0 B7R0.7 CCCC(=O)CCC SBB060386 [0,0,0,0,0,0|1,1,1]=3 1 B7R0.7 CCCC(N)CCC SBB018801 [0,0,0,0,0,0|2,0,0]=2 2 B7R0.7 CCCC(O)CCC SBB061327 [0,0,0,0,0,0|1,1,0]=2 3 B7R0.7 CCCN(C)CCC SBB061592 [0,0,0,0,0,0|3,0,0]=3 4 B7R0.7 CCNC(C)CCO SBB046562 [0,0,0,0,0,0|2,0,0]=2 5 B7R0.7 CCOC(=O)CCBr SBB070739 [0,0,0,0,0,0|2,1,1]=4 6 B7R0.7 CCOC(=O)CCN SBB004038 [0,0,0,0,0,0|2,1,1]=4 7 B7R0.7 CCOC(C)OCC SBB058503 [0,0,0,0,0,0|4,0,0]=4 8 B6R0.1 C#CC(O)CCC SBB067434 [1,0,0,0,0,0|0,1,2]=4 9 B6R0.1 CCC(O)COC SBB072708 [1,0,0,0,0,0|1,1,0]=3 10 B6R0.1 CCCC(=O)CC SBB061496 [1,0,0,0,0,0|0,1,1]=3 11 B6R0.1 CCCC(=O)OC SBB061104 [1,0,0,0,0,0|1,1,1]=4 12 B6R0.1 CCCC(C)CO SBB061282 [1,0,0,0,0,0|1,0,0]=2 13 B6R0.1 CCCC(O)CC SBB061363 [1,0,0,0,0,0|0,1,0]=2 14 B6R0.1 CCC\C(N)=N/O SBB028173 [1,0,0,0,0,0|2,0,1]=4 15 B6R0.1 CCNC(C)CO SBB046531 [1,0,0,0,0,0|2,0,0]=3 16 B6R0.1 CCOC(=O)CC SBB060312 [1,0,0,0,0,0|1,1,1]=4 17 B6R0.1 CNC(C)CCO SBB046542 [1,0,0,0,0,0|2,0,0]=3 18 B6R0.1 CNCC(C)OC SBB049894 [1,0,0,0,0,0|3,0,0]=4 19 B6R0.1 COCC(O)CN SBB051203 [1,0,0,0,0,0|2,1,0]=4 20 B6R0.1 OC(CBr)CCBr SBB007842 [1,0,0,0,0,0|2,1,0]=4 21 B6R0.6 BrCCOCCBr SBB054744 [1,0,0,0,0,0|3,0,0]=4 22 B6R0.6 C#CCCCCC SBB067441 [1,0,0,0,0,0|1,0,1]=3 23 B6R0.6 C#CCCCCO SBB015110 [1,0,0,0,0,0|0,0,2]=3 24 B6R0.6 C#CCOCCO SBB067658 [1,0,0,0,0,0|1,0,2]=4 25 B6R0.6 C=CCCCCBr SBB054740 [1,0,0,0,0,0|1,0,2]=4 26 B6R0.6 C=CCCCCC SBB059882 [1,0,0,0,0,0|1,0,1]=3 27 B6R0.6 C=CCOCCO SBB060194 [1,0,0,0,0,0|1,0,2]=4 28 B6R0.6 CCCCCC#N SBB060051 [1,0,0,0,0,0|1,0,1]=3 29 B6R0.6 CCCCCCBr SBB059934 [1,0,0,0,0,0|1,0,0]=2 30 B6R0.6 CCCCCCCl SBB059952 [1,0,0,0,0,0|1,0,0]=2 31 B6R0.6 CCCCCCN SBB059984 [1,0,0,0,0,0|1,0,0]=2 32 B6R0.6 CCCCCCO SBB059899 [1,0,0,0,0,0|0,0,0]=1 33 B6R0.6 CCCCCOC SBB061300 [1,0,0,0,0,0|2,0,0]=3 34 B6R0.6 CCCCN=C=S SBB060985 [1,0,0,0,0,0|1,1,1]=4 35 B6R0.6 CCCCNC=O SBB060026 [1,0,0,0,0,0|1,0,2]=4 36 B6R0.6 CCCCOC=O SBB060300 [1,0,0,0,0,0|1,0,2]=4 37 B6R0.6 CCCCSC#N SBB056760 [1,0,0,0,0,0|2,0,1]=4 38 B6R0.6 CCCCSCC SBB061178 [1,0,0,0,0,0|2,0,0]=3 39 B6R0.6 CCCNCCC SBB059762 [1,0,0,0,0,0|2,0,0]=3 40 B6R0.6 CCCOCCO SBB061379 [1,0,0,0,0,0|1,0,0]=2 41 B6R0.6 CCCSCCC SBB061017 [1,0,0,0,0,0|2,0,0]=3 42 B6R0.6 CCCSCCO SBB058605 [1,0,0,0,0,0|1,0,0]=2 43 B6R0.6 CCNCCC#N SBB006528 [1,0,0,0,0,0|2,0,1]=4 44 B6R0.6 CCOCCC#N SBB067181 [1,0,0,0,0,0|2,0,1]=4 45 B6R0.6 CCOCCCN SBB028180 [1,0,0,0,0,0|2,0,0]=3 46 B6R0.6 CC\C=C/CCO SBB007739 [1,0,0,0,0,0|0,0,2]=3 47 B6R0.6 ClCCOCCCl SBB059969 [1,0,0,0,0,0|3,0,0]=4 48 B6R0.6 N#CCCCCCl SBB061418 [1,0,0,0,0,0|2,0,1]=4 49 B6R0.6 NCCCCCN SBB079706 [1,0,0,0,0,0|2,0,0]=3 50 B6R0.6 NCCNCCN SBB059776 [1,0,0,0,0,0|3,0,0]=4 51 B6R0.6 NCCNCCO SBB028183 [1,0,0,0,0,0|2,0,0]=3 52 B6R0.6 NCCOCCO SBB060906 [1,0,0,0,0,0|2,0,0]=3 53 B6R0.6 NCCSCCO SBB056468 [1,0,0,0,0,0|2,0,0]=3 54 B6R0.6 OCCNCCO SBB059779 [1,0,0,0,0,0|2,0,0]=3 55 B6R0.6 OCCOCCCl SBB060189 [1,0,0,0,0,0|2,0,0]=3 56 B6R0.6 OCCSCCO SBB060117 [1,0,0,0,0,0|2,0,0]=3 57 B6R0.6 SCCOCCS SBB058846 [1,0,0,0,0,0|2,1,0]=4 58 B8R0.1 CCCC(=O)OCCCl SBB061294 [0,1,0,0,0,0|1,1,1]=4 59 B8R0.1 CCCCC(O)CCC SBB059905 [0,1,0,0,0,0|1,1,0]=3 60 B8R0.1 CCCCS(=O)CCO SBB019077 [0,1,0,0,0,0|1,1,0]=3 61 B8R0.1 CCCOC(=O)CCC SBB061105 [0,1,0,0,0,0|1,1,1]=4 62 B8R0.1 CCOC(=O)NCCO SBB079074 [0,1,0,0,0,0|1,1,1]=4 63 B8R0.1 O=C(CCS)OCCO SBB008479 [0,1,0,0,0,0|1,1,1]=4 64 B8R0.3 C#CC(O)C(C)CCC SBB009074 [0,1,0,0,0,0|2,0,1]=4 65 B8R0.3 CCN(C)C(C)CCN SBB046528 [0,1,0,0,0,0|3,0,0]=4 66 B8R0.3 O=CC[C@H](O)[C@H](O)CO SBB067136 [0,1,0,0,0,0|1,1,1]=4 67 B8R0.5 CCCC(C)CC(=O)O SBB061321 [0,1,0,0,0,0|1,0,1]=3 68 B8R0.22 C(=O)N(CCC)CCC SBB008026 [0,1,0,0,0,0|2,1,0]=4 69 B8R0.22 CCCC(C=O)CCC SBB052355 [0,1,0,0,0,0|1,1,0]=3 70 B8R0.22 CCN(CCO)CCO SBB058753 [0,1,0,0,0,0|3,0,0]=4 71 B8R1.4 CC1CCCC(C)C1 SBB061164 [0,0,0,1,0,0|2,0,0]=3 72 B8R1.4 CC1CCCC(C)N1 SBB004313 [0,0,0,1,0,0|3,0,0]=4 73 B8R1.4 CC1CCCC(O)C1 SBB061310 [0,0,0,1,0,0|1,0,0]=2 74 B8R1.4 CC1CCNC(C)C1 SBB004310 [0,0,0,1,0,0|2,0,0]=3 75 B8R1.4 CC1CNCC(C)C1 SBB027312 [0,0,0,1,0,0|3,0,0]=4 76 B8R1.4 CN1CCCC(N)C1 SBB047756 [0,0,0,1,0,0|3,0,0]=4 77 B8R1.8 BrCCC1OCCO1 SBB070738 [0,0,0,1,0,0|2,1,0]=4 78 B8R1.8 C=CCC1CCCC1 SBB008872 [0,0,0,1,0,0|2,0,1]=4 79 B8R1.8 CCCC1OCCO1 SBB060981 [0,0,0,1,0,0|2,1,0]=4 80 B8R1.8 CCCC1OCCS1 SBB056724 [0,0,0,1,0,0|2,0,0]=3 81 B8R1.8 COC[C@@H]1CCCN1 SBB006442 [0,0,0,1,0,0|3,0,0]=4 82 B8R1.8 ClCCN1CCCC1 SBB070714 [0,0,0,1,0,0|3,0,0]=4 83 B8R1.8 N#CCC1CCCO1 SBB018702 [0,0,0,1,0,0|1,1,1]=4 84 B8R1.8 NCCC1CCCC1 SBB072011 [0,0,0,1,0,0|2,0,0]=3 85 B8R1.8 NCCN1CCCC1 SBB004304 [0,0,0,1,0,0|3,0,0]=4 86 B8R1.8 OCCC1CCCC1 SBB008459 [0,0,0,1,0,0|1,0,0]=2 87 B8R1.8 OCCN1CCCC1 SBB060257 [0,0,0,1,0,0|2,0,0]=3 88 B8R1.8 OCCN1CCOC1 SBB008304 [0,0,0,1,0,0|3,0,0]=4 89 B8R1.11 CN1CCCC1CO SBB108833 [0,0,0,1,0,0|2,0,0]=3 90 B8R1.22 CN1CCCNCC1 SBB056191 [0,0,0,1,0,0|3,0,0]=4 91 B8R1.22 NC1CCCCCC1 SBB004311 [0,0,0,1,0,0|2,0,0]=3 92 B8R1.22 O=C1CCCCCC1 SBB060075 [0,0,0,1,0,0|1,1,1]=4 93 B8R1.22 OC1CCCCCC1 SBB061138 [0,0,0,1,0,0|1,1,0]=3 94 B5R0.1 CC(C)CCBr SBB061181 [2,0,0,0,0,0|2,0,0]=4 95 B5R0.1 CC(C)CCO SBB060162 [2,0,0,0,0,0|1,0,0]=3 96 B5R0.2 BrCCCCBr SBB060204 [2,0,0,0,0,0|2,0,0]=4 97 B5R0.2 CC#CCCO SBB009118 [2,0,0,0,0,0|0,0,2]=4 98 B5R0.2 CCC#CCO SBB009120 [2,0,0,0,0,0|0,0,2]=4 99 B5R0.2 CCCCCBr SBB059933 [2,0,0,0,0,0|1,0,0]=3 100 B5R0.2 CCCCCCl SBB059951 [2,0,0,0,0,0|1,0,0]=3 101 B5R0.2 CCNNCC SBB069584 [2,0,0,0,0,0|2,0,0]=4 102 B5R0.2 CCOCCBr SBB008332 [2,0,0,0,0,0|2,0,0]=4 103 B5R0.2 CCOCCCl SBB061015 [2,0,0,0,0,0|2,0,0]=4 104 B5R0.2 CCOCCN SBB072161 [2,0,0,0,0,0|2,0,0]=4 105 B5R0.2 CCSCCN SBB017894 [2,0,0,0,0,0|2,0,0]=4 106 B5R0.2 CNCCCN SBB059823 [2,0,0,0,0,0|2,0,0]=4 107 B5R0.2 CSCCCO SBB056451 [2,0,0,0,0,0|1,0,0]=3 108 B5R0.2 FCCCCBr SBB087044 [2,0,0,0,0,0|2,0,0]=4 109 B5R0.2 NCCCCN SBB059998 [2,0,0,0,0,0|2,0,0]=4 110 B5R0.2 OCCCCCl SBB002444 [2,0,0,0,0,0|1,0,0]=3 111 B5R0.3 CCC(C)CBr SBB007669 [2,0,0,0,0,0|2,0,0]=4 112 B5R0.3 CCC(Cl)CCl SBB060453 [2,0,0,0,0,0|2,0,0]=4 113 B5R0.3 CCC(N)CC SBB000050 [2,0,0,0,0,0|1,0,0]=3 114 B5R0.3 CCC(N)CC SBB071911 [2,0,0,0,0,0|1,0,0]=3 115 B5R0.3 OCC(O)CCl SBB060480 [2,0,0,0,0,0|1,1,0]=4 116 B7R0.2 CC(CO)CN(C)C SBB046544 [1,1,0,0,0,0|2,0,0]=4 117 B7R0.2 CCC(C)CC(=O)O SBB008180 [1,1,0,0,0,0|1,0,1]=4 118 B7R0.2 CCC(O)CN(C)C SBB061151 [1,1,0,0,0,0|1,1,0]=4 119 B7R0.3 C=C(CC)CCCC SBB060475 [1,1,0,0,0,0|1,0,1]=4 120 B7R0.3 CC(CN)CCCN SBB058625 [1,1,0,0,0,0|2,0,0]=4 121 B7R0.3 CCCCC(Cl)CCl SBB060394 [1,1,0,0,0,0|2,0,0]=4 122 B7R0.3 CCN(C)CCCO SBB046555 [1,1,0,0,0,0|2,0,0]=4 123 B7R0.3 CCNCC(O)CC SBB072921 [1,1,0,0,0,0|0,1,0]=3 124 B7R0.3 CCOCC(O)CN SBB017905 [1,1,0,0,0,0|1,1,0]=4 125 B7R0.3 OC[C@H](CCSC)N SBB006701 [1,1,0,0,0,0|1,0,0]=3 126 B7R0.5 CC(CCO)N(C)C SBB046554 [1,1,0,0,0,0|2,0,0]=4 127 B7R0.5 CCCC(Br)C(=O)O SBB065976 [1,1,0,0,0,0|1,0,1]=4 128 B7R0.5 CCCC(C)C(=O)O SBB065915 [1,1,0,0,0,0|1,0,1]=4 129 B7R0.5 CCCC(C)C(C)O SBB061491 [1,1,0,0,0,0|1,0,0]=3 130 B7R0.5 CCC[C@@H](N)C(=O)O SBB065919 [1,1,0,0,0,0|1,0,1]=4 131 B7R0.10 OCC(Br)C(Br)CO SBB070873 [1,1,0,0,0,0|2,0,0]=4 132 B7R0.10 OC[C@H]([C@@H](C)CC)N SBB027248 [1,1,0,0,0,0|1,0,0]=3 133 B7R0.11 CCS(=O)(=O)CCO SBB008148 [1,1,0,0,0,0|1,1,0]=4 134 B7R0.12 CCCC(CO)CO SBB059211 [1,1,0,0,0,0|0,1,0]=3 135 B7R0.12 CCN(CC)CCO SBB058521 [1,1,0,0,0,0|2,0,0]=4 136 B7R0.1 BrCCCCCCBr SBB060205 [1,1,0,0,0,0|1,0,0]=3 137 B7R0.1 C#CCNCCCC SBB300093 [1,1,0,0,0,0|1,0,1]=4 138 B7R0.1 C=CCCCCCC SBB059884 [1,1,0,0,0,0|1,0,0]=3 139 B7R0.1 C=CCSCCCC SBB058522 [1,1,0,0,0,0|1,0,1]=4 140 B7R0.1 CCCC#CCCO SBB008799 [1,1,0,0,0,0|0,0,1]=3 141 B7R0.1 CCCCC#CCO SBB008796 [1,1,0,0,0,0|0,0,1]=3 142 B7R0.1 CCCCCCC#N SBB060052 [1,1,0,0,0,0|1,0,0]=3 143 B7R0.1 CCCCCCCBr SBB059936 [1,1,0,0,0,0|1,0,0]=3 144 B7R0.1 CCCCCCCCl SBB059954 [1,1,0,0,0,0|1,0,0]=3 145 B7R0.1 CCCCCCCN SBB059985 [1,1,0,0,0,0|1,0,0]=3 146 B7R0.1 CCCCCCOC SBB061157 [1,1,0,0,0,0|0,0,0]=2 147 B7R0.1 CCCCCN=C=S SBB085742 [1,1,0,0,0,0|0,1,1]=4 148 B7R0.1 CCCCCOC=O SBB060301 [1,1,0,0,0,0|0,0,2]=4 149 B7R0.1 CCCCCSC#N SBB060089 [1,1,0,0,0,0|1,0,1]=4 150 B7R0.1 CCCCNCCC SBB059822 [1,1,0,0,0,0|1,0,0]=3 151 B7R0.1 CCCCOCCBr SBB007731 [1,1,0,0,0,0|1,0,0]=3 152 B7R0.1 CCCCOCCCl SBB059964 [1,1,0,0,0,0|1,0,0]=3 153 B7R0.1 CCCCOCCO SBB059918 [1,1,0,0,0,0|0,0,0]=2 154 B7R0.1 CCCCSCCN SBB072659 [1,1,0,0,0,0|1,0,0]=3 155 B7R0.1 CCCCSCCO SBB013616 [1,1,0,0,0,0|0,0,0]=2 156 B7R0.1 CCCCSCCS SBB057435 [1,1,0,0,0,0|0,1,0]=3 157 B7R0.1 CCCNCCC#N SBB059761 [1,1,0,0,0,0|1,0,1]=4 158 B7R0.1 CCCOCCCN SBB056585 [1,1,0,0,0,0|1,0,0]=3 159 B7R0.1 CCCSSCCC SBB058501 [1,1,0,0,0,0|2,0,0]=4 160 B7R0.1 CCNCCCCO SBB052126 [1,1,0,0,0,0|0,0,0]=2 161 B7R0.1 CCNCCNCC SBB072869 [1,1,0,0,0,0|2,0,0]=4 162 B7R0.1 COCCOCCCl SBB059966 [1,1,0,0,0,0|2,0,0]=4 163 B7R0.1 COCCOCCO SBB059920 [1,1,0,0,0,0|1,0,0]=3 164 B7R0.1 COCCOCCS SBB061387 [1,1,0,0,0,0|1,1,0]=4 165 B7R0.1 COCCSCCO SBB061070 [1,1,0,0,0,0|1,0,0]=3 166 B7R0.1 C\C=C\CCCCC SBB059885 [1,1,0,0,0,0|1,0,1]=4 167 B7R0.1 ClCCCCCCCl SBB060213 [1,1,0,0,0,0|1,0,0]=3 168 B7R0.1 N#CCCCCCBr SBB058579 [1,1,0,0,0,0|1,0,1]=4 169 B7R0.1 N#CCCSCCO SBB069588 [1,1,0,0,0,0|1,0,1]=4 170 B7R0.1 NCCCCCCN SBB059999 [1,1,0,0,0,0|1,0,0]=3 171 B7R0.1 NCCCNCCN SBB052120 [1,1,0,0,0,0|2,0,0]=4 172 B7R0.1 NCCCNCCO SBB059810 [1,1,0,0,0,0|1,0,0]=3 173 B7R0.1 OCCCCCCBr SBB054752 [1,1,0,0,0,0|0,0,0]=2 174 B7R0.1 OCCCCCCCl SBB060188 [1,1,0,0,0,0|0,0,0]=2 175 B7R0.1 OCCCCCCN SBB006584 [1,1,0,0,0,0|0,0,0]=2 176 B7R0.1 OCCCCCCO SBB059915 [1,1,0,0,0,0|0,0,0]=2 177 B7R0.1 OCCCCCCS SBB058615 [1,1,0,0,0,0|0,0,0]=2 178 B7R0.4 CC(C)CCCCBr SBB008833 [1,1,0,0,0,0|1,0,0]=3 179 B7R0.4 CC(C)OCCCN SBB061717 [1,1,0,0,0,0|2,0,0]=4 180 B7R0.4 CC(Cl)COCCCl SBB056511 [1,1,0,0,0,0|2,0,0]=4 181 B7R0.4 CCCCCC(=O)Cl SBB060011 [1,1,0,0,0,0|0,0,2]=4 182 B7R0.4 CCCCCC(=O)O SBB053586 [1,1,0,0,0,0|0,0,1]=3 183 B7R0.4 CCCCCC(C)=O SBB061125 [1,1,0,0,0,0|0,0,2]=4 184 B7R0.4 CCCCCC(N)=O SBB061056 [1,1,0,0,0,0|0,0,2]=4 185 B7R0.4 CCCCOC(Cl)Cl SBB060510 [1,1,0,0,0,0|2,0,0]=4 186 B7R0.4 CCCOCC(C)O SBB061007 [1,1,0,0,0,0|1,0,0]=3 187 B7R0.4 CCOCCC(=O)O SBB053607 [1,1,0,0,0,0|1,0,1]=4 188 B7R0.4 CN(C)CCCCN SBB008514 [1,1,0,0,0,0|2,0,0]=4 189 B7R0.4 NCCCCC(=O)O SBB061559 [1,1,0,0,0,0|1,0,1]=4 190 B7R0.4 O=C(O)CCCCBr SBB061343 [1,1,0,0,0,0|1,0,1]=4 191 B7R0.4 O=C(O)CCCCCl SBB061215 [1,1,0,0,0,0|1,0,1]=4 192 B9R0.35 CCCC(=O)C(O)CCC SBB008396 [0,2,0,0,0,0|1,1,0]=4 193 B9R0.40 CCCC(CC)NCCO SBB059831 [0,2,0,0,0,0|1,0,0]=3 194 B9R0.37 CCCC(O)C(CC)CO SBB060488 [0,2,0,0,0,0|0,1,0]=3 195 B9R0.53 CC(C)CC(O)CC(C)C SBB060165 [0,2,0,0,0,0|1,1,0]=4 196 B9R0.15 CCCC(CCC)C(=O)O SBB065764 [0,2,0,0,0,0|1,1,0]=4 197 B9R0.15 CCCC(CCC)C(N)=O SBB015062 [0,2,0,0,0,0|1,1,0]=4 198 B9R0.17 CCCN(CCO)CCO SBB061588 [0,2,0,0,0,0|1,1,0]=4 199 B7R1.1 BrCC1CCCC1 SBB054968 [1,0,0,1,0,0|2,0,0]=4 200 B7R1.1 BrCC1CCCO1 SBB003909 [1,0,0,1,0,0|1,1,0]=4 201 B7R1.1 ClCC1CCCN1 SBB018633 [1,0,0,1,0,0|2,0,0]=4 202 B7R1.1 ClCC1CCCO1 SBB008957 [1,0,0,1,0,0|1,1,0]=4 203 B7R1.1 NCC1CCCO1 SBB028168 [1,0,0,1,0,0|1,1,0]=4 204 B7R1.1 OCC1CCCC1 SBB008516 [1,0,0,1,0,0|1,0,0]=3 205 B7R1.1 OCC1CCCO1 SBB058567 [1,0,0,1,0,0|0,1,0]=3 206 B7R1.1 OCC1CCNC1 SBB046413 [1,0,0,1,0,0|2,0,0]=4 207 B7R1.1 OCC1OCCO1 SBB059646 [1,0,0,1,0,0|1,1,0]=4 208 B7R1.1 OC[C@H]1CCCN1 SBB027252 [1,0,0,1,0,0|1,0,0]=3 209 B7R1.3 BrC1CCCCC1 SBB059944 [1,0,0,1,0,0|1,0,0]=3 210 B7R1.3 BrC1CCNCC1 SBB054613 [1,0,0,1,0,0|2,0,0]=4 211 B7R1.3 CC1CCCCC1 SBB061163 [1,0,0,1,0,0|1,0,0]=3 212 B7R1.3 CN1CCCCC1 SBB060237 [1,0,0,1,0,0|2,0,0]=4 213 B7R1.3 CN1CCOCC1 SBB061013 [1,0,0,1,0,0|2,0,0]=4 214 B7R1.3 ClC1CCOCC1 SBB070678 [1,0,0,1,0,0|1,0,0]=3 215 B7R1.3 FC1CCCNC1 SBB070684 [1,0,0,1,0,0|2,0,0]=4 216 B7R1.3 FC1CCNCC1 SBB070685 [1,0,0,1,0,0|2,0,0]=4 217 B7R1.3 N1CCC(C)CC1 SBB027302 [1,0,0,1,0,0|2,0,0]=4 218 B7R1.3 N1CCCC(C)C1 SBB027301 [1,0,0,1,0,0|2,0,0]=4 219 B7R1.3 N1CCCC(O)C1 SBB004193 [1,0,0,1,0,0|1,1,0]=4 220 B7R1.3 N1CCCCC1C SBB027300 [1,0,0,1,0,0|2,0,0]=4 221 B7R1.3 NC1CCCCC1 SBB040492 [1,0,0,1,0,0|1,0,0]=3 222 B7R1.3 NC1CCCNC1 SBB052004 [1,0,0,1,0,0|2,0,0]=4 223 B7R1.3 NC1CCCOC1 SBB012974 [1,0,0,1,0,0|1,0,0]=3 224 B7R1.3 NC1CCNCC1 SBB028166 [1,0,0,1,0,0|2,0,0]=4 225 B7R1.3 NC1CCOCC1 SBB014873 [1,0,0,1,0,0|1,0,0]=3 226 B7R1.3 NC1CCOCC1 SBB069906 [1,0,0,1,0,0|1,0,0]=3 227 B7R1.3 NN1CCCCC1 SBB067336 [1,0,0,1,0,0|2,0,0]=4 228 B7R1.3 NN1CCOCC1 SBB004363 [1,0,0,1,0,0|2,0,0]=4 229 B7R1.3 N[C@@H]1CCCNC1 SBB069744 [1,0,0,1,0,0|2,0,0]=4 230 B7R1.3 N[C@H]1CCCNC1 SBB017596 [1,0,0,1,0,0|2,0,0]=4 231 B7R1.3 O=C1CCCCC1 SBB060074 [1,0,0,1,0,0|0,1,1]=4 232 B7R1.3 O=C1CCOCC1 SBB049627 [1,0,0,1,0,0|0,1,1]=4 233 B7R1.3 OC1CCCCC1 SBB060483 [1,0,0,1,0,0|0,1,0]=3 234 B7R1.3 OC1CCCCO1 SBB055947 [1,0,0,1,0,0|1,1,0]=4 235 B7R1.3 OC1CCCNC1 SBB027351 [1,0,0,1,0,0|1,1,0]=4 236 B7R1.3 OC1CCNCC1 SBB027346 [1,0,0,1,0,0|1,1,0]=4 237 B7R1.3 OC1CCOCC1 SBB055945 [1,0,0,1,0,0|0,1,0]=3 238 B7R1.4 BrC1CCCC1Br SBB060684 [1,0,0,1,0,0|2,0,0]=4 239 B7R1.4 ClC1CCCC1Cl SBB060212 [1,0,0,1,0,0|2,0,0]=4 240 B7R1.4 N[C@@H]1CSC[C@H]1O SBB014689 [1,0,0,1,0,0|2,0,0]=4 241 B7R1.4 OC1CCCC1Cl SBB060196 [1,0,0,1,0,0|1,0,0]=3 242 B7R1.4 O[C@H]1CCC[C@H]1O SBB008502 [1,0,0,1,0,0|0,1,0]=3 243 B7R1.25 CC1(CO)COC1 SBB006512 [1,0,0,1,0,0|2,0,0]=4 244 B7R1.25 CC1(CO)COC1 SBB009078 [1,0,0,1,0,0|2,0,0]=4 245 B7R1.7 CCCCC1CO1 SBB017137 [1,0,0,1,0,0|0,0,0]=2 246 B7R1.24 C1=CCCCCC1 SBB059889 [1,0,0,1,0,0|1,0,1]=4 247 B7R1.24 C1CCCCCC1 SBB060406 [1,0,0,1,0,0|1,0,0]=3 248 B7R1.24 C1CNCCNC1 SBB004367 [1,0,0,1,0,0|2,0,0]=4 249 B7R1.24 C1CNCCOC1 SBB049498 [1,0,0,1,0,0|1,0,0]=3 250 B7R1.24 N1CCCCCC1 SBB027297 [1,0,0,1,0,0|1,0,0]=3 251 B9R1.2 CCN1CCCC(N)C1 SBB010256 [0,1,0,1,0,0|2,0,0]=4 252 B9R1.2 CN1CCCC(CO)C1 SBB108760 [0,1,0,1,0,0|2,0,0]=4 253 B9R1.2 CN1CCOC(CN)C1 SBB002810 [0,1,0,1,0,0|2,0,0]=4 254 B9R1.2 O=C1CCCC(CO)C1 SBB054862 [0,1,0,1,0,0|0,1,1]=4 255 B9R1.7 CCCC1OCC(C)O1 SBB060973 [0,1,0,1,0,0|1,1,0]=4 256 B9R1.8 BrCCC1CCCCN1 SBB018737 [0,1,0,1,0,0|2,0,0]=4 257 B9R1.8 BrCCC1OCCCO1 SBB054748 [0,1,0,1,0,0|1,1,0]=4 258 B9R1.8 CCCC1CCCCN1 SBB017578 [0,1,0,1,0,0|2,0,0]=4 259 B9R1.8 CCCC1CCCCN1 SBB050937 [0,1,0,1,0,0|2,0,0]=4 260 B9R1.8 CCCC1OCCCO1 SBB060994 [0,1,0,1,0,0|1,1,0]=4 261 B9R1.8 CCCN1CCOCC1 SBB061033 [0,1,0,1,0,0|2,0,0]=4 262 B9R1.8 CNCC1COCCO1 SBB002649 [0,1,0,1,0,0|2,0,0]=4 263 B9R1.8 NCCC1CCCCC1 SBB051424 [0,1,0,1,0,0|2,0,0]=4 264 B9R1.8 NCCC1CCCCO1 SBB072556 [0,1,0,1,0,0|1,1,0]=4 265 B9R1.8 NCCC1CCCOC1 SBB050548 [0,1,0,1,0,0|1,1,0]=4 266 B9R1.8 OCCC1CCCCN1 SBB027305 [0,1,0,1,0,0|1,0,0]=3 267 B9R1.8 OCCC1CCNCC1 SBB027320 [0,1,0,1,0,0|1,0,0]=3 268 B9R1.8 OCCN1CCCCC1 SBB040888 [0,1,0,1,0,0|2,0,0]=4 269 B9R1.8 OCCN1CCNCC1 SBB004225 [0,1,0,1,0,0|2,0,0]=4 270 B9R1.8 OCCN1CCOCC1 SBB004221 [0,1,0,1,0,0|2,0,0]=4 271 B9R1.12 CCCNC1CCCC1 SBB080044 [0,1,0,1,0,0|2,0,0]=4 272 B9R1.12 CCNCC1CCCO1 SBB080022 [0,1,0,1,0,0|1,1,0]=4 273 B9R1.12 NCCCC1CCOC1 SBB012984 [0,1,0,1,0,0|1,0,0]=3 274 B9R1.15 CN1CCCCC1CO SBB062716 [0,1,0,1,0,0|2,0,0]=4 275 B9R1.15 O=C1CCCCC1CO SBB054864 [0,1,0,1,0,0|0,1,1]=4 276 B9R1.33 CN1CCCC1CCO SBB056164 [0,1,0,1,0,0|1,0,0]=3 277 B9R1.33 NN1CCC[C@@H]1COC SBB017518 [0,1,0,1,0,0|2,0,0]=4 278 B9R1.33 NN1CCC[C@H]1COC SBB017520 [0,1,0,1,0,0|2,0,0]=4 279 B9R1.50 NC1CCCCCCC1 SBB004245 [0,1,0,1,0,0|2,0,0]=4 280 B9R1.50 OC1CCCCCCC1 SBB058905 [0,1,0,1,0,0|1,1,0]=4 281 B9R1.134 CNCC1(C)OCCO1 SBB002814 [0,1,0,1,0,0|2,0,0]=4 282 B9R1.134 NCCC1(O)CCCC1 SBB050900 [0,1,0,1,0,0|1,1,0]=4 283 B9R1.3 CC1CCCC(N)C1C SBB061727 [0,1,0,1,0,0|2,0,0]=4 284 B9R1.11 CC(CO)N1CCCC1 SBB046591 [0,1,0,1,0,0|2,0,0]=4 285 B9R1.13 CC(O)CN1CCCC1 SBB056722 [0,1,0,1,0,0|2,0,0]=4 286 B9R1.13 O=C(O)CC1CCCC1 SBB080711 [0,1,0,1,0,0|1,0,1]=4 287 B9R1.13 O=C(O)CC1CCCO1 SBB002788 [0,1,0,1,0,0|0,1,1]=4 288 B9R1.13 O=C(O)C[C@@H]1CCCN1 SBB066746 [0,1,0,1,0,0|1,0,1]=4 289 B9R1.34 CC1CC(=O)CC(C)O1 SBB056218 [0,1,0,1,0,0|0,1,1]=4 290 B9R1.34 CC1CC(C)CC(C)C1 SBB061287 [0,1,0,1,0,0|2,0,0]=4 291 B9R1.34 CC1CC(O)CN(C)C1 SBB002820 [0,1,0,1,0,0|2,0,0]=4 292 B9R1.34 OC1CC(O)CC(O)C1 SBB061570 [0,1,0,1,0,0|0,1,0]=3 293 B9R1.66 CC1(C)CC(=O)CCO1 SBB048828 [0,1,0,1,0,0|0,1,1]=4 294 B9R1.14 CCN1CCCC1CO SBB108758 [0,1,0,1,0,0|2,0,0]=4 295 B9R1.89 N#CC1CCCCCC1 SBB008917 [0,1,0,1,0,0|2,0,0]=4 296 B9R1.89 O=CC1CCCCCC1 SBB059644 [0,1,0,1,0,0|1,1,0]=4 297 B9R2.39 N[C@H]1C[C@@H]2CCC1C2 SBB017219 [0,0,0,2,0,0|2,0,0]=4 298 B9R2.24 C12CCC(CC1)C2Br SBB054711 [0,0,0,2,0,0|2,0,0]=4