0 B8R0.6 CCCCCC(=O)NN PI-50287 [0,0,0,0,0,0|2,0,0]=2 1 B8R0.6 CCCCCC(C=C)O PI-39433 [0,0,0,0,0,0|0,0,4]=4 2 B8R0.6 CCCCCC(CC)O PI-42991 [0,0,0,0,0,0|0,0,2]=2 3 B8R0.6 CCCCC[C@@H](C=C)O PI-49834 [0,0,0,0,0,0|0,0,4]=4 4 B8R0.6 CCCCNC(=S)NN PI-23055 [0,0,0,0,0,0|3,1,0]=4 5 B8R0.6 O=C(OC)CCCCBr PI-40014 [0,0,0,0,0,0|2,0,0]=2 6 B7R0.1 C(CCCBr)CCO PI-39099 [1,0,0,0,0,0|2,0,1]=4 7 B7R0.1 C(CCCCl)CCCl PI-44616 [1,0,0,0,0,0|2,0,1]=4 8 B7R0.1 C(CCCS)CCO PI-40491 [1,0,0,0,0,0|2,0,1]=4 9 B7R0.1 C(CCCS)CCS PI-35928 [1,0,0,0,0,0|2,0,1]=4 10 B7R0.1 CCCCCCCBr PI-44628 [1,0,0,0,0,0|1,0,1]=3 11 B7R0.1 CCCCCN=C=O PI-11407 [1,0,0,0,0,0|2,0,1]=4 12 B7R0.1 CCCCNCCN PI-15624 [1,0,0,0,0,0|2,0,1]=4 13 B7R0.1 CCCSSCCC PI-48483 [1,0,0,0,0,0|2,0,1]=4 14 B7R0.1 COCCCCCBr PI-50168 [1,0,0,0,0,0|2,0,1]=4 15 B7R0.1 OCCCCCCCl PI-37141 [1,0,0,0,0,0|2,0,1]=4 16 B7R0.1 OCCCCCCN PI-40365 [1,0,0,0,0,0|2,0,1]=4 17 B7R0.3 CCCCC(=O)NN PI-50263 [1,0,0,0,0,0|2,0,0]=3 18 B7R0.3 COC(=O)CCC#C PI-39349 [1,0,0,0,0,0|1,0,2]=4 19 B7R0.3 COC(=O)CCC=O PI-48276 [1,0,0,0,0,0|2,0,1]=4 20 B7R0.3 COC(=O)CCCBr PI-44980 [1,0,0,0,0,0|2,0,0]=3 21 B7R0.3 COC(=O)CCCN PI-42165 [1,0,0,0,0,0|2,0,0]=3 22 B7R0.3 COC(=O)CCSC PI-45979 [1,0,0,0,0,0|2,0,0]=3 23 B7R0.3 COCCC(=O)NN PI-50294 [1,0,0,0,0,0|3,0,0]=4 24 B7R0.3 O=C(OC)CCNC PI-40057 [1,0,0,0,0,0|2,0,0]=3 25 B7R0.4 BrCCCCC(=O)Cl PI-15616 [1,0,0,0,0,0|2,0,0]=3 26 B7R0.4 BrCCCCC(=O)O PI-11341 [1,0,0,0,0,0|2,0,0]=3 27 B7R0.4 C#CCCCC(O)=O PI-37286 [1,0,0,0,0,0|1,0,2]=4 28 B7R0.4 C(CCBr)CC(=O)[O-] PI-41801 [1,0,0,0,0,0|2,0,0]=3 29 B7R0.4 C(CCCl)CC(=O)Cl PI-44721 [1,0,0,0,0,0|2,0,0]=3 30 B7R0.4 C(CNCC(=O)O)N PI-47160 [1,0,0,0,0,0|3,0,0]=4 31 B7R0.4 CC(=O)CCCCCl PI-28023 [1,0,0,0,0,0|1,0,0]=2 32 B7R0.4 CCCCCB(O)O PI-37261 [1,0,0,0,0,0|2,0,1]=4 33 B7R0.4 CCCCC[C@@H](C)O PI-49829 [1,0,0,0,0,0|0,0,2]=3 34 B7R0.4 CCCCNC(=S)N PI-23056 [1,0,0,0,0,0|2,1,0]=4 35 B7R0.4 CCCCOC(=S)[S-] PI-47064 [1,0,0,0,0,0|2,1,0]=4 36 B7R0.4 CCCOCC(=O)O PI-32592 [1,0,0,0,0,0|2,0,0]=3 37 B7R0.4 CN(C)CCCCN PI-23376 [1,0,0,0,0,0|3,0,0]=4 38 B7R0.4 CNCCCN(C)C PI-19630 [1,0,0,0,0,0|3,0,0]=4 39 B7R0.4 COCCOC(=O)C PI-12910 [1,0,0,0,0,0|2,0,0]=3 40 B7R0.4 NCCCCC(=O)O PI-30804 [1,0,0,0,0,0|2,0,0]=3 41 B7R0.4 OC(=O)CCCCN PI-40783 [1,0,0,0,0,0|2,0,0]=3 42 B9R0.1 CC(=O)NCCC(=O)OC PI-33249 [0,1,0,0,0,0|2,0,1]=4 43 B9R0.1 CC(C)CCOC(=O)C=C PI-47066 [0,1,0,0,0,0|1,0,2]=4 44 B9R0.1 COC(=O)CCCC(=O)O PI-39132 [0,1,0,0,0,0|2,0,1]=4 45 B9R0.5 C(C(OCC)=O)CCCBr PI-40015 [0,1,0,0,0,0|1,0,0]=2 46 B9R0.5 CCCCOC(=O)CC#N PI-32785 [0,1,0,0,0,0|1,0,1]=3 47 B9R0.5 CCOC(=O)CCN=C=O PI-19662 [0,1,0,0,0,0|2,0,1]=4 48 B9R0.5 CCOC=CC(=O)OCC PI-37578 [0,1,0,0,0,0|1,0,2]=4 49 B9R0.5 O=C(OCC)COCCCl PI-41952 [0,1,0,0,0,0|2,0,0]=3 50 B9R0.8 CCCCC(C(=O)OC)Br PI-12723 [0,1,0,0,0,0|1,0,0]=2 51 B9R0.8 COC(=O)C(CCCBr)Br PI-32636 [0,1,0,0,0,0|2,0,0]=3 52 B9R0.8 COC(=O)C(CCSC)N PI-25385 [0,1,0,0,0,0|2,0,0]=3 53 B9R0.8 COC(=O)C(CCSC)N PI-44538 [0,1,0,0,0,0|2,0,0]=3 54 B9R0.34 C(C)OC(CC(CBr)=O)=O PI-40019 [0,1,0,0,0,0|2,0,1]=4 55 B9R0.34 CCCC(=O)CC(=O)OC PI-45791 [0,1,0,0,0,0|1,0,1]=3 56 B9R0.34 CCCC(CC(=O)OC)O PI-45929 [0,1,0,0,0,0|1,0,0]=2 57 B9R0.46 C=CC(=O)OCCCCO PI-50413 [0,1,0,0,0,0|1,0,2]=4 58 B9R0.46 CCCCCCC(=O)NN PI-50289 [0,1,0,0,0,0|2,0,0]=3 59 B9R0.46 CCCCCCC(CO)O PI-44204 [0,1,0,0,0,0|1,0,2]=4 60 B9R0.46 CCOCCOC(=O)CCl PI-22753 [0,1,0,0,0,0|2,0,0]=3 61 B9R0.46 COC(=O)CCCCCO PI-45931 [0,1,0,0,0,0|1,0,0]=2 62 B9R0.46 O=C(OC)CCCCCBr PI-40016 [0,1,0,0,0,0|1,0,0]=2 63 B9R1.1 CCC1CCC(=O)CC1 PI-36670 [0,0,0,1,0,0|0,0,0]=1 64 B9R1.1 CCN1CCC(=O)CC1 PI-14889 [0,0,0,1,0,0|1,0,0]=2 65 B9R1.1 CCN1CCC(CC1)N PI-43175 [0,0,0,1,0,0|2,0,1]=4 66 B9R1.1 CCN1CCC(CC1)O PI-43308 [0,0,0,1,0,0|1,0,2]=4 67 B9R1.1 CNC1CCN(CC1)C PI-38560 [0,0,0,1,0,0|3,0,0]=4 68 B9R1.1 COC1CCC(CC1)=O PI-40302 [0,0,0,1,0,0|1,0,0]=2 69 B9R1.1 COC1CCC(CC1)O PI-44528 [0,0,0,1,0,0|1,0,2]=4 70 B9R1.1 O=C1CCC(CO)CC1 PI-41917 [0,0,0,1,0,0|1,0,0]=2 71 B9R1.1 O=CC1CCC(CC1)=O PI-36571 [0,0,0,1,0,0|1,0,1]=3 72 B9R1.1 OCC1CCN(C)CC1 PI-27324 [0,0,0,1,0,0|3,0,0]=4 73 B9R1.2 CCN1CCCC(C1)N PI-35816 [0,0,0,1,0,0|3,0,0]=4 74 B9R1.2 CCN1CCCC(C1)O PI-43238 [0,0,0,1,0,0|3,0,0]=4 75 B9R1.3 O=C1CCCC(=O)C1C PI-21904 [0,0,0,1,0,0|1,0,1]=3 76 B9R1.5 C1CCNC(=O)C(C1)N PI-27340 [0,0,0,1,0,0|2,0,0]=3 77 B9R1.5 C1CCNC(=O)C(C1)N PI-48189 [0,0,0,1,0,0|2,0,0]=3 78 B9R1.5 CN1CCCCCC1=O PI-15330 [0,0,0,1,0,0|1,0,0]=2 79 B9R1.5 CN1CCCNCC1=O PI-34063 [0,0,0,1,0,0|2,0,0]=3 80 B9R1.5 CN1CCNCCC1=O PI-41772 [0,0,0,1,0,0|2,0,0]=3 81 B9R1.7 CCCC1=NNC(=O)C1 PI-19398 [0,0,0,1,0,0|2,0,1]=4 82 B9R1.7 CCCC1CC(=O)OC1 PI-44369 [0,0,0,1,0,0|1,0,0]=2 83 B9R1.11 C1CCN(C1)C(=O)CCl PI-50573 [0,0,0,1,0,0|2,0,0]=3 84 B9R1.11 COC(=O)C1=CCCC1 PI-38160 [0,0,0,1,0,0|1,0,2]=4 85 B9R1.11 COC(=O)C1CC=CC1 PI-37831 [0,0,0,1,0,0|1,0,2]=4 86 B9R1.11 COC(=O)C1CCCN1 PI-14284 [0,0,0,1,0,0|2,0,0]=3 87 B9R1.11 COC(=O)C1CCCO1 PI-13051 [0,0,0,1,0,0|2,0,0]=3 88 B9R1.11 COC(=O)C1CCNC1 PI-27313 [0,0,0,1,0,0|2,0,0]=3 89 B9R1.11 COC(=O)[C@@H]1CCCN1 PI-14283 [0,0,0,1,0,0|2,0,0]=3 90 B9R1.11 O=C(C1CNCC1)OC PI-46627 [0,0,0,1,0,0|2,0,0]=3 91 B9R1.11 O=C(C1COCC1)OC PI-42697 [0,0,0,1,0,0|2,0,0]=3 92 B9R1.49 CN1CCC(=O)NCC1 PI-48290 [0,0,0,1,0,0|2,0,0]=3 93 B9R1.49 CN1CCCC(=O)CC1 PI-45965 [0,0,0,1,0,0|1,0,0]=2 94 B9R1.49 CN1CCCC(CC1)O PI-48280 [0,0,0,1,0,0|1,0,2]=4 95 B9R1.50 C1CCCNC(=O)CC1 PI-38929 [0,0,0,1,0,0|1,0,0]=2 96 B9R1.118 C1CCC(CC1)(CN)O PI-17134 [0,0,0,1,0,0|1,0,2]=4 97 B9R1.118 CC1(CCCCC1)CBr PI-36358 [0,0,0,1,0,0|2,0,1]=4 98 B9R1.118 CCC1(O)CCCCC1 PI-29293 [0,0,0,1,0,0|0,0,2]=3 99 B9R1.118 CC[N+]1(CCOCC1)C PI-42071 [0,0,0,1,0,0|3,0,0]=4 100 B9R1.118 CC[N+]1(CCOCC1)C PI-45713 [0,0,0,1,0,0|3,0,0]=4 101 B9R1.132 CCC1=C(C(=O)CC1)O PI-47191 [0,0,0,1,0,0|1,0,2]=4 102 B6R0.6 BrCCCCC=C PI-39147 [2,0,0,0,0,0|1,0,1]=4 103 B6R0.6 C(CCBr)CCBr PI-44626 [2,0,0,0,0,0|2,0,0]=4 104 B6R0.6 C(CCN)CCN PI-46858 [2,0,0,0,0,0|2,0,0]=4 105 B6R0.6 C(CCO)CCCl PI-44261 [2,0,0,0,0,0|2,0,0]=4 106 B6R0.6 C(CCS)CCS PI-11006 [2,0,0,0,0,0|2,0,0]=4 107 B6R0.6 CCCCCCN PI-46860 [2,0,0,0,0,0|1,0,0]=3 108 B6R0.6 CCCCCNC PI-21907 [2,0,0,0,0,0|1,0,0]=3 109 B6R0.6 CCCOCCCl PI-47054 [2,0,0,0,0,0|2,0,0]=4 110 B6R0.6 CCCSCCC PI-48482 [2,0,0,0,0,0|1,0,0]=3 111 B6R0.6 CCC\C=C\C=O PI-40157 [2,0,0,0,0,0|0,0,2]=4 112 B6R0.6 CNCCCNC PI-32197 [2,0,0,0,0,0|2,0,0]=4 113 B6R0.6 COCCCCBr PI-39605 [2,0,0,0,0,0|2,0,0]=4 114 B6R0.6 ClCCCCC=O PI-34745 [2,0,0,0,0,0|1,0,0]=3 115 B6R0.6 ClCCCCCBr PI-10753 [2,0,0,0,0,0|2,0,0]=4 116 B6R0.1 CCCC(=O)NN PI-23070 [2,0,0,0,0,0|2,0,0]=4 117 B6R0.1 CCCC(=O)SC PI-48512 [2,0,0,0,0,0|1,0,0]=3 118 B6R0.1 CCCC(CC)Cl PI-46859 [2,0,0,0,0,0|1,0,1]=4 119 B6R0.1 CCOC(=O)CBr PI-15815 [2,0,0,0,0,0|2,0,0]=4 120 B6R0.1 CCOC(=O)NC PI-50343 [2,0,0,0,0,0|2,0,0]=4 121 B6R0.1 CNCC(=O)OC PI-45586 [2,0,0,0,0,0|2,0,0]=4 122 B6R0.1 COC(=O)CCN PI-31148 [2,0,0,0,0,0|2,0,0]=4 123 B6R0.1 O=C(OC)CCO PI-41038 [2,0,0,0,0,0|2,0,0]=4 124 B6R0.4 CC(NCCS)=O PI-37034 [2,0,0,0,0,0|2,0,0]=4 125 B6R0.4 CCCCC(=O)[O-] PI-46856 [2,0,0,0,0,0|1,0,0]=3 126 B6R0.4 CCCCC(C)O PI-42555 [2,0,0,0,0,0|0,0,2]=4 127 B6R0.4 CCCC[C@@H](C)O PI-49839 [2,0,0,0,0,0|0,0,2]=4 128 B6R0.4 CCCNC(=O)N PI-19783 [2,0,0,0,0,0|2,0,0]=4 129 B6R0.4 CCNCC(=O)O PI-43211 [2,0,0,0,0,0|2,0,0]=4 130 B6R0.4 CSCCC(=O)O PI-31992 [2,0,0,0,0,0|2,0,0]=4 131 B6R0.4 ClCCCC(=O)C PI-39487 [2,0,0,0,0,0|1,0,0]=3 132 B6R0.4 NCCCC(=O)O PI-35917 [2,0,0,0,0,0|2,0,0]=4 133 B6R0.4 O=C(O)CCCBr PI-40017 [2,0,0,0,0,0|2,0,0]=4 134 B6R0.4 O=C(O)CCCCl PI-41227 [2,0,0,0,0,0|2,0,0]=4 135 B6R0.4 OCCCC(=O)C PI-13555 [2,0,0,0,0,0|1,0,0]=3 136 B8R0.1 CCCCC(CCC)O PI-46865 [1,1,0,0,0,0|0,0,1]=3 137 B8R0.1 CCOCC(C)OCC PI-44418 [1,1,0,0,0,0|2,0,0]=4 138 B8R0.4 CCCCCC#CCBr PI-22217 [1,1,0,0,0,0|0,0,2]=4 139 B8R0.4 CCCCCC=CCO PI-26231 [1,1,0,0,0,0|0,0,1]=3 140 B8R0.4 CCCCCCCCBr PI-44631 [1,1,0,0,0,0|0,0,1]=3 141 B8R0.4 CCCCCCCCCl PI-44615 [1,1,0,0,0,0|0,0,1]=3 142 B8R0.4 CCCCC\C=C\C=O PI-38486 [1,1,0,0,0,0|0,0,2]=4 143 B8R0.4 CCCCSCCCC PI-48485 [1,1,0,0,0,0|0,0,1]=3 144 B8R0.4 CCOCCOCCBr PI-50169 [1,1,0,0,0,0|2,0,0]=4 145 B8R0.7 CC(NCCCCO)C PI-39829 [1,1,0,0,0,0|2,0,0]=4 146 B8R0.7 CCCCCCC(C)O PI-10350 [1,1,0,0,0,0|0,0,1]=3 147 B8R0.3 CC(CCCl)C(=O)OC PI-26123 [1,1,0,0,0,0|2,0,0]=4 148 B8R0.3 CCC(=O)C(=O)OCC PI-50191 [1,1,0,0,0,0|1,0,1]=4 149 B8R0.3 CCCC(C(=O)OC)Br PI-44177 [1,1,0,0,0,0|1,0,0]=3 150 B8R0.3 CSC[C@@H](C(=O)OC)N PI-35894 [1,1,0,0,0,0|2,0,0]=4 151 B8R0.3 O=C(OC)C(Br)CCBr PI-40018 [1,1,0,0,0,0|2,0,0]=4 152 B8R0.8 CCCCC(=O)C(=O)O PI-50172 [1,1,0,0,0,0|1,0,1]=4 153 B8R0.11 CCC\C=C(/CC)\C=O PI-50386 [1,1,0,0,0,0|0,0,1]=3 154 B8R0.19 CCC(=O)CC(=O)CC PI-15985 [1,1,0,0,0,0|0,0,1]=3 155 B8R0.19 CCC(=O)CC(=O)OC PI-10902 [1,1,0,0,0,0|1,0,1]=4 156 B8R0.19 CCC(CC(=O)OC)O PI-42251 [1,1,0,0,0,0|1,0,0]=3 157 B8R0.19 CC[C@H](O)CC(OC)=O PI-42252 [1,1,0,0,0,0|1,0,0]=3 158 B8R0.19 COC(=O)CC(CCl)O PI-24655 [1,1,0,0,0,0|2,0,0]=4 159 B8R0.19 COC(=O)C[C@H](CCl)O PI-24658 [1,1,0,0,0,0|2,0,0]=4 160 B8R0.21 CCCCOS(=O)(=O)C PI-25287 [1,1,0,0,0,0|2,0,0]=4 161 B8R0.28 CC(=O)CCCC(=O)C PI-42581 [1,1,0,0,0,0|0,0,1]=3 162 B8R0.28 CC(C)CCCC(=O)C PI-47229 [1,1,0,0,0,0|0,0,0]=2 163 B8R0.28 CN(C)CCCC(=O)O PI-29854 [1,1,0,0,0,0|2,0,0]=4 164 B10R0.3 CCOC(=O)CCCC(=O)O PI-19044 [0,2,0,0,0,0|1,0,1]=4 165 B10R0.59 COC(=O)CCCC(=O)OC PI-44636 [0,2,0,0,0,0|1,0,1]=4 166 B10R0.60 C[N+](C)(C)CCCC(=O)OC PI-33874 [0,2,0,0,0,0|2,0,0]=4 167 B10R0.77 CCN(CC)CCCC(C)O PI-17704 [0,2,0,0,0,0|2,0,0]=4 168 B10R0.1 BrCCCCCC(=O)OCC PI-21505 [0,2,0,0,0,0|0,0,0]=2 169 B10R0.1 CCOC(=O)CCCCCO PI-45932 [0,2,0,0,0,0|0,0,0]=2 170 B10R0.2 CCCC(=O)CC(=O)OCC PI-45789 [0,2,0,0,0,0|0,0,1]=3 171 B10R0.2 CCCC(CC(=O)OCC)O PI-45930 [0,2,0,0,0,0|0,0,0]=2 172 B10R0.2 CCOC(=N)CC(=O)OCC PI-18369 [0,2,0,0,0,0|1,0,1]=4 173 B10R0.2 CCOC(=O)C[C@H](CC#N)O PI-13566 [0,2,0,0,0,0|1,0,1]=4 174 B10R0.2 CCOC(=O)C[C@H](O)CC#N PI-16779 [0,2,0,0,0,0|1,0,1]=4 175 B10R0.19 CCCCC(=O)C(=O)OCC PI-33911 [0,2,0,0,0,0|0,0,1]=3 176 B10R0.19 CCCCC(C(=O)OCC)Br PI-19765 [0,2,0,0,0,0|0,0,0]=2 177 B10R0.19 CCCCC(C(C)CCC)O PI-30171 [0,2,0,0,0,0|1,0,1]=4 178 B10R0.19 CCOC(=O)C(CCCN)N PI-45795 [0,2,0,0,0,0|1,0,0]=3 179 B10R0.19 CCOC(=O)C(CCSC)N PI-31138 [0,2,0,0,0,0|1,0,0]=3 180 B10R0.83 COC(=O)C(CCCCN)N PI-33226 [0,2,0,0,0,0|1,0,0]=3 181 B10R0.83 COC(=O)C(CCCCN)N PI-42164 [0,2,0,0,0,0|1,0,0]=3 182 B10R0.156 CCCCCC(C)(CCC)O PI-19339 [0,2,0,0,0,0|0,0,2]=4 183 B10R0.35 CCC(=O)C(C(=O)OCC)F PI-33674 [0,2,0,0,0,0|1,0,1]=4 184 B10R0.62 CCCCCCC(C)(CC)O PI-30303 [0,2,0,0,0,0|0,0,2]=4 185 B10R0.26 CCOC(=O)CC(=O)C(C)C PI-24578 [0,2,0,0,0,0|1,0,1]=4 186 B10R0.55 COC(=O)CCCCC(=O)O PI-25751 [0,2,0,0,0,0|1,0,1]=4 187 B10R0.74 CCCCCCCC(=O)NN PI-50239 [0,2,0,0,0,0|2,0,0]=4 188 B10R0.74 CCCCCCOC(=O)CN PI-15958 [0,2,0,0,0,0|1,0,0]=3 189 B10R0.5 CCCCOC(=O)C(F)(F)F PI-23059 [0,2,0,0,0,0|2,0,0]=4 190 B8R1.2 BrCC1CCCCC1 PI-33021 [1,0,0,1,0,0|1,0,1]=4 191 B8R1.2 BrCC1CCNCC1 PI-36265 [1,0,0,1,0,0|2,0,0]=4 192 B8R1.2 BrCC1CCOCC1 PI-14484 [1,0,0,1,0,0|2,0,0]=4 193 B8R1.2 C(C1CCOCC1)O PI-40556 [1,0,0,1,0,0|2,0,0]=4 194 B8R1.2 C1CCC(CC1)CI PI-44086 [1,0,0,1,0,0|1,0,1]=4 195 B8R1.2 C1CNCCC1CN PI-11070 [1,0,0,1,0,0|2,0,0]=4 196 B8R1.2 C1CNCCC1CO PI-31327 [1,0,0,1,0,0|2,0,0]=4 197 B8R1.2 CCC1CCCCN1 PI-11060 [1,0,0,1,0,0|1,0,1]=4 198 B8R1.2 CCN1CCNCC1 PI-33488 [1,0,0,1,0,0|2,0,0]=4 199 B8R1.2 CNC1CCNCC1 PI-43342 [1,0,0,1,0,0|2,0,0]=4 200 B8R1.2 CNC1CCNCC1 PI-43343 [1,0,0,1,0,0|2,0,0]=4 201 B8R1.2 CNC1CCOCC1 PI-38449 [1,0,0,1,0,0|2,0,0]=4 202 B8R1.2 COC1CCNCC1 PI-39354 [1,0,0,1,0,0|2,0,0]=4 203 B8R1.2 COC1CCNCC1 PI-39359 [1,0,0,1,0,0|2,0,0]=4 204 B8R1.2 NCC1CCCCC1 PI-34207 [1,0,0,1,0,0|1,0,1]=4 205 B8R1.2 NCC1CCOCC1 PI-14113 [1,0,0,1,0,0|2,0,0]=4 206 B8R1.2 OCC1CCCCC1 PI-15325 [1,0,0,1,0,0|1,0,1]=4 207 B8R1.2 OCC1CCNCC1 PI-11073 [1,0,0,1,0,0|2,0,0]=4 208 B8R1.5 CC1CCCCC1N PI-13571 [1,0,0,1,0,0|1,0,1]=4 209 B8R1.22 CN1CCCNCC1 PI-34064 [1,0,0,1,0,0|2,0,0]=4 210 B8R1.36 CCCNCC1CC1 PI-13558 [1,0,0,1,0,0|1,0,1]=4 211 B8R1.1 C1CC(=O)NC1CO PI-35695 [1,0,0,1,0,0|2,0,0]=4 212 B8R1.1 CCC1COC(=O)O1 PI-50185 [1,0,0,1,0,0|2,0,0]=4 213 B8R1.1 OC[C@@H]1CCC(=O)N1 PI-35779 [1,0,0,1,0,0|2,0,0]=4 214 B8R1.1 OC[C@@H]1CCC(=O)O1 PI-27485 [1,0,0,1,0,0|2,0,0]=4 215 B8R1.3 CC1CCC(=O)CC1 PI-37804 [1,0,0,1,0,0|0,0,0]=2 216 B8R1.3 CC1CCC(CC1)N PI-12652 [1,0,0,1,0,0|1,0,1]=4 217 B8R1.3 CC1CCC(CC1)N PI-13103 [1,0,0,1,0,0|1,0,1]=4 218 B8R1.3 CC1CCC(CC1)N PI-13124 [1,0,0,1,0,0|1,0,1]=4 219 B8R1.3 CN1CCC(=O)CC1 PI-31482 [1,0,0,1,0,0|1,0,0]=3 220 B8R1.3 C[C@@H]1CC[C@H](CC1)O PI-22724 [1,0,0,1,0,0|0,0,2]=4 221 B8R1.3 O=C1CCC(=O)CC1 PI-13127 [1,0,0,1,0,0|1,0,1]=4 222 B8R1.38 COC(=O)C1CNC1 PI-40197 [1,0,0,1,0,0|2,0,0]=4 223 B8R1.38 COC(=O)C1CNC1 PI-43200 [1,0,0,1,0,0|2,0,0]=4 224 B8R1.38 COC(=O)[C@@H]1CCN1 PI-48283 [1,0,0,1,0,0|2,0,0]=4 225 B8R1.40 COC(=O)NC1CC1 PI-17914 [1,0,0,1,0,0|2,0,0]=4 226 B8R1.50 CC1C(CCC1=O)=O PI-12377 [1,0,0,1,0,0|1,0,1]=4 227 B8R1.52 CCC1(CCCC1)O PI-37576 [1,0,0,1,0,0|0,0,2]=4 228 B8R1.52 CC[N+]1(C)CCCC1 PI-36564 [1,0,0,1,0,0|2,0,0]=4 229 B8R1.4 CC1CCCC(=O)N1 PI-35204 [1,0,0,1,0,0|1,0,0]=3 230 B8R1.4 O=C1CCCC(=O)C1 PI-32070 [1,0,0,1,0,0|1,0,1]=4 231 B8R1.4 O=C1CCC[C@@H](C)O1 PI-27587 [1,0,0,1,0,0|1,0,0]=3 232 B8R1.4 O=C1CCOC(C1)C PI-40554 [1,0,0,1,0,0|1,0,0]=3 233 B8R1.4 O=C1NCCC(O)C1 PI-37263 [1,0,0,1,0,0|2,0,0]=4 234 B8R1.4 O=C1NCCN(C)C1 PI-41916 [1,0,0,1,0,0|2,0,0]=4 235 B8R1.7 C1CC(NC1)C(=O)O PI-44957 [1,0,0,1,0,0|2,0,0]=4 236 B8R1.7 C1CC(OC1)C(=O)O PI-31322 [1,0,0,1,0,0|2,0,0]=4 237 B8R1.7 C1CC(OC1)C(=O)O PI-31323 [1,0,0,1,0,0|2,0,0]=4 238 B8R1.7 C1CNCC1C(=O)O PI-25815 [1,0,0,1,0,0|2,0,0]=4 239 B8R1.7 C1COCC1C(=O)O PI-42680 [1,0,0,1,0,0|2,0,0]=4 240 B8R1.7 CC(=O)C1CCCC1 PI-38161 [1,0,0,1,0,0|0,0,0]=2 241 B8R1.7 CC(=O)C1CCOC1 PI-42706 [1,0,0,1,0,0|1,0,0]=3 242 B8R1.7 ClC(=O)C1CCCC1 PI-39144 [1,0,0,1,0,0|1,0,0]=3 243 B8R1.7 NC(=O)[C@@H]1CCCN1 PI-10274 [1,0,0,1,0,0|2,0,0]=4 244 B8R1.7 NC(=O)[C@@H]1CCCN1 PI-16579 [1,0,0,1,0,0|2,0,0]=4 245 B8R1.7 NC(=O)[C@H]1CCCN1 PI-16293 [1,0,0,1,0,0|2,0,0]=4 246 B8R1.7 OC(=O)C1CCCC1 PI-39143 [1,0,0,1,0,0|1,0,0]=3 247 B8R1.7 OC(=O)C1CCCO1 PI-33719 [1,0,0,1,0,0|2,0,0]=4 248 B8R1.7 OC(=O)C1CNCC1 PI-36920 [1,0,0,1,0,0|2,0,0]=4 249 B8R1.7 OC(=O)[C@H]1CCCN1 PI-31157 [1,0,0,1,0,0|2,0,0]=4 250 B8R1.34 CC(=O)NC1CNC1 PI-39138 [1,0,0,1,0,0|2,0,0]=4 251 B8R1.72 CC1(O)CCCCC1 PI-36472 [1,0,0,1,0,0|0,0,2]=4 252 B10R1.13 CC(C)N1CCC(=O)CC1 PI-43300 [0,1,0,1,0,0|1,0,0]=3 253 B10R1.14 COC(=O)C1CC(CN1)O PI-14274 [0,1,0,1,0,0|2,0,0]=4 254 B10R1.14 COC(=O)C1CCC(=O)C1 PI-42489 [0,1,0,1,0,0|1,0,1]=4 255 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O PI-39281 [0,1,0,1,0,0|2,0,0]=4 256 B10R1.14 O=[C@@](OC)[C@@H]1NC[C@@H](F)C1 PI-36946 [0,1,0,1,0,0|2,0,0]=4 257 B10R1.14 O=[C@@](OC)[C@@H]1NC[C@H](F)C1 PI-36789 [0,1,0,1,0,0|2,0,0]=4 258 B10R1.54 CC(C)CC1COC(=O)N1 PI-35871 [0,1,0,1,0,0|2,0,0]=4 259 B10R1.54 CC(C)CC1COC(=O)N1 PI-35872 [0,1,0,1,0,0|2,0,0]=4 260 B10R1.11 CCOC(=O)C1CC=CC1 PI-33720 [0,1,0,1,0,0|0,0,2]=4 261 B10R1.11 CCOC(=O)C1CCCO1 PI-13056 [0,1,0,1,0,0|1,0,0]=3 262 B10R1.11 CCOC(=O)[C@@H]1CCCN1 PI-33223 [0,1,0,1,0,0|1,0,0]=3 263 B10R1.29 CCCCN1CCCC1=O PI-50565 [0,1,0,1,0,0|1,0,0]=3 264 B10R1.29 NCCCN1CCCC1=O PI-17919 [0,1,0,1,0,0|2,0,0]=4 265 B10R1.85 C1CCCN(CC1)CCN PI-15900 [0,1,0,1,0,0|2,0,0]=4 266 B10R1.85 C1CCCN(CC1)CCO PI-42925 [0,1,0,1,0,0|2,0,0]=4 267 B10R1.85 ClCCN1CCCCCC1 PI-16498 [0,1,0,1,0,0|2,0,0]=4 268 B10R1.135 CCOC(=O)C1CC1C=O PI-17872 [0,1,0,1,0,0|1,0,1]=4 269 B10R1.138 CCCC(=O)OCC1CO1 PI-16670 [0,1,0,1,0,0|2,0,0]=4 270 B10R1.138 CCCC(=O)OC[C@@H]1CO1 PI-16664 [0,1,0,1,0,0|2,0,0]=4 271 B10R1.15 C1COCCN1C(=O)CCl PI-23122 [0,1,0,1,0,0|2,0,0]=4 272 B10R1.15 COC(=O)C1CCCCC1 PI-34205 [0,1,0,1,0,0|1,0,0]=3 273 B10R1.15 COC(=O)C1CCCCN1 PI-25279 [0,1,0,1,0,0|1,0,0]=3 274 B10R1.15 COC(=O)C1CCCCN1 PI-33279 [0,1,0,1,0,0|1,0,0]=3 275 B10R1.15 COC(=O)C1CCCNC1 PI-25618 [0,1,0,1,0,0|1,0,0]=3 276 B10R1.15 COC(=O)C1CCNCC1 PI-24303 [0,1,0,1,0,0|1,0,0]=3 277 B10R1.15 COC(=O)C1CCOCC1 PI-40558 [0,1,0,1,0,0|1,0,0]=3 278 B10R1.15 COC(=O)C1CNCCN1 PI-36154 [0,1,0,1,0,0|2,0,0]=4 279 B10R1.15 COC(=O)N1CCNCC1 PI-43190 [0,1,0,1,0,0|2,0,0]=4 280 B10R1.15 COC(=O)[C@@H]1CCCCN1 PI-25280 [0,1,0,1,0,0|1,0,0]=3 281 B10R1.411 COC(=O)C1(CCCC1)N PI-34598 [0,1,0,1,0,0|1,0,0]=3 282 B10R1.411 C[C@]1(CCCN1)C(=O)OC PI-48346 [0,1,0,1,0,0|2,0,0]=4 283 B10R1.131 CCCC1=NN(C(=O)C1)C PI-19427 [0,1,0,1,0,0|1,0,1]=4 284 B10R1.134 COC(=O)CC(=O)C1CC1 PI-33756 [0,1,0,1,0,0|1,0,1]=4 285 B10R1.149 COC(=O)C1CCCC1=O PI-12298 [0,1,0,1,0,0|1,0,1]=4 286 B10R1.149 COC(=O)C1CNCC1C PI-36282 [0,1,0,1,0,0|1,0,0]=3 287 B10R1.1 CCCC1CCC(CC1)O PI-36674 [0,1,0,1,0,0|0,0,2]=4 288 B10R1.1 CCCN1CCC(=O)CC1 PI-33319 [0,1,0,1,0,0|0,0,0]=2 289 B10R1.161 C1CCCC(=NO)CCC1 PI-30055 [0,1,0,1,0,0|0,0,1]=3 290 B10R2.61 C1CC2CC(C1)OC2=O PI-34881 [0,0,0,2,0,0|1,0,0]=3 291 B10R2.2 NN1CC2C(C1)CCC2 PI-16776 [0,0,0,2,0,0|2,0,0]=4