 [2,0,0,0,0,0|1,0,0]=3 143 B8R1.4 N[C@H]1CCC[C@H](F)C1 P46535 [2,0,0,0,0,0|2,0,0]=4 144 B8R1.4 N[C@H]1CCC[C@H](N)C1 L18352 [2,0,0,0,0,0|2,0,0]=4 145 B8R1.4 N[C@H]1CCC[C@H](O)C1 O33050 [2,0,0,0,0,0|1,0,0]=3 146 B8R1.4 N[C@H]1CCC[C@H](O)C1 P45649 [2,0,0,0,0,0|1,0,0]=3 147 B8R1.4 N[C@H]1COC[C@@H](O)C1 Q54628 [2,0,0,0,0,0|2,0,0]=4 148 B8R1.4 N[C@H]1COC[C@H](O)C1 Q54627 [2,0,0,0,0,0|2,0,0]=4 149 B8R1.4 O=C1CCCC(O)C1 L18346 [2,0,0,0,0,0|1,0,1]=4 150 B8R1.4 O=C1CCC[C@H](O)C1 P47405 [2,0,0,0,0,0|1,0,1]=4 151 B8R1.4 OC1COCC(F)C1 Q54619 [2,0,0,0,0,0|2,0,0]=4 152 B8R1.4 OC1COCC(O)C1 Q54618 [2,0,0,0,0,0|2,0,0]=4 153 B8R1.4 O[C@@H]1CNC[C@H](O)C1 Q61083 [2,0,0,0,0,0|2,0,0]=4 154 B8R1.4 O[C@H]1CNC[C@H](O)C1 Q61084 [2,0,0,0,0,0|2,0,0]=4 155 B8R1.72 CC1(C)CCCCN1 Q52541 [2,0,0,0,0,0|1,0,0]=3 156 B8R1.72 CC1(C)CCNCC1 C-3355 [2,0,0,0,0,0|1,0,0]=3 157 B8R1.72 CC1(C)CNCCN1 D-2719 [2,0,0,0,0,0|2,0,0]=4 158 B8R1.72 CC1(C)CNCCO1 H-8786 [2,0,0,0,0,0|2,0,0]=4 159 B8R1.72 CC1(C)CNCCO1 L14122 [2,0,0,0,0,0|2,0,0]=4 160 B8R1.72 CC1(C)COCCN1 H-8787 [2,0,0,0,0,0|2,0,0]=4 161 B8R1.72 CC1(C)COCCN1 O28306 [2,0,0,0,0,0|2,0,0]=4 162 B8R1.72 CC1(F)CCCNC1 Q54394 [2,0,0,0,0,0|2,0,0]=4 163 B8R1.72 CC1(F)CCNCC1 Q54423 [2,0,0,0,0,0|2,0,0]=4 164 B8R1.72 CC1(N)CCCOC1 H-8277 [2,0,0,0,0,0|2,0,0]=4 165 B8R1.72 CC1(N)CCCOC1 H-8277-1 [2,0,0,0,0,0|2,0,0]=4 166 B8R1.72 CC1(N)CCOCC1 G-6788 [2,0,0,0,0,0|2,0,0]=4 167 B8R1.72 CC1(N)CCOCC1 Q51895 [2,0,0,0,0,0|2,0,0]=4 168 B8R1.72 CC1(N)CCSCC1 Q61458 [2,0,0,0,0,0|2,0,0]=4 169 B8R1.72 CC1(O)CCCNC1 A-831 [2,0,0,0,0,0|2,0,0]=4 170 B8R1.72 CC1(O)CCCNC1 M22629 [2,0,0,0,0,0|2,0,0]=4 171 B8R1.72 CC1(O)CCCOC1 Q65022 [2,0,0,0,0,0|2,0,0]=4 172 B8R1.72 CC1(O)CCNCC1 A-829 [2,0,0,0,0,0|2,0,0]=4 173 B8R1.72 CC1(O)CCOCC1 P36263 [2,0,0,0,0,0|2,0,0]=4 174 B8R1.72 C[C@@]1(O)CCCNC1 Q65190 [2,0,0,0,0,0|2,0,0]=4 175 B8R1.72 C[C@]1(O)CCCNC1 P44137 [2,0,0,0,0,0|2,0,0]=4 176 B8R1.72 C[Si]1(C)CCNCC1 L21960 [2,0,0,0,0,0|1,1,0]=4 177 B10R0.31 CC(C)CC(O)CC(C)(C)O O29732 [0,1,1,0,0,0|1,0,0]=3 178 B10R0.70 CC(C)C[C@@H](CN)CC(=O)O O32856 [0,1,1,0,0,0|1,0,1]=4 179 B10R1.8 C(=O)C1C[C@H](C)O[C@H](C)C1 Q64373 [1,1,0,0,0,0|1,0,1]=4 180 B10R1.8 CC1CC(C)CC(C#N)C1 Q59585 [1,1,0,0,0,0|1,0,0]=3 181 B10R1.8 CC1CC(C)CC(CO)C1 P45319 [1,1,0,0,0,0|0,0,0]=2 182 B10R1.8 CC1CC(C=O)CC(C)O1 Q60447 [1,1,0,0,0,0|1,0,1]=4 183 B10R1.8 CC1CC(CO)CC(C)N1 P50219 [1,1,0,0,0,0|1,0,0]=3 184 B10R1.120 CN1CCC(N)C(C)(C)C1 Q63687 [1,1,0,0,0,0|1,0,0]=3 185 B10R1.120 CN1CCC(N)CC1(C)C Q53122 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.147 CC1(C)C[C@@H](O)[C@H](N)CO1 Q56780 [1,1,0,0,0,0|1,0,0]=3 187 B10R1.147 CC1CC(C)(C)CCC1N P48524 [1,1,0,0,0,0|0,0,0]=2 188 B10R1.147 C[C@H]1CC(C)(C)CC[C@@H]1N P46669 [1,1,0,0,0,0|0,0,0]=2 189 B10R1.147 C[C@H]1CC(C)(C)CC[C@@H]1N P48692 [1,1,0,0,0,0|0,0,0]=2 190 B10R1.147 C[C@H]1CC(C)(C)CC[C@H]1N P48693 [1,1,0,0,0,0|0,0,0]=2 191 B10R1.147 N[C@@H]1CCC(F)(F)C[C@H]1O P47420 [1,1,0,0,0,0|2,0,0]=4 192 B10R1.147 N[C@H]1CCC(F)(F)C[C@H]1O P47389 [1,1,0,0,0,0|2,0,0]=4 193 B10R1.171 CC1(C)CC(C#N)CCO1 Q54971 [1,1,0,0,0,0|1,0,1]=4 194 B10R1.171 CC1(C)CC(C=O)CCO1 O33440 [1,1,0,0,0,0|1,0,1]=4 195 B10R1.171 CC1(C)CC(CBr)CCO1 Q64215 [1,1,0,0,0,0|1,0,0]=3 196 B10R1.171 CC1(C)CC(CN)CCO1 Q61508 [1,1,0,0,0,0|1,0,0]=3 197 B10R1.171 CC1(C)CCCC(CN)C1 O29794 [1,1,0,0,0,0|0,0,0]=2 198 B10R1.171 CC1(C)CCCC(CO)C1 Q59489 [1,1,0,0,0,0|0,0,0]=2 199 B10R1.171 CC1(C)CNCC(CO)O1 H-8788 [1,1,0,0,0,0|2,0,0]=4 200 B10R1.171 CCN1CCNC(C)(C)C1 P51444 [1,1,0,0,0,0|2,0,0]=4 201 B10R1.171 NCC1CCCC(F)(F)C1 L21674 [1,1,0,0,0,0|2,0,0]=4 202 B10R1.171 NCC1CCCC(F)(F)C1 O33364 [1,1,0,0,0,0|2,0,0]=4 203 B10R1.171 NC[C@@H]1CCCC(F)(F)C1 P45952 [1,1,0,0,0,0|2,0,0]=4 204 B10R1.171 NC[C@H]1CCCC(F)(F)C1 P50386 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.171 OCC1CCCC(F)(F)C1 P47865 [1,1,0,0,0,0|2,0,0]=4 206 B10R1.171 OC[C@@H]1CCCC(F)(F)C1 P50391 [1,1,0,0,0,0|2,0,0]=4 207 B10R1.171 OC[C@H]1CCCC(F)(F)C1 P50387 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.301 CC1(C)CNC[C@H](F)[C@@H]1O Q52087 [1,1,0,0,0,0|2,0,0]=4 209 B10R1.301 CC1(C)CNC[C@H](F)[C@@H]1O Q52088 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.301 CC1(C)CNC[C@H](F)[C@H]1O Q52086 [1,1,0,0,0,0|2,0,0]=4 211 B10R1.307 CC1(C)CC(F)(F)CCN1 Q63711 [1,1,0,0,0,0|2,0,0]=4 212 B10R1.307 CC1(C)CNCC(C)(C)O1 H-8723 [1,1,0,0,0,0|2,0,0]=4 213 B10R1.560 CC1(C)CC(=O)C(C)(C)C1 Q52096 [0,1,0,0,1,0|0,0,2]=4 214 B10R1.560 CC1(C)CC(N)C(C)(C)C1 L13465 [0,1,0,0,1,0|1,0,0]=3 215 B10R1.560 CC1(C)CC(N)C(C)(C)C1 Q52095 [0,1,0,0,1,0|1,0,0]=3 216 B12R1.242 C#CC1CC(C)(C)OC(C)(C)C1 Q52299 [0,2,0,0,0,0|2,0,0]=4 217 B12R1.242 C(=O)C1CC(C)(C)OC(C)(C)C1 Q64262 [0,2,0,0,0,0|1,0,1]=4 218 B12R1.242 CC1(C)CC(CBr)CC(C)(C)O1 Q52296 [0,2,0,0,0,0|2,0,0]=4 219 B12R1.242 CC1(C)CC(CI)CC(C)(C)O1 Q52297 [0,2,0,0,0,0|2,0,0]=4 220 B12R1.242 CC1(C)CC(CN)CC(C)(C)C1 O31300 [0,2,0,0,0,0|1,0,0]=3 221 B12R1.242 CC1(C)CC(CN)CC(C)(C)O1 Q52298 [0,2,0,0,0,0|2,0,0]=4 222 B12R1.242 CC1(C)CC(CO)CC(C)(C)N1 P45406 [0,2,0,0,0,0|1,0,0]=3 223 B12R1.242 CC1(C)CC(CO)CC(C)(C)N1 Q65183 [0,2,0,0,0,0|1,0,0]=3 224 B12R1.242 CC1(C)CC(CO)CC(C)(C)O1 Q52295 [0,2,0,0,0,0|1,0,0]=3 225 B12R1.3005 CC1CC(C(=O)O)CC(C)(C)C1 Q59608 [0,2,0,0,0,0|0,0,0]=2 226 B12R1.510 CN1C(C)(C)CC(O)CC1(C)C Q52706 [0,2,0,0,0,0|1,0,0]=3 227 B10R1.95 CC1(C)OC[C@H](CCO)O1 O33306 [0,0,1,1,0,0|2,0,0]=4 228 B10R1.95 OCCC1CCC(F)(F)C1 Q52102 [0,0,1,1,0,0|2,0,0]=4 229 B10R1.112 CC(C)(C)OC1CC(Br)C1 P47991 [0,0,1,1,0,0|2,0,0]=4 230 B10R1.112 CC(C)(C)OC1CC(N)C1 P48064 [0,0,1,1,0,0|2,0,0]=4 231 B10R1.112 CC(C)(C)O[C@H]1C[C@@H](N)C1 P47554 [0,0,1,1,0,0|2,0,0]=4 232 B10R1.112 CC(C)(C)O[C@H]1C[C@H](Br)C1 P46698 [0,0,1,1,0,0|2,0,0]=4 233 B10R1.112 CC(C)(C)O[C@H]1C[C@H](N)C1 P47480 [0,0,1,1,0,0|2,0,0]=4 234 B10R1.371 CC1(C)CC(CC(=O)O)C1 P47546 [0,0,1,1,0,0|1,0,1]=4 235 B10R1.128 CC1(C)CCCC1C(=O)O Q63830 [0,0,1,1,0,0|1,0,1]=4 236 B10R1.254 CC1(C)OC(C)(C)C1CN Q62642 [0,0,1,1,0,0|2,0,0]=4 237 B10R1.254 CC1(C)OC(C)(C)C1CO Q62641 [0,0,1,1,0,0|1,0,0]=3 238 B10R2.63 NC1CC2CC(O)C1C2 L21375 [1,0,0,1,0,0|1,0,0]=3 239 B10R2.63 NC1CC2CC(O)C1C2 P45935 [1,0,0,1,0,0|1,0,0]=3 240 B10R2.71 FC1CC2CCC(C1)N2 L18831 [1,0,0,1,0,0|2,0,0]=4 241 B10R2.71 FC1CC2CCC(C1)N2 P48364 [1,0,0,1,0,0|2,0,0]=4 242 B10R2.71 FC1C[C@@H]2CC[C@@H](C1)N2 P44148 [1,0,0,1,0,0|2,0,0]=4 243 B10R2.71 F[C@H]1C[C@@H]2CC[C@H](C1)N2 L13950 [1,0,0,1,0,0|2,0,0]=4 244 B10R2.71 NC1CC2CCC(C1)C2 F-4591 [1,0,0,1,0,0|1,0,0]=3 245 B10R2.71 NC1CC2CCC(C1)C2 G-6985 [1,0,0,1,0,0|1,0,0]=3 246 B10R2.71 NC1CC2CCC(C1)O2 I-9764 [1,0,0,1,0,0|2,0,0]=4 247 B10R2.71 NC1CC2CCC(C1)O2 P44881 [1,0,0,1,0,0|2,0,0]=4 248 B10R2.71 N[C@@H]1C[C@@H]2CC[C@H](C1)N2 P50871 [1,0,0,1,0,0|2,0,0]=4 249 B10R2.71 N[C@H]1C[C@@H]2CC[C@H](C1)N2 P50870 [1,0,0,1,0,0|2,0,0]=4 250 B10R2.71 O=C1CC2CCC(C1)C2 G-7015 [1,0,0,1,0,0|0,0,2]=4 251 B10R2.71 OC1CC2CCC(C1)N2 F-4227 [1,0,0,1,0,0|1,0,0]=3 252 B10R2.71 OC1CC2CCC(C1)O2 P49665 [1,0,0,1,0,0|1,0,0]=3 253 B10R2.71 O[C@@H]1C[C@@H]2CC[C@H](C1)N2 C-3493 [1,0,0,1,0,0|1,0,0]=3 254 B10R2.71 O[C@H]1C[C@@H]2CC[C@H](C1)N2 P45550 [1,0,0,1,0,0|1,0,0]=3 255 B10R2.71 [C@H]12CC[C@H](C[C@@H](N)C1)O2 P50504 [1,0,0,1,0,0|2,0,0]=4 256 B10R2.71 [C@H]12CC[C@H](C[C@@H](O)C1)N2 G-5153 [1,0,0,1,0,0|1,0,0]=3 257 B10R2.71 [C@H]12CC[C@H](C[C@@H](O)C1)O2 L21419 [1,0,0,1,0,0|1,0,0]=3 258 B10R2.71 [C@H]12CC[C@H](C[C@H](N)C1)O2 P45311 [1,0,0,1,0,0|2,0,0]=4 259 B10R2.71 [C@H]12CC[C@H](C[C@H](O)C1)O2 L21421 [1,0,0,1,0,0|1,0,0]=3 260 B10R2.177 CC12CC(=O)CCC1C2 Q57147 [1,0,0,1,0,0|0,0,2]=4 261 B10R2.177 CN1CCC2CC2(N)C1 Q61279 [1,0,0,1,0,0|2,0,0]=4 262 B10R2.179 CC12CCCC(=O)C1C2 Q52396 [1,0,0,1,0,0|0,0,2]=4 263 B10R2.235 NC12CCCC(F)(C1)C2 P46338 [1,0,0,1,0,0|2,0,0]=4 264 B10R2.235 NC12CCCC(N)(C1)C2 P45000 [1,0,0,1,0,0|2,0,0]=4 265 B10R2.235 NC12CCCC(O)(C1)C2 P46321 [1,0,0,1,0,0|1,0,0]=3 266 B10R2.236 NC12CCCN(CC1)C2 P46377 [1,0,0,1,0,0|2,0,0]=4 267 B10R2.534 CN1CCNC2(CC2)C1 Q63866 [1,0,0,1,0,0|2,0,0]=4 268 B10R2.534 NC1CCCC2(CC2)C1 H-8027 [1,0,0,1,0,0|1,0,0]=3 269 B10R2.534 NC1CCCC2(CC2)C1 P49265 [1,0,0,1,0,0|1,0,0]=3 270 B10R2.534 O=C1CCCC2(CC2)C1 L22282 [1,0,0,1,0,0|0,0,2]=4 271 B10R2.534 OC1CCCC2(CC2)C1 Q61494 [1,0,0,1,0,0|0,0,0]=2 272 B10R2.19 NC12CCC(CC1Br)C2 P48201 [0,0,0,1,1,0|2,0,0]=4 273 B12R2.2482 CC1(C)CC2CC(C)(CN2)C1 P45505 [0,0,0,1,0,1|1,0,0]=3 274 B8R0.23 CC(C)C(N)CN(C)C P36129 [0,0,1,0,1,0|2,0,0]=4 275 B8R0.23 CC(C)[C@@H](N)CN(C)C P37903 [0,0,1,0,1,0|2,0,0]=4 276 B8R0.23 CC(C)[C@H](N)CN(C)C P35834 [0,0,1,0,1,0|2,0,0]=4 277 B8R1.18 CN1C[C@H](N)[C@H](O)C1 L22266 [1,0,0,0,1,0|2,0,0]=4 278 B8R1.19 CC1(C)CCCC1=O L21296 [1,0,0,0,1,0|0,0,2]=4 279 B8R1.19 CC1(C)CCCC1N Q62001 [1,0,0,0,1,0|1,0,0]=3 280 B8R1.19 CC1(C)CCCC1O L20761 [1,0,0,0,1,0|0,0,0]=2 281 B8R1.19 CC1(C)CCC[C@@H]1N Q63826 [1,0,0,0,1,0|1,0,0]=3 282 B8R1.19 CC1(C)CCC[C@@H]1O Q63828 [1,0,0,0,1,0|0,0,0]=2 283 B8R1.19 CC1(C)CCC[C@H]1N Q63827 [1,0,0,0,1,0|1,0,0]=3 284 B8R1.19 CC1(C)CCC[C@H]1O Q63829 [1,0,0,0,1,0|0,0,0]=2 285 B8R1.19 CC1(C)CNC[C@H]1O Q61634 [1,0,0,0,1,0|1,0,0]=3 286 B8R1.19 CC1(C)NCCC1O Q64208 [1,0,0,0,1,0|1,0,0]=3 287 B8R1.19 CC1(C)NCCC1O Q64209 [1,0,0,0,1,0|1,0,0]=3 288 B8R1.19 CC1(F)CCCC1N Q54478 [1,0,0,0,1,0|2,0,0]=4 289 B8R1.51 CC1(C)CC(O)CN1 L22151 [1,0,0,0,1,0|1,0,0]=3 290 B8R1.51 CC1(C)CCC(=O)C1 L21292 [1,0,0,0,1,0|0,0,2]=4 291 B8R1.51 CC1(O)CCC(N)C1 P50831 [1,0,0,0,1,0|2,0,0]=4 292 B8R1.51 CC1(O)CCC(N)C1 Q56519 [1,0,0,0,1,0|2,0,0]=4 293 B8R1.51 CC1CC(C)(C)CN1 Q57412 [1,0,0,0,1,0|1,0,0]=3 294 B8R1.51 C[C@]1(O)CC[C@@H](N)C1 Q56976 [1,0,0,0,1,0|2,0,0]=4 295 B8R1.51 OC1CCC(F)(F)C1 K12083 [1,0,0,0,1,0|2,0,0]=4 296 B8R1.51 O[C@@H]1CCC(F)(F)C1 Q55062 [1,0,0,0,1,0|2,0,0]=4 297 B8R1.51 O[C@H]1CCC(F)(F)C1 Q55061 [1,0,0,0,1,0|2,0,0]=4 298 B8R1.24 CC1(C)C(=O)CC1O P48188 [0,0,0,0,2,0|1,0,1]=4 299 B8R1.24 CC1(C)C(N)CC1F P46342 [0,0,0,0,2,0|2,0,0]=4 300 B8R1.24 CC1(C)C(N)CC1O P48166 [0,0,0,0,2,0|1,0,0]=3 301 B8R1.24 CC1(C)C(N)CC1O P48175 [0,0,0,0,2,0|1,0,0]=3 302 B8R1.24 CC1(C)C(O)CC1O P48133 [0,0,0,0,2,0|1,0,0]=3 303 B8R1.24 CC1(C)[C@@H](N)C[C@H]1O I-9724 [0,0,0,0,2,0|1,0,0]=3 304 B8R1.24 CC1(C)[C@@H](N)C[C@H]1O P48165 [0,0,0,0,2,0|1,0,0]=3 305 B8R1.24 CC1(C)[C@H](N)C[C@H]1O P48164 [0,0,0,0,2,0|1,0,0]=3 306 B8R1.24 CC1(C)[C@H](N)C[C@H]1O P48170 [0,0,0,0,2,0|1,0,0]=3