0 B8R0.7 B(CCCCCC)(O)O PI-25221 [0,0,0,0,0,0|2,0,0]=2 1 B8R0.7 BrCCCCCC(=O)Cl PI-21506 [0,0,0,0,0,0|2,0,2]=4 2 B8R0.7 BrCCCCCC(=O)O PI-26630 [0,0,0,0,0,0|2,0,1]=3 3 B8R0.7 C(CCC(=O)N)CCBr PI-21503 [0,0,0,0,0,0|2,0,2]=4 4 B8R0.7 CC(=O)OCCCSC PI-35854 [0,0,0,0,0,0|2,0,2]=4 5 B8R0.7 CC(NCCCCO)C PI-39829 [0,0,0,0,0,0|3,0,0]=3 6 B8R0.7 CCCCCCC(=O)[O-] PI-46862 [0,0,0,0,0,0|1,0,2]=3 7 B8R0.7 CCCCCCC(C)O PI-10350 [0,0,0,0,0,0|0,0,0]=0 8 B8R0.7 CCCCCOC(=O)Cl PI-24536 [0,0,0,0,0,0|2,0,2]=4 9 B8R0.7 CCCCCOC(=S)[S-] PI-47065 [0,0,0,0,0,0|2,1,1]=4 10 B8R0.7 CCCC\C=C\B(O)O PI-18546 [0,0,0,0,0,0|2,0,2]=4 11 B8R0.7 CCOCCOC(C)=O PI-12911 [0,0,0,0,0,0|2,0,2]=4 12 B8R0.7 O=C(O)CCCCCN PI-41159 [0,0,0,0,0,0|2,0,1]=3 13 B8R0.7 O=C(O)COCCCC PI-32593 [0,0,0,0,0,0|2,0,1]=3 14 B7R0.1 BrCCCCCC#N PI-21504 [1,0,0,0,0,0|2,0,1]=4 15 B7R0.1 C(CCCBr)CCO PI-39099 [1,0,0,0,0,0|1,0,0]=2 16 B7R0.1 C(CCCCl)CCCl PI-44616 [1,0,0,0,0,0|2,0,0]=3 17 B7R0.1 C(CCCS)CCO PI-40491 [1,0,0,0,0,0|1,0,0]=2 18 B7R0.1 C(CCCS)CCS PI-35928 [1,0,0,0,0,0|1,1,0]=3 19 B7R0.1 CCCCCCCBr PI-44628 [1,0,0,0,0,0|1,0,0]=2 20 B7R0.1 CCCCCN=C=O PI-11407 [1,0,0,0,0,0|1,0,2]=4 21 B7R0.1 CCCCNCCN PI-15624 [1,0,0,0,0,0|2,0,0]=3 22 B7R0.1 CCCSSCCC PI-48483 [1,0,0,0,0,0|2,0,0]=3 23 B7R0.1 COCCCCCBr PI-50168 [1,0,0,0,0,0|2,0,0]=3 24 B7R0.1 OCCCCCCCl PI-37141 [1,0,0,0,0,0|1,0,0]=2 25 B7R0.1 OCCCCCCN PI-40365 [1,0,0,0,0,0|1,0,0]=2 26 B7R0.1 OCCCCOC=C PI-12738 [1,0,0,0,0,0|1,0,2]=4 27 B7R0.4 BrCCCCC(=O)O PI-11341 [1,0,0,0,0,0|2,0,1]=4 28 B7R0.4 CC(=O)CCCCCl PI-28023 [1,0,0,0,0,0|1,0,2]=4 29 B7R0.4 CCCCCB(O)O PI-37261 [1,0,0,0,0,0|2,0,0]=3 30 B7R0.4 CCCCC[C@@H](C)O PI-49829 [1,0,0,0,0,0|0,0,0]=1 31 B7R0.4 CCCOCC(=O)O PI-32592 [1,0,0,0,0,0|2,0,1]=4 32 B7R0.4 CN(C)CCCCN PI-23376 [1,0,0,0,0,0|3,0,0]=4 33 B7R0.4 CNCCCN(C)C PI-19630 [1,0,0,0,0,0|3,0,0]=4 34 B7R0.4 NCCCCC(=O)O PI-30804 [1,0,0,0,0,0|2,0,1]=4 35 B7R0.4 OC(=O)CCCCN PI-40783 [1,0,0,0,0,0|2,0,1]=4 36 B9R0.2 B(C=CCCCCC)(O)O PI-25691 [0,1,0,0,0,0|2,0,1]=4 37 B9R0.2 BrCCCCCCC(=O)O PI-36573 [0,1,0,0,0,0|1,0,1]=3 38 B9R0.2 CC(=O)OCCCCCCl PI-44263 [0,1,0,0,0,0|1,0,2]=4 39 B9R0.2 CCCCCCNC(=S)N PI-20722 [0,1,0,0,0,0|1,1,1]=4 40 B9R0.2 CCCCCCOC(=O)Cl PI-41139 [0,1,0,0,0,0|1,0,2]=4 41 B9R0.2 NCCCCCCC(=O)O PI-11340 [0,1,0,0,0,0|1,0,1]=3 42 B9R0.2 O=C(O)CCCCCCO PI-37225 [0,1,0,0,0,0|1,0,1]=3 43 B9R0.4 CCCCC(=O)CC(=O)C PI-36799 [0,1,0,0,0,0|0,0,3]=4 44 B9R0.4 CSCCC(CC(=O)O)N PI-43861 [0,1,0,0,0,0|2,0,1]=4 45 B9R0.38 CCCCCCP(=O)(O)O PI-40609 [0,1,0,0,0,0|2,0,0]=3 46 B9R0.38 CCCCCCS(=O)(=O)Cl PI-20719 [0,1,0,0,0,0|2,0,1]=4 47 B9R0.38 CCCCCCS(=O)(=O)[O-] PI-36859 [0,1,0,0,0,0|2,0,1]=4 48 B9R0.38 CCCCCC[Si](Cl)(Cl)C PI-38996 [0,1,0,0,0,0|1,1,0]=3 49 B9R0.38 CCNCCNC(C)(C)C PI-22937 [0,1,0,0,0,0|3,0,0]=4 50 B9R0.46 CCCCCCC(=O)NN PI-50289 [0,1,0,0,0,0|1,0,2]=4 51 B9R0.46 CCCCCCC(CO)O PI-44204 [0,1,0,0,0,0|0,0,0]=1 52 B9R0.46 COC(=O)CCCCCO PI-45931 [0,1,0,0,0,0|1,0,2]=4 53 B9R0.46 O=C(OC)CCCCCBr PI-40016 [0,1,0,0,0,0|1,0,2]=4 54 B9R0.47 C(CCN)CC(C(=O)O)N PI-14281 [0,1,0,0,0,0|2,0,1]=4 55 B9R0.47 CCCCCC(N)C(=O)O PI-17287 [0,1,0,0,0,0|1,0,1]=3 56 B9R0.47 CCSCCC(C(=O)O)N PI-38397 [0,1,0,0,0,0|2,0,1]=4 57 B9R0.47 NCCCC[C@@H](N)C(=O)O PI-14280 [0,1,0,0,0,0|2,0,1]=4 58 B9R0.47 NCCCC[C@H](C(=O)O)N PI-22775 [0,1,0,0,0,0|2,0,1]=4 59 B9R0.47 O=C(O)[C@@H](N)CCCCN PI-41533 [0,1,0,0,0,0|2,0,1]=4 60 B9R0.55 CC(NCCNC(C)C)C PI-25541 [0,1,0,0,0,0|3,0,0]=4 61 B9R1.2 CCN1CCCC(C1)N PI-35816 [0,0,0,1,0,0|2,0,0]=3 62 B9R1.2 CCN1CCCC(C1)O PI-43238 [0,0,0,1,0,0|1,0,0]=2 63 B9R1.2 CN1CCCC(C1)CO PI-46014 [0,0,0,1,0,0|3,0,0]=4 64 B9R1.6 C1CC(CNC1)C(=O)O PI-21884 [0,0,0,1,0,0|2,0,1]=4 65 B9R1.6 C1CC(CNC1)C(=O)O PI-25607 [0,0,0,1,0,0|2,0,1]=4 66 B9R1.6 C1CCC(CC1)C(=O)N PI-30065 [0,0,0,1,0,0|1,0,2]=4 67 B9R1.6 C1CCN(CC1)C(=O)O PI-13305 [0,0,0,1,0,0|2,0,1]=4 68 B9R1.6 C1CCNC(C1)C(=O)O PI-16483 [0,0,0,1,0,0|2,0,1]=4 69 B9R1.6 C1CNCCC1C(=O)O PI-10271 [0,0,0,1,0,0|2,0,1]=4 70 B9R1.6 C1CNCCC1C(=O)O PI-32117 [0,0,0,1,0,0|2,0,1]=4 71 B9R1.6 C1CSCCC1C(=O)O PI-48819 [0,0,0,1,0,0|2,0,1]=4 72 B9R1.6 CC(C)N1CCNCC1 PI-31735 [0,0,0,1,0,0|3,0,0]=4 73 B9R1.6 CC(C1CCCCC1)N PI-43987 [0,0,0,1,0,0|1,0,0]=2 74 B9R1.6 CC(C1CCCCC1)N PI-44012 [0,0,0,1,0,0|1,0,0]=2 75 B9R1.6 CC(C1CCCCC1)N PI-44013 [0,0,0,1,0,0|1,0,0]=2 76 B9R1.6 CC(C1CCOCC1)=O PI-42683 [0,0,0,1,0,0|1,0,2]=4 77 B9R1.6 CN(C)C1CCCNC1 PI-23400 [0,0,0,1,0,0|3,0,0]=4 78 B9R1.6 CN(C)C1CCCNC1 PI-43350 [0,0,0,1,0,0|3,0,0]=4 79 B9R1.6 CN(C)C1CCNCC1 PI-11072 [0,0,0,1,0,0|3,0,0]=4 80 B9R1.6 CN(C)C1CCNCC1 PI-43349 [0,0,0,1,0,0|3,0,0]=4 81 B9R1.6 OB(C1CCCCC1)O PI-25580 [0,0,0,1,0,0|2,0,0]=3 82 B9R1.6 OC(=O)C1CCCCC1 PI-34204 [0,0,0,1,0,0|1,0,1]=3 83 B9R1.6 OC(=O)C1CCCCN1 PI-16286 [0,0,0,1,0,0|2,0,1]=4 84 B9R1.6 OC(=O)C1CCCOC1 PI-39358 [0,0,0,1,0,0|2,0,1]=4 85 B9R1.6 OC(=O)[C@@H]1CCCCN1 PI-10137 [0,0,0,1,0,0|2,0,1]=4 86 B9R1.6 OC(=O)[C@H]1CCCCN1 PI-10136 [0,0,0,1,0,0|2,0,1]=4 87 B9R1.6 OC(=O)[C@H]1CCCNC1 PI-21885 [0,0,0,1,0,0|2,0,1]=4 88 B9R1.7 CCCC1CC(=O)OC1 PI-44369 [0,0,0,1,0,0|1,0,2]=4 89 B9R1.7 O[C@H]1CN(CCN)CC1 PI-40972 [0,0,0,1,0,0|2,0,0]=3 90 B9R1.13 C1CC(NC1)CC(=O)O PI-27684 [0,0,0,1,0,0|2,0,1]=4 91 B9R1.13 C1CC(NC1)CC(=O)O PI-43782 [0,0,0,1,0,0|2,0,1]=4 92 B9R1.13 C1COCC1CC(=O)O PI-45427 [0,0,0,1,0,0|2,0,1]=4 93 B9R1.13 CN(C)CC1CNCC1 PI-36290 [0,0,0,1,0,0|3,0,0]=4 94 B9R1.16 C#CCCCC1CC1O PI-42403 [0,0,0,1,0,0|0,0,2]=3 95 B9R1.40 CC1(CNCCN1C)C PI-48776 [0,0,0,1,0,0|3,0,0]=4 96 B9R1.41 C1CC(C(C1)N)C(=O)O PI-36305 [0,0,0,1,0,0|2,0,1]=4 97 B9R1.41 CN1CCCC1C(=O)O PI-43187 [0,0,0,1,0,0|2,0,1]=4 98 B9R1.50 C1CCCNC(=O)CC1 PI-38929 [0,0,0,1,0,0|1,0,2]=4 99 B9R1.83 C=CCCCCC1OC1 PI-19272 [0,0,0,1,0,0|0,0,2]=3 100 B9R1.84 C1CC(C1)CCC(=O)O PI-33316 [0,0,0,1,0,0|1,0,1]=3 101 B9R1.85 C1CC1COCC(=O)O PI-48044 [0,0,0,1,0,0|2,0,1]=4 102 B6R0.6 C#CCCCCO PI-40904 [2,0,0,0,0,0|0,0,2]=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|1,0,0]=3 106 B6R0.6 C(CCS)CCS PI-11006 [2,0,0,0,0,0|1,1,0]=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 CNCCCNC PI-32197 [2,0,0,0,0,0|2,0,0]=4 112 B6R0.6 COCCCCBr PI-39605 [2,0,0,0,0,0|2,0,0]=4 113 B6R0.6 ClCCCCCBr PI-10753 [2,0,0,0,0,0|2,0,0]=4 114 B6R0.4 B(CCCC)(O)O PI-16470 [2,0,0,0,0,0|2,0,0]=4 115 B6R0.4 CCC#CC(C)O PI-10903 [2,0,0,0,0,0|0,0,2]=4 116 B6R0.4 CCCCC(C)O PI-42555 [2,0,0,0,0,0|0,0,0]=2 117 B6R0.4 CCCC[C@@H](C)O PI-49839 [2,0,0,0,0,0|0,0,0]=2 118 B8R0.1 CCCCC(CCC)O PI-46865 [1,1,0,0,0,0|0,0,0]=2 119 B8R0.1 CCOCC(C)OCC PI-44418 [1,1,0,0,0,0|2,0,0]=4 120 B8R0.4 CCCCCC#CCBr PI-22217 [1,1,0,0,0,0|0,0,2]=4 121 B8R0.4 CCCCCC=CCO PI-26231 [1,1,0,0,0,0|0,0,1]=3 122 B8R0.4 CCCCCCCCBr PI-44631 [1,1,0,0,0,0|0,0,0]=2 123 B8R0.4 CCCCCCCCCl PI-44615 [1,1,0,0,0,0|0,0,0]=2 124 B8R0.4 CCCCNCCC#N PI-22875 [1,1,0,0,0,0|1,0,1]=4 125 B8R0.4 CCCCSCCCC PI-48485 [1,1,0,0,0,0|0,0,0]=2 126 B8R0.4 CCOCCOCCBr PI-50169 [1,1,0,0,0,0|2,0,0]=4 127 B8R0.4 COCCNCCOC PI-42682 [1,1,0,0,0,0|2,0,0]=4 128 B8R0.4 OCCCCCCC#C PI-40903 [1,1,0,0,0,0|0,0,1]=3 129 B8R0.6 CCCCCC(C=C)O PI-39433 [1,1,0,0,0,0|0,0,2]=4 130 B8R0.6 CCCCCC(CC)O PI-42991 [1,1,0,0,0,0|0,0,0]=2 131 B8R0.6 CCCCC[C@@H](C=C)O PI-49834 [1,1,0,0,0,0|0,0,2]=4 132 B8R0.5 CCOC(=O)CC(C)O PI-12942 [1,1,0,0,0,0|1,0,1]=4 133 B8R0.5 C[C@H](O)CC(OCC)=O PI-37307 [1,1,0,0,0,0|1,0,1]=4 134 B8R0.8 CCCCC(C(=O)O)Br PI-44233 [1,1,0,0,0,0|1,0,1]=4 135 B8R0.9 CCC(C)CCC(O)=O PI-37097 [1,1,0,0,0,0|1,0,1]=4 136 B8R0.28 CC(C)CCCC(=O)C PI-47229 [1,1,0,0,0,0|0,0,2]=4 137 B10R0.77 CCN(CC)CCCC(C)O PI-17704 [0,2,0,0,0,0|1,0,0]=3 138 B10R0.4 B(C=CCCCCCC)(O)O PI-18545 [0,2,0,0,0,0|2,0,0]=4 139 B10R0.4 B(CCCCCCCC)(O)O PI-25412 [0,2,0,0,0,0|2,0,0]=4 140 B10R0.4 BrCCCCCCCC(=O)O PI-14490 [0,2,0,0,0,0|1,0,1]=4 141 B10R0.4 C(CCCC(=O)O)CCCO PI-20834 [0,2,0,0,0,0|1,0,1]=4 142 B10R0.4 CCCCNCCNC(C)C PI-22953 [0,2,0,0,0,0|1,0,0]=3 143 B10R0.4 NCCCCCCCC(=O)O PI-24013 [0,2,0,0,0,0|1,0,1]=4 144 B10R0.6 C(CCN)CC(CC(=O)O)N PI-43593 [0,2,0,0,0,0|1,0,1]=4 145 B10R0.22 CCCNCCNC(C)(C)C PI-23021 [0,2,0,0,0,0|2,0,0]=4 146 B10R0.55 CCC(C)NCCNC(C)C PI-22954 [0,2,0,0,0,0|2,0,0]=4 147 B10R0.74 CCCCCCOC(=O)CN PI-15958 [0,2,0,0,0,0|0,0,2]=4 148 B10R0.75 CCCCCCC(N)C(=O)O PI-30827 [0,2,0,0,0,0|1,0,0]=3 149 B10R0.78 CCCCC(C)CCC(=O)O PI-24483 [0,2,0,0,0,0|1,0,1]=4 150 B10R0.5 CCCCCC(N)P(=O)(O)O PI-17014 [0,2,0,0,0,0|2,0,0]=4 151 B10R0.62 CCCCCCC(C)(CC)O PI-30303 [0,2,0,0,0,0|0,0,0]=2 152 B10R0.1 CCCCCCC(C)N=C=S PI-14646 [0,2,0,0,0,0|0,1,0]=3 153 B8R1.2 BrCC1CCCCC1 PI-33021 [1,0,0,1,0,0|1,0,0]=3 154 B8R1.2 BrCC1CCCOC1 PI-39467 [1,0,0,1,0,0|2,0,0]=4 155 B8R1.2 BrCC1CCNCC1 PI-36265 [1,0,0,1,0,0|2,0,0]=4 156 B8R1.2 BrCC1CCOCC1 PI-14484 [1,0,0,1,0,0|2,0,0]=4 157 B8R1.2 C(C1CCOCC1)O PI-40556 [1,0,0,1,0,0|1,0,0]=3 158 B8R1.2 C1CC(CNC1)CN PI-11064 [1,0,0,1,0,0|2,0,0]=4 159 B8R1.2 C1CC(CNC1)CO PI-11066 [1,0,0,1,0,0|1,0,0]=3 160 B8R1.2 C1CCC(CC1)C#N PI-34206 [1,0,0,1,0,0|1,0,1]=4 161 B8R1.2 C1CCC(CC1)CI PI-44086 [1,0,0,1,0,0|1,0,0]=3 162 B8R1.2 C1CCC(CC1)NN PI-17833 [1,0,0,1,0,0|2,0,0]=4 163 B8R1.2 C1CCC(CC1)NO PI-17940 [1,0,0,1,0,0|1,0,0]=3 164 B8R1.2 C1CCC(CC1)ON PI-47245 [1,0,0,1,0,0|2,0,0]=4 165 B8R1.2 C1CCNC(C1)CO PI-11061 [1,0,0,1,0,0|1,0,0]=3 166 B8R1.2 C1CNCCC1CN PI-11070 [1,0,0,1,0,0|2,0,0]=4 167 B8R1.2 C1CNCCC1CO PI-31327 [1,0,0,1,0,0|1,0,0]=3 168 B8R1.2 C1CN[C@H](CN1)CO PI-49244 [1,0,0,1,0,0|2,0,0]=4 169 B8R1.2 C1COC(CN1)CO PI-41789 [1,0,0,1,0,0|2,0,0]=4 170 B8R1.2 C1COC(CN1)CO PI-44022 [1,0,0,1,0,0|2,0,0]=4 171 B8R1.2 C1COC(CN1)CO PI-44023 [1,0,0,1,0,0|2,0,0]=4 172 B8R1.2 C1CO[C@@H](CO1)CO PI-48359 [1,0,0,1,0,0|2,0,0]=4 173 B8R1.2 C1CO[C@H](CO1)CO PI-48360 [1,0,0,1,0,0|2,0,0]=4 174 B8R1.2 C1C[C@@H](CNC1)CO PI-48081 [1,0,0,1,0,0|1,0,0]=3 175 B8R1.2 CCC1CCCCN1 PI-11060 [1,0,0,1,0,0|1,0,0]=3 176 B8R1.2 CCC1CNCCN1 PI-40004 [1,0,0,1,0,0|2,0,0]=4 177 B8R1.2 CCN1CCNCC1 PI-33488 [1,0,0,1,0,0|2,0,0]=4 178 B8R1.2 CNC1CCCNC1 PI-11067 [1,0,0,1,0,0|2,0,0]=4 179 B8R1.2 CNC1CCNCC1 PI-43342 [1,0,0,1,0,0|2,0,0]=4 180 B8R1.2 CNC1CCNCC1 PI-43343 [1,0,0,1,0,0|2,0,0]=4 181 B8R1.2 CNC1CCOCC1 PI-38449 [1,0,0,1,0,0|2,0,0]=4 182 B8R1.2 COC1CCCNC1 PI-36380 [1,0,0,1,0,0|2,0,0]=4 183 B8R1.2 COC1CCCNC1 PI-43328 [1,0,0,1,0,0|2,0,0]=4 184 B8R1.2 COC1CCNCC1 PI-39354 [1,0,0,1,0,0|2,0,0]=4 185 B8R1.2 COC1CCNCC1 PI-39359 [1,0,0,1,0,0|2,0,0]=4 186 B8R1.2 NCC1CCCCC1 PI-34207 [1,0,0,1,0,0|1,0,0]=3 187 B8R1.2 NCC1CCCCN1 PI-11059 [1,0,0,1,0,0|2,0,0]=4 188 B8R1.2 NCC1CCOCC1 PI-14113 [1,0,0,1,0,0|2,0,0]=4 189 B8R1.2 NOC1CCCCO1 PI-31842 [1,0,0,1,0,0|2,0,0]=4 190 B8R1.2 O=CC1CCCCC1 PI-11615 [1,0,0,1,0,0|0,0,2]=4 191 B8R1.2 OCC1CCCCC1 PI-15325 [1,0,0,1,0,0|0,0,0]=2 192 B8R1.2 OCC1CCNCC1 PI-11073 [1,0,0,1,0,0|1,0,0]=3 193 B8R1.5 C1CCC(=O)C(C1)O PI-29668 [1,0,0,1,0,0|1,0,1]=4 194 B8R1.5 C1CCC(C(C1)N)O PI-30701 [1,0,0,1,0,0|1,0,0]=3 195 B8R1.5 C1CCC(C(C1)N)O PI-35193 [1,0,0,1,0,0|1,0,0]=3 196 B8R1.5 C1CCC(C(C1)N)O PI-35194 [1,0,0,1,0,0|1,0,0]=3 197 B8R1.5 C1CNC[C@H]([C@H]1O)F PI-49290 [1,0,0,1,0,0|2,0,0]=4 198 B8R1.5 C1COCC(C1N)O PI-45087 [1,0,0,1,0,0|2,0,0]=4 199 B8R1.5 CC1CCCCC1N PI-13571 [1,0,0,1,0,0|1,0,0]=3 200 B8R1.5 CC1CNCCC1O PI-43324 [1,0,0,1,0,0|1,0,0]=3 201 B8R1.5 NC1CCCCC1O PI-17286 [1,0,0,1,0,0|1,0,0]=3 202 B8R1.5 N[C@@H]1CCCC[C@@H]1N PI-33717 [1,0,0,1,0,0|2,0,0]=4 203 B8R1.5 N[C@@H]1CCCC[C@H]1N PI-13122 [1,0,0,1,0,0|2,0,0]=4 204 B8R1.5 N[C@@H]1CCCC[C@H]1N PI-16574 [1,0,0,1,0,0|2,0,0]=4 205 B8R1.5 N[C@@H]1CCCC[C@H]1N PI-31383 [1,0,0,1,0,0|2,0,0]=4 206 B8R1.5 N[C@H]1CCCC[C@@H]1N PI-16575 [1,0,0,1,0,0|2,0,0]=4 207 B8R1.5 N[C@H]1CCCC[C@@H]1O PI-38120 [1,0,0,1,0,0|1,0,0]=3 208 B8R1.5 N[C@H]1CCCC[C@H]1O PI-41464 [1,0,0,1,0,0|1,0,0]=3 209 B8R1.5 O[C@H]1[C@H](N)CCCC1 PI-41097 [1,0,0,1,0,0|1,0,0]=3 210 B8R1.8 C1CCN(C1)CCO PI-49853 [1,0,0,1,0,0|1,0,0]=3 211 B8R1.8 C1COC(O1)CCN PI-17178 [1,0,0,1,0,0|2,0,0]=4 212 B8R1.8 CNCC1CCCO1 PI-45431 [1,0,0,1,0,0|1,0,0]=3 213 B8R1.8 COC[C@@H]1CCCN1 PI-35918 [1,0,0,1,0,0|2,0,0]=4 214 B8R1.8 ClCCN1CCCC1 PI-16416 [1,0,0,1,0,0|2,0,0]=4 215 B8R1.11 CN1CCCC1CO PI-28906 [1,0,0,1,0,0|1,0,0]=3 216 B8R1.11 OC[C@H]1N(C)CCC1 PI-28408 [1,0,0,1,0,0|1,0,0]=3 217 B8R1.22 C1CCNCC(C1)N PI-15948 [1,0,0,1,0,0|2,0,0]=4 218 B8R1.22 CN1CCCNCC1 PI-34064 [1,0,0,1,0,0|2,0,0]=4 219 B8R1.36 CCCNCC1CC1 PI-13558 [1,0,0,1,0,0|1,0,0]=3 220 B8R1.1 C1[C@H](CN[C@@H]1CO)O PI-48269 [1,0,0,1,0,0|2,0,0]=4 221 B8R1.1 OC1CN(CC)CC1 PI-40304 [1,0,0,1,0,0|1,0,0]=3 222 B8R1.4 C1CC(CC(C1)O)N PI-34780 [1,0,0,1,0,0|1,0,0]=3 223 B8R1.4 CC1CC(CNC1)C PI-32523 [1,0,0,1,0,0|2,0,0]=4 224 B8R1.4 CC1CCNC(C1)C PI-11063 [1,0,0,1,0,0|2,0,0]=4 225 B8R1.4 CC1CNCC(N1)C PI-11769 [1,0,0,1,0,0|2,0,0]=4 226 B8R1.4 CN1CCCC(C1)N PI-43339 [1,0,0,1,0,0|2,0,0]=4 227 B8R1.4 C[C@@H]1CNC[C@@H](O1)C PI-12868 [1,0,0,1,0,0|1,0,0]=3 228 B8R1.4 O=C1CCC[C@@H](C)O1 PI-27587 [1,0,0,1,0,0|1,0,1]=4 229 B8R1.7 CC(=O)C1CCCC1 PI-38161 [1,0,0,1,0,0|0,0,2]=4 230 B8R1.7 OB(O)C1CCCC1 PI-20922 [1,0,0,1,0,0|2,0,0]=4 231 B8R1.7 OC(=O)C1CCCC1 PI-39143 [1,0,0,1,0,0|1,0,1]=4 232 B8R1.72 C1CCNCC1(C)C PI-38949 [1,0,0,1,0,0|2,0,0]=4 233 B8R1.72 CC1(C)CCNCC1 PI-40549 [1,0,0,1,0,0|2,0,0]=4 234 B8R1.72 CC1(CCCNC1)O PI-43320 [1,0,0,1,0,0|1,0,0]=3 235 B8R1.72 CC1(CCCNC1)O PI-43321 [1,0,0,1,0,0|1,0,0]=3 236 B8R1.72 CC1(CCNCC1)O PI-43202 [1,0,0,1,0,0|1,0,0]=3 237 B8R1.72 CC1(O)CCCCC1 PI-36472 [1,0,0,1,0,0|0,0,0]=2 238 B8R1.72 CC1(O)CCNCC1 PI-42681 [1,0,0,1,0,0|1,0,0]=3 239 B8R1.72 NC1(C)CCOCC1 PI-40814 [1,0,0,1,0,0|2,0,0]=4 240 B10R1.13 C1CC(CCC1C(=O)O)O PI-41501 [0,1,0,1,0,0|1,0,1]=4 241 B10R1.13 CC(C)N1CCC(CC1)N PI-43333 [0,1,0,1,0,0|2,0,0]=4 242 B10R1.13 CC(C)N1CCC(CC1)O PI-43309 [0,1,0,1,0,0|2,0,0]=4 243 B10R1.13 NC1CCC(CC1)C(=O)O PI-17553 [0,1,0,1,0,0|1,0,1]=4 244 B10R1.13 NC1CCC(CC1)C(=O)O PI-36878 [0,1,0,1,0,0|1,0,1]=4 245 B10R1.13 N[C@H]1CC[C@H](N(C)C)CC1 PI-40980 [0,1,0,1,0,0|2,0,0]=4 246 B10R1.18 C1CNCCC1CC(=O)O PI-21883 [0,1,0,1,0,0|1,0,1]=4 247 B10R1.18 CC(=O)CC1CCCCC1 PI-17830 [0,1,0,1,0,0|0,0,2]=4 248 B10R1.18 CC(C)CN1CCNCC1 PI-16004 [0,1,0,1,0,0|2,0,0]=4 249 B10R1.18 CC(CN1CCSCC1)O PI-17918 [0,1,0,1,0,0|1,0,0]=3 250 B10R1.18 CN(C)CC1CCNCC1 PI-43352 [0,1,0,1,0,0|2,0,0]=4 251 B10R1.18 OC(=O)CC1CCCCC1 PI-11618 [0,1,0,1,0,0|1,0,1]=4 252 B10R1.61 CN(C)C1CCCCC1N PI-33728 [0,1,0,1,0,0|2,0,0]=4 253 B10R1.61 CN1CCCCC1C(=O)O PI-25389 [0,1,0,1,0,0|1,0,1]=4 254 B10R1.66 OC(=O)CCC1CCCC1 PI-12731 [0,1,0,1,0,0|1,0,1]=4 255 B10R1.348 C1CCCC(CC1)C(=O)O PI-20907 [0,1,0,1,0,0|1,0,1]=4 256 B10R1.8 CCC1CN(CC(O1)O)C PI-42085 [0,1,0,1,0,0|2,0,0]=4 257 B10R1.28 CC(C)(C)C1CCCCC1 PI-42268 [0,1,0,1,0,0|1,0,0]=3 258 B10R1.1 C1CN(CCC1O)CCN PI-15906 [0,1,0,1,0,0|2,0,0]=4 259 B10R1.1 CCCC1CCC(CC1)O PI-36674 [0,1,0,1,0,0|0,0,0]=2 260 B10R1.15 C1CCC(CC1)C(CO)N PI-42212 [0,1,0,1,0,0|1,0,0]=3 261 B10R1.15 COC(=O)C1CCCCC1 PI-34205 [0,1,0,1,0,0|0,0,2]=4 262 B10R1.15 N[C@@H](C1CCCCC1)CO PI-42211 [0,1,0,1,0,0|1,0,0]=3 263 B10R1.161 C1CCCC(=NO)CCC1 PI-30055 [0,1,0,1,0,0|0,0,1]=3 264 B10R1.23 C1CCC(C1)C(C(=O)O)N PI-18401 [0,1,0,1,0,0|1,0,1]=4 265 B10R1.23 C1CCC(C1)C(C(=O)O)N PI-43694 [0,1,0,1,0,0|1,0,1]=4 266 B10R1.113 C1CC(CC(C1)N)C(=O)O PI-30392 [0,1,0,1,0,0|1,0,1]=4 267 B10R1.113 CC(C)N1CCCC(C1)O PI-43317 [0,1,0,1,0,0|1,0,0]=3 268 B10R1.363 C1CCC(CC1)(C(=O)O)N PI-45023 [0,1,0,1,0,0|1,0,1]=4 269 B10R1.138 CCCC(=O)OCC1CO1 PI-16670 [0,1,0,1,0,0|1,0,1]=4 270 B10R1.138 CCCC(=O)OC[C@@H]1CO1 PI-16664 [0,1,0,1,0,0|1,0,1]=4 271 B10R2.61 C1CC2CC(C1)OC2=O PI-34881 [0,0,0,2,0,0|1,0,1]=4 272 B10R2.62 C1CN2CCC1C(C2)N PI-12324 [0,0,0,2,0,0|2,0,0]=4 273 B10R2.62 NC1CN2CCC1CC2 PI-37848 [0,0,0,2,0,0|2,0,0]=4 274 B10R2.62 N[C@H]1CN2CCC1CC2 PI-13077 [0,0,0,2,0,0|2,0,0]=4 275 B10R2.71 C1CC2CC(CC1N2)O PI-39584 [0,0,0,2,0,0|1,0,0]=3 276 B10R2.2 NN1CC2C(C1)CCC2 PI-16776 [0,0,0,2,0,0|2,0,0]=4 277 B10R2.32 C1COC2C1C(CO2)O PI-44214 [0,0,0,2,0,0|2,0,0]=4