0 B9R1.33 BrCCc1ccsc1Br Amb27793997 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.33 BrCCc1sccc1Br Amb25804548 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.33 BrCCn1ccnc1Br Amb27268689 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.33 C#CCc1ccnn1C Amb33323502 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.33 C#CCc1ccoc1C Amb33224609 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.33 C#CCc1occc1C Amb33501881 [0,0,0,0,0,0|2,1,1]=4 6 B9R1.33 C#CCc1sccc1Br Amb33387509 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.33 C#CCc1sccc1C Amb33202960 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.33 C#CCc1sccc1Cl Amb33257934 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.33 C#CCc1scnc1C Amb32875942 [0,0,0,0,0,0|1,0,1]=2 10 B9R1.33 C#CCn1ccnc1C Amb19291616 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.33 C=CCc1ccnn1C Amb24391233 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.33 C=CCc1sccc1I Amb27268613 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.33 C=CCc1scnc1C Amb35636154 [0,0,0,0,0,0|1,0,1]=2 14 B9R1.33 C=CCn1ccnc1C Amb8384842 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.33 CC1=C(CCO)CC=C1 Amb27761613 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.33 CC1=NC=CC1CCN Amb27440770 [0,0,0,0,0,0|2,0,1]=3 17 B9R1.33 CC1=NCCN1CCN Amb24580519 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.33 CC1CC=NN1CCO Amb27662434 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.33 CC1N=CC=N1CCN Amb20414404 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.33 CC1NCSC1CCO Amb27185591 [0,0,0,0,0,0|0,0,4]=4 21 B9R1.33 CCCc1cccn1C Amb27259846 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.33 CCCc1ccsc1C Amb26622189 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.33 CCCc1conc1N Amb25809543 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.33 CCCc1ncsc1Br Amb20617307 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.33 CCCc1ncsc1N Amb18958393 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.33 CCCc1nnnn1C Amb28349637 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.33 CCCc1nonc1N Amb33528945 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.33 CCCc1scnc1Br Amb20617257 [0,0,0,0,0,0|2,0,0]=2 29 B9R1.33 CCCc1scnc1C Amb28364975 [0,0,0,0,0,0|1,0,0]=1 30 B9R1.33 CCCc1scnc1N Amb24317506 [0,0,0,0,0,0|2,0,0]=2 31 B9R1.33 CCCn1cccc1C Amb27186235 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.33 CCCn1ccnc1Br Amb17401245 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.33 CCCn1ccnc1C Amb24529103 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.33 CCCn1ccnc1I Amb32685566 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.33 CCCn1ccnc1N Amb18281317 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.33 CCCn1ccnc1S Amb419350 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.33 CCCn1cnnc1C Amb22157279 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.33 CCCn1nccc1C Amb6889683 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.33 CCCn1ncnc1Br Amb19517062 [0,0,0,0,0,0|4,0,0]=4 40 B9R1.33 CCCn1ncnc1I Amb32685615 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.33 CCCn1ncnc1N Amb18963227 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.33 CCCn1nnnc1C Amb27768704 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.33 CCNc1nonc1C Amb28436360 [0,0,0,0,0,0|4,0,0]=4 44 B9R1.33 CCOc1ocnc1C Amb8394921 [0,0,0,0,0,0|2,1,0]=3 45 B9R1.33 CCOc1sccc1N Amb19929914 [0,0,0,0,0,0|4,0,0]=4 46 B9R1.33 CCSc1ccoc1C Amb27220426 [0,0,0,0,0,0|4,0,0]=4 47 B9R1.33 CCSc1ncnn1C Amb27486638 [0,0,0,0,0,0|4,0,0]=4 48 B9R1.33 CCSc1ocnc1C Amb27851563 [0,0,0,0,0,0|2,1,0]=3 49 B9R1.33 CCSc1sccc1Br Amb28202686 [0,0,0,0,0,0|4,0,0]=4 50 B9R1.33 CNCc1ccnn1C Amb1946200 [0,0,0,0,0,0|4,0,0]=4 51 B9R1.33 CNCc1ccnn1C Amb28934941 [0,0,0,0,0,0|4,0,0]=4 52 B9R1.33 CNCc1ccoc1C Amb10610125 [0,0,0,0,0,0|4,0,0]=4 53 B9R1.33 CNCc1ccoc1C Amb6572127 [0,0,0,0,0,0|4,0,0]=4 54 B9R1.33 CNCc1ncnn1C Amb18963439 [0,0,0,0,0,0|4,0,0]=4 55 B9R1.33 CNCc1ncoc1C Amb18642434 [0,0,0,0,0,0|4,0,0]=4 56 B9R1.33 CNCc1nonc1C Amb1090870 [0,0,0,0,0,0|4,0,0]=4 57 B9R1.33 CNCc1nsnc1C Amb18202470 [0,0,0,0,0,0|4,0,0]=4 58 B9R1.33 CNCc1occc1C Amb6572132 [0,0,0,0,0,0|3,1,0]=4 59 B9R1.33 CNCc1ocnc1C Amb16230505 [0,0,0,0,0,0|2,1,0]=3 60 B9R1.33 CNCc1ocnc1C Amb35747477 [0,0,0,0,0,0|2,1,0]=3 61 B9R1.33 CNCc1sccc1Br Amb16230502 [0,0,0,0,0,0|4,0,0]=4 62 B9R1.33 CNCc1sccc1Br Amb20623997 [0,0,0,0,0,0|4,0,0]=4 63 B9R1.33 CNCc1sccc1C Amb5729070 [0,0,0,0,0,0|3,0,0]=3 64 B9R1.33 CNCc1sccc1C Amb837566 [0,0,0,0,0,0|3,0,0]=3 65 B9R1.33 CNCc1sccc1Cl Amb26950450 [0,0,0,0,0,0|4,0,0]=4 66 B9R1.33 CNCc1sccc1I Amb27866188 [0,0,0,0,0,0|4,0,0]=4 67 B9R1.33 CNCc1scnc1C Amb21959891 [0,0,0,0,0,0|2,0,0]=2 68 B9R1.33 CNCc1scnc1C Amb33549699 [0,0,0,0,0,0|2,0,0]=2 69 B9R1.33 CNCc1snnc1C Amb9133082 [0,0,0,0,0,0|3,0,0]=3 70 B9R1.33 COCc1ccnn1C Amb24269821 [0,0,0,0,0,0|4,0,0]=4 71 B9R1.33 COCc1ccsc1C Amb27185549 [0,0,0,0,0,0|4,0,0]=4 72 B9R1.33 COCc1ncoc1C Amb27240103 [0,0,0,0,0,0|4,0,0]=4 73 B9R1.33 COCc1occc1C Amb27665910 [0,0,0,0,0,0|3,1,0]=4 74 B9R1.33 COCc1sccc1Br Amb27222407 [0,0,0,0,0,0|4,0,0]=4 75 B9R1.33 COCc1sccc1Cl Amb27791946 [0,0,0,0,0,0|4,0,0]=4 76 B9R1.33 COCc1scnc1N Amb25147198 [0,0,0,0,0,0|3,0,0]=3 77 B9R1.33 COCn1ccnc1C Amb23401111 [0,0,0,0,0,0|4,0,0]=4 78 B9R1.33 CSCc1ccoc1C Amb27186359 [0,0,0,0,0,0|4,0,0]=4 79 B9R1.33 CSCc1ncoc1C Amb27252960 [0,0,0,0,0,0|4,0,0]=4 80 B9R1.33 CSCc1sccc1Br Amb28062716 [0,0,0,0,0,0|4,0,0]=4 81 B9R1.33 CSCc1scnc1Cl Amb28369959 [0,0,0,0,0,0|3,0,0]=3 82 B9R1.33 C\N=C\c1ocnc1C Amb27789050 [0,0,0,0,0,0|2,1,1]=4 83 B9R1.33 Cc1cccn1CCBr Amb27863512 [0,0,0,0,0,0|4,0,0]=4 84 B9R1.33 Cc1ccnn1CCBr Amb26484575 [0,0,0,0,0,0|4,0,0]=4 85 B9R1.33 Cc1ccnn1CCCl Amb535954 [0,0,0,0,0,0|4,0,0]=4 86 B9R1.33 Cc1ccnn1CCF Amb23449807 [0,0,0,0,0,0|4,0,0]=4 87 B9R1.33 Cc1ccnn1CCN Amb32434791 [0,0,0,0,0,0|4,0,0]=4 88 B9R1.33 Cc1ccnn1CCN Amb535647 [0,0,0,0,0,0|4,0,0]=4 89 B9R1.33 Cc1ccnn1CCO Amb7089061 [0,0,0,0,0,0|3,0,0]=3 90 B9R1.33 Cc1ccoc1CC#N Amb25247026 [0,0,0,0,0,0|2,1,1]=4 91 B9R1.33 Cc1ccoc1CC=O Amb28198051 [0,0,0,0,0,0|1,1,2]=4 92 B9R1.33 Cc1ccoc1CCBr Amb26874546 [0,0,0,0,0,0|2,1,0]=3 93 B9R1.33 Cc1ccoc1CCCl Amb28366072 [0,0,0,0,0,0|2,1,0]=3 94 B9R1.33 Cc1ccoc1CCN Amb18832814 [0,0,0,0,0,0|2,1,0]=3 95 B9R1.33 Cc1ccoc1CCO Amb25300068 [0,0,0,0,0,0|1,1,0]=2 96 B9R1.33 Cc1ccoc1CCS Amb33342789 [0,0,0,0,0,0|1,2,0]=3 97 B9R1.33 Cc1ccoc1CNN Amb6250434 [0,0,0,0,0,0|3,1,0]=4 98 B9R1.33 Cc1ccoc1CNO Amb26944486 [0,0,0,0,0,0|2,1,0]=3 99 B9R1.33 Cc1ccoc1CON Amb33343539 [0,0,0,0,0,0|3,1,0]=4 100 B9R1.33 Cc1ccsc1CC#N Amb27268122 [0,0,0,0,0,0|2,0,1]=3 101 B9R1.33 Cc1ccsc1CC=O Amb27155654 [0,0,0,0,0,0|1,0,2]=3 102 B9R1.33 Cc1ccsc1CCBr Amb25234538 [0,0,0,0,0,0|2,0,0]=2 103 B9R1.33 Cc1ccsc1CCN Amb2592465 [0,0,0,0,0,0|2,0,0]=2 104 B9R1.33 Cc1ccsc1CCN Amb33291373 [0,0,0,0,0,0|2,0,0]=2 105 B9R1.33 Cc1ccsc1CCN Amb8503271 [0,0,0,0,0,0|2,0,0]=2 106 B9R1.33 Cc1ccsc1CCO Amb25935748 [0,0,0,0,0,0|1,0,0]=1 107 B9R1.33 Cc1ccsc1CCS Amb25108739 [0,0,0,0,0,0|1,1,0]=2 108 B9R1.33 Cc1ccsc1CNN Amb6244503 [0,0,0,0,0,0|3,0,0]=3 109 B9R1.33 Cc1ccsc1CNO Amb27971966 [0,0,0,0,0,0|2,0,0]=2 110 B9R1.33 Cc1ccsc1CON Amb27847247 [0,0,0,0,0,0|3,0,0]=3 111 B9R1.33 Cc1ccsc1N=C=S Amb27771108 [0,0,0,0,0,0|2,1,1]=4 112 B9R1.33 Cc1ccsc1NC=O Amb8439406 [0,0,0,0,0,0|2,0,2]=4 113 B9R1.33 Cc1ccsc1\C=C\Br Amb33134854 [0,0,0,0,0,0|2,0,2]=4 114 B9R1.33 Cc1ccsc1\C=N\N Amb22342744 [0,0,0,0,0,0|3,0,1]=4 115 B9R1.33 Cc1ccsc1\C=N\O Amb2782070 [0,0,0,0,0,0|2,0,1]=3 116 B9R1.33 Cc1cnoc1CNO Amb27843574 [0,0,0,0,0,0|3,1,0]=4 117 B9R1.33 Cc1cnsc1CC#N Amb28053164 [0,0,0,0,0,0|3,0,1]=4 118 B9R1.33 Cc1cnsc1CCO Amb27598622 [0,0,0,0,0,0|2,0,0]=2 119 B9R1.33 Cc1cocc1CCBr Amb27613578 [0,0,0,0,0,0|4,0,0]=4 120 B9R1.33 Cc1cocc1CCN Amb18832813 [0,0,0,0,0,0|4,0,0]=4 121 B9R1.33 Cc1cocc1CCO Amb26918329 [0,0,0,0,0,0|3,0,0]=3 122 B9R1.33 Cc1conc1CCO Amb28315531 [0,0,0,0,0,0|3,0,0]=3 123 B9R1.33 Cc1cscc1CCBr Amb33436102 [0,0,0,0,0,0|4,0,0]=4 124 B9R1.33 Cc1cscc1CCN Amb20529271 [0,0,0,0,0,0|4,0,0]=4 125 B9R1.33 Cc1cscc1CCO Amb33147729 [0,0,0,0,0,0|3,0,0]=3 126 B9R1.33 Cc1cscc1CCS Amb33226430 [0,0,0,0,0,0|3,1,0]=4 127 B9R1.33 Cc1cscc1CNO Amb28129567 [0,0,0,0,0,0|4,0,0]=4 128 B9R1.33 Cc1csnc1CCN Amb18202551 [0,0,0,0,0,0|4,0,0]=4 129 B9R1.33 Cc1nccn1CC#N Amb6260979 [0,0,0,0,0,0|3,0,1]=4 130 B9R1.33 Cc1nccn1CCBr Amb10609382 [0,0,0,0,0,0|3,0,0]=3 131 B9R1.33 Cc1nccn1CCBr Amb6255204 [0,0,0,0,0,0|3,0,0]=3 132 B9R1.33 Cc1nccn1CCCl Amb22587120 [0,0,0,0,0,0|3,0,0]=3 133 B9R1.33 Cc1nccn1CCCl Amb8828369 [0,0,0,0,0,0|3,0,0]=3 134 B9R1.33 Cc1nccn1CCN Amb17659444 [0,0,0,0,0,0|3,0,0]=3 135 B9R1.33 Cc1nccn1CCN Amb21955194 [0,0,0,0,0,0|3,0,0]=3 136 B9R1.33 Cc1nccn1CCN Amb29083248 [0,0,0,0,0,0|3,0,0]=3 137 B9R1.33 Cc1nccn1CCN Amb33543300 [0,0,0,0,0,0|3,0,0]=3 138 B9R1.33 Cc1nccn1CCN Amb34930379 [0,0,0,0,0,0|3,0,0]=3 139 B9R1.33 Cc1nccn1CCO Amb6307699 [0,0,0,0,0,0|2,0,0]=2 140 B9R1.33 Cc1nccn1CCS Amb20668959 [0,0,0,0,0,0|2,1,0]=3 141 B9R1.33 Cc1ncnn1CCN Amb18917106 [0,0,0,0,0,0|3,0,0]=3 142 B9R1.33 Cc1ncoc1CC#N Amb24413842 [0,0,0,0,0,0|1,1,1]=3 143 B9R1.33 Cc1ncoc1CCCl Amb27258552 [0,0,0,0,0,0|1,1,0]=2 144 B9R1.33 Cc1ncoc1CCN Amb17399804 [0,0,0,0,0,0|1,1,0]=2 145 B9R1.33 Cc1ncoc1CCO Amb17399816 [0,0,0,0,0,0|0,1,0]=1 146 B9R1.33 Cc1ncoc1\C=C\Br Amb33135378 [0,0,0,0,0,0|1,1,2]=4 147 B9R1.33 Cc1ncoc1\C=N\O Amb27613075 [0,0,0,0,0,0|1,1,1]=3 148 B9R1.33 Cc1ncsc1CC#N Amb18560817 [0,0,0,0,0,0|1,0,1]=2 149 B9R1.33 Cc1ncsc1CC=O Amb8010897 [0,0,0,0,0,0|0,0,2]=2 150 B9R1.33 Cc1ncsc1CCBr Amb18062593 [0,0,0,0,0,0|1,0,0]=1 151 B9R1.33 Cc1ncsc1CCCl Amb22369901 [0,0,0,0,0,0|1,0,0]=1 152 B9R1.33 Cc1ncsc1CCCl Amb8390356 [0,0,0,0,0,0|1,0,0]=1 153 B9R1.33 Cc1ncsc1CCI Amb27870612 [0,0,0,0,0,0|1,0,0]=1 154 B9R1.33 Cc1ncsc1CCN Amb13890617 [0,0,0,0,0,0|1,0,0]=1 155 B9R1.33 Cc1ncsc1CCN Amb21959889 [0,0,0,0,0,0|1,0,0]=1 156 B9R1.33 Cc1ncsc1CCN Amb22263923 [0,0,0,0,0,0|1,0,0]=1 157 B9R1.33 Cc1ncsc1CCN Amb22587682 [0,0,0,0,0,0|1,0,0]=1 158 B9R1.33 Cc1ncsc1CCN Amb32662649 [0,0,0,0,0,0|1,0,0]=1 159 B9R1.33 Cc1ncsc1CCN Amb33529465 [0,0,0,0,0,0|1,0,0]=1 160 B9R1.33 Cc1ncsc1CCO Amb2724374 [0,0,0,0,0,0|0,0,0]=0 161 B9R1.33 Cc1ncsc1CCS Amb27753234 [0,0,0,0,0,0|0,1,0]=1 162 B9R1.33 Cc1ncsc1CNN Amb6254626 [0,0,0,0,0,0|2,0,0]=2 163 B9R1.33 Cc1ncsc1CNO Amb24422983 [0,0,0,0,0,0|1,0,0]=1 164 B9R1.33 Cc1ncsc1CON Amb32877627 [0,0,0,0,0,0|2,0,0]=2 165 B9R1.33 Cc1ncsc1N=[N+]=[N-] Amb27811480 [0,0,0,0,0,0|3,0,0]=3 166 B9R1.33 Cc1ncsc1\C=C\Br Amb33135268 [0,0,0,0,0,0|1,0,2]=3 167 B9R1.33 Cc1ncsc1\C=N\O Amb29848687 [0,0,0,0,0,0|1,0,1]=2 168 B9R1.33 Cc1nncn1CCBr Amb22032552 [0,0,0,0,0,0|4,0,0]=4 169 B9R1.33 Cc1nncn1CCBr Amb22587507 [0,0,0,0,0,0|4,0,0]=4 170 B9R1.33 Cc1nncn1CCCl Amb29845201 [0,0,0,0,0,0|4,0,0]=4 171 B9R1.33 Cc1nncn1CCN Amb18893323 [0,0,0,0,0,0|4,0,0]=4 172 B9R1.33 Cc1nncn1CCN Amb19335728 [0,0,0,0,0,0|4,0,0]=4 173 B9R1.33 Cc1nncn1CCO Amb25889458 [0,0,0,0,0,0|3,0,0]=3 174 B9R1.33 Cc1nnnn1CCF Amb27443513 [0,0,0,0,0,0|4,0,0]=4 175 B9R1.33 Cc1nnnn1CCN Amb18954248 [0,0,0,0,0,0|4,0,0]=4 176 B9R1.33 Cc1nnnn1CCN Amb19515202 [0,0,0,0,0,0|4,0,0]=4 177 B9R1.33 Cc1nnnn1CCO Amb27482345 [0,0,0,0,0,0|3,0,0]=3 178 B9R1.33 Cc1nnsc1CC=O Amb27954184 [0,0,0,0,0,0|1,0,2]=3 179 B9R1.33 Cc1nnsc1CCN Amb18831560 [0,0,0,0,0,0|2,0,0]=2 180 B9R1.33 Cc1nnsc1CNN Amb27985481 [0,0,0,0,0,0|3,0,0]=3 181 B9R1.33 Cc1nnsc1\C=C\Br Amb33135394 [0,0,0,0,0,0|2,0,2]=4 182 B9R1.33 Cc1nnsc1\C=N\N Amb28323782 [0,0,0,0,0,0|3,0,1]=4 183 B9R1.33 Cc1nocc1CC#N Amb26022920 [0,0,0,0,0,0|3,0,1]=4 184 B9R1.33 Cc1nocc1CCN Amb18832752 [0,0,0,0,0,0|3,0,0]=3 185 B9R1.33 Cc1nocc1CNN Amb35679620 [0,0,0,0,0,0|4,0,0]=4 186 B9R1.33 Cc1nonc1CC#N Amb24477850 [0,0,0,0,0,0|3,0,1]=4 187 B9R1.33 Cc1nonc1CCN Amb18832694 [0,0,0,0,0,0|3,0,0]=3 188 B9R1.33 Cc1nonc1CCO Amb27249178 [0,0,0,0,0,0|2,0,0]=2 189 B9R1.33 Cc1nsnc1CC#N Amb28053039 [0,0,0,0,0,0|3,0,1]=4 190 B9R1.33 Cc1nsnc1CCN Amb18831561 [0,0,0,0,0,0|3,0,0]=3 191 B9R1.33 Cc1occc1CC#N Amb23536069 [0,0,0,0,0,0|3,0,1]=4 192 B9R1.33 Cc1occc1CC=O Amb25147113 [0,0,0,0,0,0|2,0,2]=4 193 B9R1.33 Cc1occc1CCBr Amb26391386 [0,0,0,0,0,0|3,0,0]=3 194 B9R1.33 Cc1occc1CCN Amb18832810 [0,0,0,0,0,0|3,0,0]=3 195 B9R1.33 Cc1occc1CCO Amb25104148 [0,0,0,0,0,0|2,0,0]=2 196 B9R1.33 Cc1occc1CCS Amb33274022 [0,0,0,0,0,0|2,1,0]=3 197 B9R1.33 Cc1occc1CNN Amb6246516 [0,0,0,0,0,0|4,0,0]=4 198 B9R1.33 Cc1occc1CNO Amb26361281 [0,0,0,0,0,0|3,0,0]=3 199 B9R1.33 Cc1occc1CON Amb33275067 [0,0,0,0,0,0|4,0,0]=4 200 B9R1.33 Cc1ocnc1CCN Amb32665236 [0,0,0,0,0,0|3,0,0]=3 201 B9R1.33 Cc1oncc1CCBr Amb33450711 [0,0,0,0,0,0|4,0,0]=4 202 B9R1.33 Cc1oncc1CCN Amb18832757 [0,0,0,0,0,0|4,0,0]=4 203 B9R1.33 Cc1oncc1CCN Amb30585180 [0,0,0,0,0,0|4,0,0]=4 204 B9R1.33 Cc1oncc1CCO Amb28398571 [0,0,0,0,0,0|3,0,0]=3 205 B9R1.33 Cc1oncc1CCS Amb33361036 [0,0,0,0,0,0|3,1,0]=4 206 B9R1.33 Cc1oncc1CNO Amb33361979 [0,0,0,0,0,0|4,0,0]=4 207 B9R1.33 Cc1sccc1CCN Amb18202674 [0,0,0,0,0,0|3,0,0]=3 208 B9R1.33 Cc1sccc1CCO Amb24738484 [0,0,0,0,0,0|2,0,0]=2 209 B9R1.33 Cc1scnc1CCBr Amb27613149 [0,0,0,0,0,0|3,0,0]=3 210 B9R1.33 Cc1scnc1CCN Amb18831616 [0,0,0,0,0,0|3,0,0]=3 211 B9R1.33 Cc1scnc1CCO Amb24670192 [0,0,0,0,0,0|2,0,0]=2 212 B9R1.33 Cc1sncc1CCN Amb18202559 [0,0,0,0,0,0|4,0,0]=4 213 B9R1.33 ClCCc1occc1Br Amb27399521 [0,0,0,0,0,0|3,1,0]=4 214 B9R1.33 ClCCc1sccc1Br Amb26973740 [0,0,0,0,0,0|3,0,0]=3 215 B9R1.33 ClCCc1scnc1Br Amb26515919 [0,0,0,0,0,0|2,0,0]=2 216 B9R1.33 ClCCc1scnc1Cl Amb24445989 [0,0,0,0,0,0|2,0,0]=2 217 B9R1.33 ClCCc1scnc1I Amb26984141 [0,0,0,0,0,0|2,0,0]=2 218 B9R1.33 ClCCn1ccnc1Cl Amb26594407 [0,0,0,0,0,0|4,0,0]=4 219 B9R1.33 Clc1ccsc1CCBr Amb27493968 [0,0,0,0,0,0|3,0,0]=3 220 B9R1.33 Cn1cccc1CCBr Amb33113563 [0,0,0,0,0,0|4,0,0]=4 221 B9R1.33 Cn1cccc1CCCl Amb24419304 [0,0,0,0,0,0|4,0,0]=4 222 B9R1.33 Cn1cccc1CCN Amb7796008 [0,0,0,0,0,0|4,0,0]=4 223 B9R1.33 Cn1cccc1CCO Amb19957346 [0,0,0,0,0,0|3,0,0]=3 224 B9R1.33 Cn1cccc1CCS Amb25282882 [0,0,0,0,0,0|3,1,0]=4 225 B9R1.33 Cn1cccc1CNO Amb26515826 [0,0,0,0,0,0|4,0,0]=4 226 B9R1.33 Cn1ccnc1CCBr Amb24477839 [0,0,0,0,0,0|4,0,0]=4 227 B9R1.33 Cn1ccnc1CCBr Amb32652558 [0,0,0,0,0,0|4,0,0]=4 228 B9R1.33 Cn1ccnc1CCCl Amb19516879 [0,0,0,0,0,0|4,0,0]=4 229 B9R1.33 Cn1ccnc1CCCl Amb22587406 [0,0,0,0,0,0|4,0,0]=4 230 B9R1.33 Cn1ccnc1CCN Amb21959921 [0,0,0,0,0,0|4,0,0]=4 231 B9R1.33 Cn1ccnc1CCN Amb5638916 [0,0,0,0,0,0|4,0,0]=4 232 B9R1.33 Cn1ccnc1CCO Amb17593312 [0,0,0,0,0,0|3,0,0]=3 233 B9R1.33 Cn1ccnc1CCS Amb27804407 [0,0,0,0,0,0|3,1,0]=4 234 B9R1.33 Cn1ccnc1CNO Amb24339748 [0,0,0,0,0,0|4,0,0]=4 235 B9R1.33 Cn1cncc1CCO Amb25111555 [0,0,0,0,0,0|4,0,0]=4 236 B9R1.33 Cn1cnnc1CCO Amb28436246 [0,0,0,0,0,0|4,0,0]=4 237 B9R1.33 Cn1nccc1CC#N Amb6891263 [0,0,0,0,0,0|3,0,1]=4 238 B9R1.33 Cn1nccc1CC=O Amb26653892 [0,0,0,0,0,0|2,0,2]=4 239 B9R1.33 Cn1nccc1CCBr Amb24678295 [0,0,0,0,0,0|3,0,0]=3 240 B9R1.33 Cn1nccc1CCCl Amb24477840 [0,0,0,0,0,0|3,0,0]=3 241 B9R1.33 Cn1nccc1CCCl Amb28895928 [0,0,0,0,0,0|3,0,0]=3 242 B9R1.33 Cn1nccc1CCI Amb27466198 [0,0,0,0,0,0|3,0,0]=3 243 B9R1.33 Cn1nccc1CCN Amb18832803 [0,0,0,0,0,0|3,0,0]=3 244 B9R1.33 Cn1nccc1CCN Amb32410219 [0,0,0,0,0,0|3,0,0]=3 245 B9R1.33 Cn1nccc1CCO Amb19957348 [0,0,0,0,0,0|2,0,0]=2 246 B9R1.33 Cn1nccc1CCS Amb25675493 [0,0,0,0,0,0|2,1,0]=3 247 B9R1.33 Cn1nccc1CNN Amb27454617 [0,0,0,0,0,0|4,0,0]=4 248 B9R1.33 Cn1nccc1CNO Amb25360541 [0,0,0,0,0,0|3,0,0]=3 249 B9R1.33 Cn1ncnc1CC#N Amb26458865 [0,0,0,0,0,0|3,0,1]=4 250 B9R1.33 Cn1ncnc1CC#N Amb30585211 [0,0,0,0,0,0|3,0,1]=4 251 B9R1.33 Cn1ncnc1CC=O Amb27648490 [0,0,0,0,0,0|2,0,2]=4 252 B9R1.33 Cn1ncnc1CCN Amb10607855 [0,0,0,0,0,0|3,0,0]=3 253 B9R1.33 Cn1ncnc1CCN Amb20632195 [0,0,0,0,0,0|3,0,0]=3 254 B9R1.33 Cn1ncnc1CCN Amb22587033 [0,0,0,0,0,0|3,0,0]=3 255 B9R1.33 Cn1ncnc1CCO Amb27867219 [0,0,0,0,0,0|2,0,0]=2 256 B9R1.33 Cn1nncc1CCCl Amb27815150 [0,0,0,0,0,0|4,0,0]=4 257 B9R1.33 Cn1nncc1CCN Amb17538040 [0,0,0,0,0,0|4,0,0]=4 258 B9R1.33 Cn1nncc1CCO Amb28423645 [0,0,0,0,0,0|3,0,0]=3 259 B9R1.33 Cn1nncc1CCS Amb33144829 [0,0,0,0,0,0|3,1,0]=4 260 B9R1.33 Cn1nncc1CNO Amb26529229 [0,0,0,0,0,0|4,0,0]=4 261 B9R1.33 Cn1nnnc1CCBr Amb35617125 [0,0,0,0,0,0|4,0,0]=4 262 B9R1.33 Cn1nnnc1CCCl Amb24675290 [0,0,0,0,0,0|4,0,0]=4 263 B9R1.33 Cn1nnnc1CCN Amb17567864 [0,0,0,0,0,0|4,0,0]=4 264 B9R1.33 Cn1nnnc1CCN Amb33291323 [0,0,0,0,0,0|4,0,0]=4 265 B9R1.33 Cn1nnnc1CCO Amb30017738 [0,0,0,0,0,0|3,0,0]=3 266 B9R1.33 FCCn1ccnc1I Amb28135174 [0,0,0,0,0,0|4,0,0]=4 267 B9R1.33 FCCn1ccnc1S Amb28047573 [0,0,0,0,0,0|4,0,0]=4 268 B9R1.33 Fc1ncsc1CCCl Amb25107905 [0,0,0,0,0,0|2,0,0]=2 269 B9R1.33 N#CCc1sccc1Br Amb27478420 [0,0,0,0,0,0|3,0,1]=4 270 B9R1.33 N#CCc1sccc1Cl Amb25147110 [0,0,0,0,0,0|3,0,1]=4 271 B9R1.33 NCCc1ccsc1Br Amb18176174 [0,0,0,0,0,0|4,0,0]=4 272 B9R1.33 NCCc1ccsc1F Amb18202047 [0,0,0,0,0,0|4,0,0]=4 273 B9R1.33 NCCc1ncoc1Cl Amb28200541 [0,0,0,0,0,0|4,0,0]=4 274 B9R1.33 NCCc1nonc1O Amb27655572 [0,0,0,0,0,0|4,0,0]=4 275 B9R1.33 NCCc1occc1Br Amb18186835 [0,0,0,0,0,0|3,1,0]=4 276 B9R1.33 NCCc1occc1Cl Amb18202348 [0,0,0,0,0,0|3,1,0]=4 277 B9R1.33 NCCc1occc1F Amb27786685 [0,0,0,0,0,0|3,1,0]=4 278 B9R1.33 NCCc1sccc1Br Amb18956643 [0,0,0,0,0,0|3,0,0]=3 279 B9R1.33 NCCc1sccc1Cl Amb26482982 [0,0,0,0,0,0|3,0,0]=3 280 B9R1.33 NCCc1sccc1F Amb27491721 [0,0,0,0,0,0|3,0,0]=3 281 B9R1.33 NCCc1scnc1Br Amb18176354 [0,0,0,0,0,0|2,0,0]=2 282 B9R1.33 NCCc1sncc1Cl Amb28455776 [0,0,0,0,0,0|4,0,0]=4 283 B9R1.33 NCCn1ccnc1Cl Amb27633983 [0,0,0,0,0,0|4,0,0]=4 284 B9R1.33 NCCn1ncnc1Cl Amb27441906 [0,0,0,0,0,0|4,0,0]=4 285 B9R1.33 NNCc1sccc1Br Amb26000654 [0,0,0,0,0,0|4,0,0]=4 286 B9R1.33 NNCc1sccc1Cl Amb26439315 [0,0,0,0,0,0|4,0,0]=4 287 B9R1.33 NOCc1sccc1Br Amb24372190 [0,0,0,0,0,0|4,0,0]=4 288 B9R1.33 NOCc1sccc1Cl Amb27852923 [0,0,0,0,0,0|4,0,0]=4 289 B9R1.33 Nc1ccnn1CCO Amb8396869 [0,0,0,0,0,0|4,0,0]=4 290 B9R1.33 Nc1ccsc1\C=N\O Amb27489543 [0,0,0,0,0,0|3,0,1]=4 291 B9R1.33 Nc1nccn1CCF Amb33165781 [0,0,0,0,0,0|4,0,0]=4 292 B9R1.33 Nc1nccn1CCO Amb27186285 [0,0,0,0,0,0|3,0,0]=3 293 B9R1.33 Nc1ncsc1CCCl Amb26978533 [0,0,0,0,0,0|2,0,0]=2 294 B9R1.33 Nc1nnnn1CCO Amb656472 [0,0,0,0,0,0|4,0,0]=4 295 B9R1.33 Nc1oncc1CCO Amb27186011 [0,0,0,0,0,0|4,0,0]=4 296 B9R1.33 O=C1C=CCC1CCO Amb27260839 [0,0,0,0,0,0|3,0,1]=4 297 B9R1.33 O=C1C=CON1CCO Amb27756062 [0,0,0,0,0,0|3,1,0]=4 298 B9R1.33 O=C1C=CSN1CCO Amb23441692 [0,0,0,0,0,0|3,0,0]=3 299 B9R1.33 O=C1CC=CN1CCO Amb27186780 [0,0,0,0,0,0|4,0,0]=4 300 B9R1.33 O=C1NNC=C1CCO Amb26991507 [0,0,0,0,0,0|3,0,1]=4 301 B9R1.33 O=CCc1sccc1Br Amb24534254 [0,0,0,0,0,0|2,0,2]=4 302 B9R1.33 O=CCc1sccc1Cl Amb26509642 [0,0,0,0,0,0|2,0,2]=4 303 B9R1.33 OCCC1=C(Br)CCC1 Amb27826576 [0,0,0,0,0,0|3,0,1]=4 304 B9R1.33 OCCN1NNN=C1S Amb8390315 [0,0,0,0,0,0|4,0,0]=4 305 B9R1.33 OCCc1ccsc1Br Amb28203635 [0,0,0,0,0,0|3,0,0]=3 306 B9R1.33 OCCc1ccsc1Cl Amb28137304 [0,0,0,0,0,0|3,0,0]=3 307 B9R1.33 OCCc1cocc1I Amb28202669 [0,0,0,0,0,0|4,0,0]=4 308 B9R1.33 OCCc1cscc1Br Amb27838493 [0,0,0,0,0,0|4,0,0]=4 309 B9R1.33 OCCc1cscc1Cl Amb32951040 [0,0,0,0,0,0|4,0,0]=4 310 B9R1.33 OCCc1occc1Br Amb26397345 [0,0,0,0,0,0|2,1,0]=3 311 B9R1.33 OCCc1sccc1Br Amb28076288 [0,0,0,0,0,0|2,0,0]=2 312 B9R1.33 OCCc1sccc1Cl Amb26657502 [0,0,0,0,0,0|2,0,0]=2 313 B9R1.33 OCCc1scnc1Br Amb32945201 [0,0,0,0,0,0|1,0,0]=1 314 B9R1.33 OCCc1sncc1Br Amb33213574 [0,0,0,0,0,0|3,0,0]=3 315 B9R1.33 OCCn1ccnc1Cl Amb22741180 [0,0,0,0,0,0|3,0,0]=3 316 B9R1.33 OCCn1nccc1Cl Amb27810503 [0,0,0,0,0,0|4,0,0]=4 317 B9R1.33 OCCn1nccc1I Amb28041764 [0,0,0,0,0,0|4,0,0]=4 318 B9R1.33 OCCn1nccc1O Amb27952644 [0,0,0,0,0,0|4,0,0]=4 319 B9R1.33 OCCn1nnnc1S Amb8390289 [0,0,0,0,0,0|4,0,0]=4 320 B9R1.33 ONCc1sccc1Br Amb27205540 [0,0,0,0,0,0|3,0,0]=3 321 B9R1.33 ONCc1sccc1Cl Amb26041704 [0,0,0,0,0,0|3,0,0]=3 322 B9R1.33 O\N=C\c1sccc1Br Amb6346195 [0,0,0,0,0,0|3,0,1]=4 323 B9R1.33 Oc1ncsc1CCCl Amb25329274 [0,0,0,0,0,0|2,0,0]=2 324 B9R1.33 SCCc1sccc1Br Amb33387983 [0,0,0,0,0,0|2,1,0]=3 325 B9R1.33 SCCc1sccc1Cl Amb33258013 [0,0,0,0,0,0|2,1,0]=3 326 B9R1.33 [C-]#[N+]Cc1ccoc1C Amb33275131 [0,0,0,0,0,0|4,0,0]=4 327 B9R1.33 [C-]#[N+]Cc1occc1C Amb33343819 [0,0,0,0,0,0|3,1,0]=4 328 B9R1.33 [C-]#[N+]Cc1sccc1Br Amb33387138 [0,0,0,0,0,0|4,0,0]=4 329 B9R1.33 [C-]#[N+]Cc1sccc1C Amb33203312 [0,0,0,0,0,0|3,0,0]=3 330 B9R1.33 [C-]#[N+]Cc1sccc1Cl Amb33257617 [0,0,0,0,0,0|4,0,0]=4 331 B9R1.33 [C-]#[N+]Cc1scnc1C Amb32876038 [0,0,0,0,0,0|2,0,0]=2 332 B9R1.33 [C-]#[N+]Cn1ccnc1C Amb27959127 [0,0,0,0,0,0|4,0,0]=4 333 B8R1.8 BrCCc1ccco1 Amb22752866 [1,0,0,0,0,0|2,1,0]=4 334 B8R1.8 BrCCc1cccs1 Amb16234134 [1,0,0,0,0,0|2,0,0]=3 335 B8R1.8 BrCCc1ccns1 Amb24622827 [1,0,0,0,0,0|3,0,0]=4 336 B8R1.8 BrCCc1ccoc1 Amb19374721 [1,0,0,0,0,0|3,0,0]=4 337 B8R1.8 BrCCc1ccsc1 Amb18325324 [1,0,0,0,0,0|3,0,0]=4 338 B8R1.8 BrCCc1cnco1 Amb33335799 [1,0,0,0,0,0|1,1,0]=3 339 B8R1.8 BrCCc1cncs1 Amb27438892 [1,0,0,0,0,0|1,0,0]=2 340 B8R1.8 BrCCc1cnoc1 Amb25771054 [1,0,0,0,0,0|3,0,0]=4 341 B8R1.8 BrCCc1cnsc1 Amb29862954 [1,0,0,0,0,0|3,0,0]=4 342 B8R1.8 BrCCc1cnsn1 Amb27776340 [1,0,0,0,0,0|3,0,0]=4 343 B8R1.8 BrCCc1cscn1 Amb24357977 [1,0,0,0,0,0|3,0,0]=4 344 B8R1.8 BrCCc1cscn1 Amb33482927 [1,0,0,0,0,0|3,0,0]=4 345 B8R1.8 BrCCc1nccs1 Amb25189038 [1,0,0,0,0,0|3,0,0]=4 346 B8R1.8 BrCCn1ccnc1 Amb19889135 [1,0,0,0,0,0|3,0,0]=4 347 B8R1.8 BrCCn1ccnc1 Amb6255221 [1,0,0,0,0,0|3,0,0]=4 348 B8R1.8 BrCCn1cncn1 Amb13952642 [1,0,0,0,0,0|3,0,0]=4 349 B8R1.8 BrCCn1cncn1 Amb6255163 [1,0,0,0,0,0|3,0,0]=4 350 B8R1.8 Br\C=C\c1cncs1 Amb33135071 [1,0,0,0,0,0|1,0,2]=4 351 B8R1.8 C#CCc1cccs1 Amb26358472 [1,0,0,0,0,0|2,0,1]=4 352 B8R1.8 C#CCc1cnco1 Amb26004313 [1,0,0,0,0,0|1,1,1]=4 353 B8R1.8 C#CCc1cncs1 Amb33269140 [1,0,0,0,0,0|1,0,1]=3 354 B8R1.8 C#NCc1cccs1 Amb31132456 [1,0,0,0,0,0|3,0,0]=4 355 B8R1.8 C=CCc1cccs1 Amb27882648 [1,0,0,0,0,0|2,0,1]=4 356 B8R1.8 C=CCc1cncs1 Amb35625105 [1,0,0,0,0,0|1,0,1]=3 357 B8R1.8 C=NCc1cccs1 Amb27964411 [1,0,0,0,0,0|3,0,0]=4 358 B8R1.8 CCCc1ccco1 Amb10070288 [1,0,0,0,0,0|2,1,0]=4 359 B8R1.8 CCCc1cccs1 Amb2690417 [1,0,0,0,0,0|2,0,0]=3 360 B8R1.8 CCCc1ccsc1 Amb17689448 [1,0,0,0,0,0|3,0,0]=4 361 B8R1.8 CCCc1cnco1 Amb35647887 [1,0,0,0,0,0|1,1,0]=3 362 B8R1.8 CCCc1cncs1 Amb27954740 [1,0,0,0,0,0|1,0,0]=2 363 B8R1.8 CCCc1cscn1 Amb13884094 [1,0,0,0,0,0|3,0,0]=4 364 B8R1.8 CCCc1nccs1 Amb2725496 [1,0,0,0,0,0|3,0,0]=4 365 B8R1.8 CCCn1ccnc1 Amb8390623 [1,0,0,0,0,0|3,0,0]=4 366 B8R1.8 CCCn1cncn1 Amb8386343 [1,0,0,0,0,0|3,0,0]=4 367 B8R1.8 CCNc1cncs1 Amb25360802 [1,0,0,0,0,0|2,0,0]=3 368 B8R1.8 CCOc1cnns1 Amb2427907 [1,0,0,0,0,0|3,0,0]=4 369 B8R1.8 CCSc1cccs1 Amb17845323 [1,0,0,0,0,0|3,0,0]=4 370 B8R1.8 CCSc1cnns1 Amb22370503 [1,0,0,0,0,0|3,0,0]=4 371 B8R1.8 CCSc1nncs1 Amb24532191 [1,0,0,0,0,0|3,0,0]=4 372 B8R1.8 CNCc1cccs1 Amb1152299 [1,0,0,0,0,0|3,0,0]=4 373 B8R1.8 CNCc1cccs1 Amb6344856 [1,0,0,0,0,0|3,0,0]=4 374 B8R1.8 CNCc1cnco1 Amb8009703 [1,0,0,0,0,0|2,1,0]=4 375 B8R1.8 CNCc1cncs1 Amb33756946 [1,0,0,0,0,0|2,0,0]=3 376 B8R1.8 CNCc1cncs1 Amb8009692 [1,0,0,0,0,0|2,0,0]=3 377 B8R1.8 CNCc1cnns1 Amb27980962 [1,0,0,0,0,0|3,0,0]=4 378 B8R1.8 CNCc1nncs1 Amb27857633 [1,0,0,0,0,0|3,0,0]=4 379 B8R1.8 COCc1cccs1 Amb25169518 [1,0,0,0,0,0|3,0,0]=4 380 B8R1.8 COCc1cnco1 Amb35652247 [1,0,0,0,0,0|2,1,0]=4 381 B8R1.8 CSCc1cncs1 Amb27660777 [1,0,0,0,0,0|2,0,0]=3 382 B8R1.8 ClCCc1cccs1 Amb9004334 [1,0,0,0,0,0|2,0,0]=3 383 B8R1.8 ClCCc1ccno1 Amb27970622 [1,0,0,0,0,0|3,0,0]=4 384 B8R1.8 ClCCc1ccoc1 Amb28381646 [1,0,0,0,0,0|3,0,0]=4 385 B8R1.8 ClCCc1cncs1 Amb28246836 [1,0,0,0,0,0|1,0,0]=2 386 B8R1.8 ClCCc1cnoc1 Amb28069961 [1,0,0,0,0,0|3,0,0]=4 387 B8R1.8 ClCCc1cnsc1 Amb35729626 [1,0,0,0,0,0|3,0,0]=4 388 B8R1.8 ClCCc1cscn1 Amb10608058 [1,0,0,0,0,0|3,0,0]=4 389 B8R1.8 ClCCn1ccnc1 Amb1154377 [1,0,0,0,0,0|3,0,0]=4 390 B8R1.8 ClCCn1ccnc1 Amb2371185 [1,0,0,0,0,0|3,0,0]=4 391 B8R1.8 ClCCn1cncn1 Amb21961544 [1,0,0,0,0,0|3,0,0]=4 392 B8R1.8 ClCCn1cncn1 Amb4303965 [1,0,0,0,0,0|3,0,0]=4 393 B8R1.8 ClCSc1cccs1 Amb28347488 [1,0,0,0,0,0|3,0,0]=4 394 B8R1.8 ClSCc1cccs1 Amb27959056 [1,0,0,0,0,0|3,0,0]=4 395 B8R1.8 FCCn1ccnc1 Amb27760889 [1,0,0,0,0,0|3,0,0]=4 396 B8R1.8 FCCn1cncn1 Amb26896420 [1,0,0,0,0,0|3,0,0]=4 397 B8R1.8 ICCc1ccco1 Amb27224391 [1,0,0,0,0,0|2,1,0]=4 398 B8R1.8 ICCn1ccnc1 Amb26912728 [1,0,0,0,0,0|3,0,0]=4 399 B8R1.8 ICCn1ccnc1 Amb33620484 [1,0,0,0,0,0|3,0,0]=4 400 B8R1.8 N#CCc1cccs1 Amb2690600 [1,0,0,0,0,0|2,0,1]=4 401 B8R1.8 N#CCc1cnco1 Amb10071197 [1,0,0,0,0,0|1,1,1]=4 402 B8R1.8 N#CCc1cncs1 Amb18917901 [1,0,0,0,0,0|1,0,1]=3 403 B8R1.8 NCCC1=CC=CC1 Amb27975816 [1,0,0,0,0,0|3,0,0]=4 404 B8R1.8 NCCc1ccco1 Amb1080943 [1,0,0,0,0,0|2,1,0]=4 405 B8R1.8 NCCc1ccco1 Amb22587649 [1,0,0,0,0,0|2,1,0]=4 406 B8R1.8 NCCc1cccs1 Amb1073690 [1,0,0,0,0,0|2,0,0]=3 407 B8R1.8 NCCc1cccs1 Amb6858256 [1,0,0,0,0,0|2,0,0]=3 408 B8R1.8 NCCc1ccno1 Amb32660914 [1,0,0,0,0,0|3,0,0]=4 409 B8R1.8 NCCc1ccno1 Amb33804628 [1,0,0,0,0,0|3,0,0]=4 410 B8R1.8 NCCc1ccno1 Amb8009428 [1,0,0,0,0,0|3,0,0]=4 411 B8R1.8 NCCc1ccns1 Amb30585097 [1,0,0,0,0,0|3,0,0]=4 412 B8R1.8 NCCc1ccns1 Amb32680466 [1,0,0,0,0,0|3,0,0]=4 413 B8R1.8 NCCc1ccns1 Amb8011377 [1,0,0,0,0,0|3,0,0]=4 414 B8R1.8 NCCc1ccoc1 Amb18833105 [1,0,0,0,0,0|3,0,0]=4 415 B8R1.8 NCCc1ccoc1 Amb31146576 [1,0,0,0,0,0|3,0,0]=4 416 B8R1.8 NCCc1ccsc1 Amb2236392 [1,0,0,0,0,0|3,0,0]=4 417 B8R1.8 NCCc1ccsc1 Amb8631337 [1,0,0,0,0,0|3,0,0]=4 418 B8R1.8 NCCc1cnco1 Amb8009427 [1,0,0,0,0,0|1,1,0]=3 419 B8R1.8 NCCc1cncs1 Amb22491501 [1,0,0,0,0,0|1,0,0]=2 420 B8R1.8 NCCc1cncs1 Amb8009911 [1,0,0,0,0,0|1,0,0]=2 421 B8R1.8 NCCc1cnns1 Amb18203230 [1,0,0,0,0,0|2,0,0]=3 422 B8R1.8 NCCc1cnoc1 Amb22756366 [1,0,0,0,0,0|3,0,0]=4 423 B8R1.8 NCCc1cnoc1 Amb8009429 [1,0,0,0,0,0|3,0,0]=4 424 B8R1.8 NCCc1cnon1 Amb18833073 [1,0,0,0,0,0|3,0,0]=4 425 B8R1.8 NCCc1cnsc1 Amb18202921 [1,0,0,0,0,0|3,0,0]=4 426 B8R1.8 NCCc1cocn1 Amb8009426 [1,0,0,0,0,0|3,0,0]=4 427 B8R1.8 NCCc1cscn1 Amb17935894 [1,0,0,0,0,0|3,0,0]=4 428 B8R1.8 NCCc1cscn1 Amb32409469 [1,0,0,0,0,0|3,0,0]=4 429 B8R1.8 NCCc1cscn1 Amb5782907 [1,0,0,0,0,0|3,0,0]=4 430 B8R1.8 NCCc1nccs1 Amb10072657 [1,0,0,0,0,0|3,0,0]=4 431 B8R1.8 NCCc1nccs1 Amb15741139 [1,0,0,0,0,0|3,0,0]=4 432 B8R1.8 NCCc1nccs1 Amb5754073 [1,0,0,0,0,0|3,0,0]=4 433 B8R1.8 NCCc1ncno1 Amb20622798 [1,0,0,0,0,0|3,0,0]=4 434 B8R1.8 NCCc1ncno1 Amb8009431 [1,0,0,0,0,0|3,0,0]=4 435 B8R1.8 NCCc1ncns1 Amb18203234 [1,0,0,0,0,0|3,0,0]=4 436 B8R1.8 NCCc1nnco1 Amb17079560 [1,0,0,0,0,0|2,1,0]=4 437 B8R1.8 NCCc1nncs1 Amb23439703 [1,0,0,0,0,0|2,0,0]=3 438 B8R1.8 NCCc1nncs1 Amb24700378 [1,0,0,0,0,0|2,0,0]=3 439 B8R1.8 NCCn1ccnc1 Amb10068902 [1,0,0,0,0,0|3,0,0]=4 440 B8R1.8 NCCn1ccnc1 Amb17659443 [1,0,0,0,0,0|3,0,0]=4 441 B8R1.8 NCCn1ccnc1 Amb2236264 [1,0,0,0,0,0|3,0,0]=4 442 B8R1.8 NCCn1ccnc1 Amb2785101 [1,0,0,0,0,0|3,0,0]=4 443 B8R1.8 NCCn1cncn1 Amb1135202 [1,0,0,0,0,0|3,0,0]=4 444 B8R1.8 NCCn1cncn1 Amb19373215 [1,0,0,0,0,0|3,0,0]=4 445 B8R1.8 NCCn1cncn1 Amb28991358 [1,0,0,0,0,0|3,0,0]=4 446 B8R1.8 NCCn1cncn1 Amb32411839 [1,0,0,0,0,0|3,0,0]=4 447 B8R1.8 NCCn1cncn1 Amb7969434 [1,0,0,0,0,0|3,0,0]=4 448 B8R1.8 NNCc1cccs1 Amb22587449 [1,0,0,0,0,0|3,0,0]=4 449 B8R1.8 NNCc1cccs1 Amb29848034 [1,0,0,0,0,0|3,0,0]=4 450 B8R1.8 NNCc1cccs1 Amb6242338 [1,0,0,0,0,0|3,0,0]=4 451 B8R1.8 NNCc1cnco1 Amb33415258 [1,0,0,0,0,0|2,1,0]=4 452 B8R1.8 NNCc1cncs1 Amb19664525 [1,0,0,0,0,0|2,0,0]=3 453 B8R1.8 NOCc1cccs1 Amb25189036 [1,0,0,0,0,0|3,0,0]=4 454 B8R1.8 NOCc1cnco1 Amb33414840 [1,0,0,0,0,0|2,1,0]=4 455 B8R1.8 NOCc1cncs1 Amb24454699 [1,0,0,0,0,0|2,0,0]=3 456 B8R1.8 NOCc1cnns1 Amb28127724 [1,0,0,0,0,0|3,0,0]=4 457 B8R1.8 O=C=Nc1cncs1 Amb28352310 [1,0,0,0,0,0|1,0,2]=4 458 B8R1.8 O=CCc1cccs1 Amb17089527 [1,0,0,0,0,0|1,0,2]=4 459 B8R1.8 O=CCc1cnco1 Amb24653904 [1,0,0,0,0,0|0,1,2]=4 460 B8R1.8 O=CCc1cncs1 Amb28316235 [1,0,0,0,0,0|0,0,2]=3 461 B8R1.8 OCC=C1C=CC=C1 Amb27662404 [1,0,0,0,0,0|2,0,1]=4 462 B8R1.8 OCC[n+]1ccsc1 Amb24518966 [1,0,0,0,0,0|3,0,0]=4 463 B8R1.8 OCCc1ccco1 Amb17089516 [1,0,0,0,0,0|1,1,0]=3 464 B8R1.8 OCCc1cccs1 Amb2099445 [1,0,0,0,0,0|1,0,0]=2 465 B8R1.8 OCCc1ccno1 Amb27164449 [1,0,0,0,0,0|2,0,0]=3 466 B8R1.8 OCCc1ccns1 Amb23441022 [1,0,0,0,0,0|2,0,0]=3 467 B8R1.8 OCCc1ccoc1 Amb25802261 [1,0,0,0,0,0|2,0,0]=3 468 B8R1.8 OCCc1ccon1 Amb33198329 [1,0,0,0,0,0|3,0,0]=4 469 B8R1.8 OCCc1ccsc1 Amb3939119 [1,0,0,0,0,0|2,0,0]=3 470 B8R1.8 OCCc1ccsn1 Amb28453528 [1,0,0,0,0,0|3,0,0]=4 471 B8R1.8 OCCc1cnco1 Amb33474917 [1,0,0,0,0,0|0,1,0]=2 472 B8R1.8 OCCc1cncs1 Amb33544209 [1,0,0,0,0,0|0,0,0]=1 473 B8R1.8 OCCc1cnoc1 Amb1971497 [1,0,0,0,0,0|2,0,0]=3 474 B8R1.8 OCCc1cnsc1 Amb32945188 [1,0,0,0,0,0|2,0,0]=3 475 B8R1.8 OCCc1cocn1 Amb17399797 [1,0,0,0,0,0|2,0,0]=3 476 B8R1.8 OCCc1cscn1 Amb33548480 [1,0,0,0,0,0|2,0,0]=3 477 B8R1.8 OCCc1csnn1 Amb26641240 [1,0,0,0,0,0|3,0,0]=4 478 B8R1.8 OCCc1ncco1 Amb27495611 [1,0,0,0,0,0|2,1,0]=4 479 B8R1.8 OCCc1nccs1 Amb33547163 [1,0,0,0,0,0|2,0,0]=3 480 B8R1.8 OCCc1ncon1 Amb28125753 [1,0,0,0,0,0|3,0,0]=4 481 B8R1.8 OCCc1nnco1 Amb22500316 [1,0,0,0,0,0|1,1,0]=3 482 B8R1.8 OCCc1nncs1 Amb33213126 [1,0,0,0,0,0|1,0,0]=2 483 B8R1.8 OCCn1cccc1 Amb9174997 [1,0,0,0,0,0|3,0,0]=4 484 B8R1.8 OCCn1cccn1 Amb6382238 [1,0,0,0,0,0|3,0,0]=4 485 B8R1.8 OCCn1ccnc1 Amb2688741 [1,0,0,0,0,0|2,0,0]=3 486 B8R1.8 OCCn1ccnn1 Amb6307296 [1,0,0,0,0,0|3,0,0]=4 487 B8R1.8 OCCn1cncn1 Amb33531609 [1,0,0,0,0,0|2,0,0]=3 488 B8R1.8 OCCn1cnnc1 Amb6307238 [1,0,0,0,0,0|3,0,0]=4 489 B8R1.8 OCCn1cnnn1 Amb4042379 [1,0,0,0,0,0|3,0,0]=4 490 B8R1.8 OCNc1ncns1 Amb22497924 [1,0,0,0,0,0|3,0,0]=4 491 B8R1.8 ONCc1ccco1 Amb23449450 [1,0,0,0,0,0|2,1,0]=4 492 B8R1.8 ONCc1cccs1 Amb23449451 [1,0,0,0,0,0|2,0,0]=3 493 B8R1.8 ONCc1ccns1 Amb35649961 [1,0,0,0,0,0|3,0,0]=4 494 B8R1.8 ONCc1ccoc1 Amb28059138 [1,0,0,0,0,0|3,0,0]=4 495 B8R1.8 ONCc1ccsc1 Amb25994264 [1,0,0,0,0,0|3,0,0]=4 496 B8R1.8 ONCc1cnco1 Amb27247434 [1,0,0,0,0,0|1,1,0]=3 497 B8R1.8 ONCc1cncs1 Amb26991202 [1,0,0,0,0,0|1,0,0]=2 498 B8R1.8 ONCc1cscn1 Amb27162852 [1,0,0,0,0,0|3,0,0]=4 499 B8R1.8 ONCc1nccs1 Amb26025896 [1,0,0,0,0,0|3,0,0]=4 500 B8R1.8 O\N=C/c1cccs1 Amb27801792 [1,0,0,0,0,0|2,0,1]=4 501 B8R1.8 O\N=C\c1cccs1 Amb6384738 [1,0,0,0,0,0|2,0,1]=4 502 B8R1.8 O\N=C\c1cnns1 Amb24631860 [1,0,0,0,0,0|2,0,1]=4 503 B8R1.8 SCCc1ccco1 Amb24511324 [1,0,0,0,0,0|1,2,0]=4 504 B8R1.8 SCCc1cccs1 Amb17399886 [1,0,0,0,0,0|1,1,0]=3 505 B8R1.8 SCCc1ccoc1 Amb33360331 [1,0,0,0,0,0|2,1,0]=4 506 B8R1.8 SCCc1ccsc1 Amb25300451 [1,0,0,0,0,0|2,1,0]=4 507 B8R1.8 SCCc1cnco1 Amb33319556 [1,0,0,0,0,0|0,2,0]=3 508 B8R1.8 SCCc1cncs1 Amb33268035 [1,0,0,0,0,0|0,1,0]=2 509 B8R1.8 SCCc1cscn1 Amb25356281 [1,0,0,0,0,0|2,1,0]=4 510 B8R1.8 SCCc1nccs1 Amb20621112 [1,0,0,0,0,0|2,1,0]=4 511 B8R1.8 SCCn1cncn1 Amb24724270 [1,0,0,0,0,0|2,1,0]=4 512 B8R1.8 [C-]#[N+]Cc1cccs1 Amb3973219 [1,0,0,0,0,0|3,0,0]=4 513 B8R1.8 [C-]#[N+]Cc1cnco1 Amb33414856 [1,0,0,0,0,0|2,1,0]=4 514 B8R1.8 [C-]#[N+]Cc1cncs1 Amb33270088 [1,0,0,0,0,0|2,0,0]=3 515 B8R1.11 BrCc1sccc1Br Amb25793641 [1,0,0,0,0,0|3,0,0]=4 516 B8R1.11 BrCc1scnc1Br Amb28316124 [1,0,0,0,0,0|2,0,0]=3 517 B8R1.11 Brc1ccsc1CI Amb28064272 [1,0,0,0,0,0|3,0,0]=4 518 B8R1.11 C#Cc1ocnc1C Amb33169117 [1,0,0,0,0,0|0,1,2]=4 519 B8R1.11 C#Cc1sccc1C Amb22489883 [1,0,0,0,0,0|1,0,2]=4 520 B8R1.11 C#Cc1scnc1C Amb22751297 [1,0,0,0,0,0|0,0,2]=3 521 B8R1.11 C=C1N=CS\C1=C\Br Amb27185914 [1,0,0,0,0,0|1,0,2]=4 522 B8R1.11 C=Cc1sccc1C Amb24532317 [1,0,0,0,0,0|1,0,2]=4 523 B8R1.11 C=Cc1scnc1C Amb3941635 [1,0,0,0,0,0|0,0,2]=3 524 B8R1.11 CC1=C(CO)CCO1 Amb8392376 [1,0,0,0,0,0|2,0,1]=4 525 B8R1.11 CCC1=C(C)CCC1 Amb22227944 [1,0,0,0,0,0|2,0,1]=4 526 B8R1.11 CCC1=CC=CC1C Amb28247297 [1,0,0,0,0,0|2,0,1]=4 527 B8R1.11 CCN1CCN=C1C Amb27228803 [1,0,0,0,0,0|2,0,1]=4 528 B8R1.11 CCc1ccnn1C Amb6891586 [1,0,0,0,0,0|2,0,0]=3 529 B8R1.11 CCc1ccoc1Br Amb13884533 [1,0,0,0,0,0|3,0,0]=4 530 B8R1.11 CCc1ccsc1Br Amb13884511 [1,0,0,0,0,0|3,0,0]=4 531 B8R1.11 CCc1ccsc1C Amb25313892 [1,0,0,0,0,0|2,0,0]=3 532 B8R1.11 CCc1ccsc1Cl Amb27185548 [1,0,0,0,0,0|3,0,0]=4 533 B8R1.11 CCc1ccsc1I Amb26079787 [1,0,0,0,0,0|3,0,0]=4 534 B8R1.11 CCc1ccsc1N Amb28049025 [1,0,0,0,0,0|3,0,0]=4 535 B8R1.11 CCc1ccsc1O Amb26547659 [1,0,0,0,0,0|3,0,0]=4 536 B8R1.11 CCc1ccsc1S Amb32728959 [1,0,0,0,0,0|3,0,0]=4 537 B8R1.11 CCc1conc1N Amb28424081 [1,0,0,0,0,0|3,0,0]=4 538 B8R1.11 CCc1ncsc1Br Amb20617306 [1,0,0,0,0,0|3,0,0]=4 539 B8R1.11 CCc1ncsc1C Amb24117157 [1,0,0,0,0,0|2,0,0]=3 540 B8R1.11 CCc1ncsc1N Amb18946568 [1,0,0,0,0,0|3,0,0]=4 541 B8R1.11 CCc1nnnn1C Amb22170065 [1,0,0,0,0,0|3,0,0]=4 542 B8R1.11 CCc1nonc1N Amb2513730 [1,0,0,0,0,0|3,0,0]=4 543 B8R1.11 CCc1nsnc1Cl Amb35707005 [1,0,0,0,0,0|3,0,0]=4 544 B8R1.11 CCc1nsnc1N Amb29864614 [1,0,0,0,0,0|3,0,0]=4 545 B8R1.11 CCc1occc1O Amb27444323 [1,0,0,0,0,0|2,1,0]=4 546 B8R1.11 CCc1ocnc1C Amb28186783 [1,0,0,0,0,0|0,1,0]=2 547 B8R1.11 CCc1sccc1F Amb27631779 [1,0,0,0,0,0|2,0,0]=3 548 B8R1.11 CCc1sccc1S Amb27193410 [1,0,0,0,0,0|2,0,0]=3 549 B8R1.11 CCc1scnc1Br Amb20617256 [1,0,0,0,0,0|1,0,0]=2 550 B8R1.11 CCc1scnc1C Amb19515914 [1,0,0,0,0,0|0,0,0]=1 551 B8R1.11 CCc1scnc1N Amb24317504 [1,0,0,0,0,0|1,0,0]=2 552 B8R1.11 CCc1sncc1N Amb27631722 [1,0,0,0,0,0|3,0,0]=4 553 B8R1.11 CCn1ccnc1Br Amb15701653 [1,0,0,0,0,0|3,0,0]=4 554 B8R1.11 CCn1ccnc1Br Amb22587411 [1,0,0,0,0,0|3,0,0]=4 555 B8R1.11 CCn1ccnc1C Amb27964894 [1,0,0,0,0,0|2,0,0]=3 556 B8R1.11 CCn1ccnc1Cl Amb10067353 [1,0,0,0,0,0|3,0,0]=4 557 B8R1.11 CCn1ccnc1F Amb35642427 [1,0,0,0,0,0|3,0,0]=4 558 B8R1.11 CCn1ccnc1I Amb26368117 [1,0,0,0,0,0|3,0,0]=4 559 B8R1.11 CCn1ccnc1N Amb18278257 [1,0,0,0,0,0|3,0,0]=4 560 B8R1.11 CCn1ccnc1S Amb2371689 [1,0,0,0,0,0|3,0,0]=4 561 B8R1.11 CCn1cnnc1C Amb13952400 [1,0,0,0,0,0|3,0,0]=4 562 B8R1.11 CCn1nccc1C Amb6888496 [1,0,0,0,0,0|3,0,0]=4 563 B8R1.11 CCn1ncnc1Br Amb19516906 [1,0,0,0,0,0|3,0,0]=4 564 B8R1.11 CCn1ncnc1Cl Amb26426308 [1,0,0,0,0,0|3,0,0]=4 565 B8R1.11 CCn1ncnc1I Amb32685614 [1,0,0,0,0,0|3,0,0]=4 566 B8R1.11 CCn1ncnc1N Amb10607465 [1,0,0,0,0,0|3,0,0]=4 567 B8R1.11 CCn1ncnc1N Amb22586795 [1,0,0,0,0,0|3,0,0]=4 568 B8R1.11 CCn1ncnc1O Amb27235127 [1,0,0,0,0,0|3,0,0]=4 569 B8R1.11 CCn1nnnc1C Amb28142535 [1,0,0,0,0,0|3,0,0]=4 570 B8R1.11 CNc1ccnn1C Amb18278923 [1,0,0,0,0,0|3,0,0]=4 571 B8R1.11 CNc1ccnn1C Amb19318085 [1,0,0,0,0,0|3,0,0]=4 572 B8R1.11 CNc1csnc1C Amb33456081 [1,0,0,0,0,0|3,0,0]=4 573 B8R1.11 CNc1ncnn1C Amb27217274 [1,0,0,0,0,0|3,0,0]=4 574 B8R1.11 CNc1nonc1C Amb25760477 [1,0,0,0,0,0|3,0,0]=4 575 B8R1.11 CNc1scnc1Br Amb18190436 [1,0,0,0,0,0|2,0,0]=3 576 B8R1.11 CNc1snnc1C Amb24058713 [1,0,0,0,0,0|2,0,0]=3 577 B8R1.11 COc1ccnn1C Amb22275956 [1,0,0,0,0,0|3,0,0]=4 578 B8R1.11 COc1ccoc1C Amb27462648 [1,0,0,0,0,0|3,0,0]=4 579 B8R1.11 COc1ccsc1C Amb25226814 [1,0,0,0,0,0|3,0,0]=4 580 B8R1.11 COc1occc1C Amb27625304 [1,0,0,0,0,0|2,1,0]=4 581 B8R1.11 COc1sccc1Br Amb24082781 [1,0,0,0,0,0|3,0,0]=4 582 B8R1.11 COc1sccc1C Amb25064766 [1,0,0,0,0,0|2,0,0]=3 583 B8R1.11 COc1sccc1N Amb19895576 [1,0,0,0,0,0|3,0,0]=4 584 B8R1.11 COc1scnc1Br Amb24317561 [1,0,0,0,0,0|2,0,0]=3 585 B8R1.11 CSc1ccoc1C Amb8393178 [1,0,0,0,0,0|3,0,0]=4 586 B8R1.11 CSc1ccsc1C Amb24639247 [1,0,0,0,0,0|3,0,0]=4 587 B8R1.11 CSc1sccc1Br Amb26864440 [1,0,0,0,0,0|3,0,0]=4 588 B8R1.11 Cc1ccoc1CBr Amb18183895 [1,0,0,0,0,0|2,1,0]=4 589 B8R1.11 Cc1ccoc1CCl Amb8860567 [1,0,0,0,0,0|2,1,0]=4 590 B8R1.11 Cc1ccoc1CN Amb6572131 [1,0,0,0,0,0|2,1,0]=4 591 B8R1.11 Cc1ccoc1CO Amb6572130 [1,0,0,0,0,0|1,1,0]=3 592 B8R1.11 Cc1ccoc1CS Amb25969059 [1,0,0,0,0,0|1,2,0]=4 593 B8R1.11 Cc1ccsc1C#N Amb33528580 [1,0,0,0,0,0|2,0,1]=4 594 B8R1.11 Cc1ccsc1C=O Amb534988 [1,0,0,0,0,0|1,0,2]=4 595 B8R1.11 Cc1ccsc1CBr Amb18325320 [1,0,0,0,0,0|2,0,0]=3 596 B8R1.11 Cc1ccsc1CCl Amb33528081 [1,0,0,0,0,0|2,0,0]=3 597 B8R1.11 Cc1ccsc1CN Amb1128389 [1,0,0,0,0,0|2,0,0]=3 598 B8R1.11 Cc1ccsc1CN Amb6892658 [1,0,0,0,0,0|2,0,0]=3 599 B8R1.11 Cc1ccsc1CO Amb837436 [1,0,0,0,0,0|1,0,0]=2 600 B8R1.11 Cc1ccsc1CS Amb24526885 [1,0,0,0,0,0|1,1,0]=3 601 B8R1.11 Cc1ccsc1[Zn]Br Amb22000458 [1,0,0,0,0,0|3,0,0]=4 602 B8R1.11 Cc1cnoc1CO Amb24467683 [1,0,0,0,0,0|2,1,0]=4 603 B8R1.11 Cc1conc1CO Amb24593199 [1,0,0,0,0,0|3,0,0]=4 604 B8R1.11 Cc1cscc1CO Amb24483178 [1,0,0,0,0,0|3,0,0]=4 605 B8R1.11 Cc1nccn1CN Amb28196152 [1,0,0,0,0,0|3,0,0]=4 606 B8R1.11 Cc1ncoc1C#N Amb17843583 [1,0,0,0,0,0|1,1,1]=4 607 B8R1.11 Cc1ncoc1C=O Amb8010969 [1,0,0,0,0,0|0,1,2]=4 608 B8R1.11 Cc1ncoc1CBr Amb22268316 [1,0,0,0,0,0|1,1,0]=3 609 B8R1.11 Cc1ncoc1CCl Amb17399824 [1,0,0,0,0,0|1,1,0]=3 610 B8R1.11 Cc1ncoc1CN Amb17399791 [1,0,0,0,0,0|1,1,0]=3 611 B8R1.11 Cc1ncoc1CN Amb30585114 [1,0,0,0,0,0|1,1,0]=3 612 B8R1.11 Cc1ncoc1CO Amb5282883 [1,0,0,0,0,0|0,1,0]=2 613 B8R1.11 Cc1ncoc1CS Amb22268324 [1,0,0,0,0,0|0,2,0]=3 614 B8R1.11 Cc1ncsc1C#N Amb20669505 [1,0,0,0,0,0|1,0,1]=3 615 B8R1.11 Cc1ncsc1C=O Amb3319371 [1,0,0,0,0,0|0,0,2]=3 616 B8R1.11 Cc1ncsc1CBr Amb19073775 [1,0,0,0,0,0|1,0,0]=2 617 B8R1.11 Cc1ncsc1CBr Amb22587583 [1,0,0,0,0,0|1,0,0]=2 618 B8R1.11 Cc1ncsc1CCl Amb22586997 [1,0,0,0,0,0|1,0,0]=2 619 B8R1.11 Cc1ncsc1CCl Amb9004346 [1,0,0,0,0,0|1,0,0]=2 620 B8R1.11 Cc1ncsc1CN Amb6255641 [1,0,0,0,0,0|1,0,0]=2 621 B8R1.11 Cc1ncsc1CO Amb8392849 [1,0,0,0,0,0|0,0,0]=1 622 B8R1.11 Cc1ncsc1CS Amb18837003 [1,0,0,0,0,0|0,1,0]=2 623 B8R1.11 Cc1nnsc1C#N Amb4477076 [1,0,0,0,0,0|2,0,1]=4 624 B8R1.11 Cc1nnsc1C=O Amb5282858 [1,0,0,0,0,0|1,0,2]=4 625 B8R1.11 Cc1nnsc1CBr Amb26429197 [1,0,0,0,0,0|2,0,0]=3 626 B8R1.11 Cc1nnsc1CCl Amb7968811 [1,0,0,0,0,0|2,0,0]=3 627 B8R1.11 Cc1nnsc1CN Amb6891600 [1,0,0,0,0,0|2,0,0]=3 628 B8R1.11 Cc1nnsc1CO Amb6297733 [1,0,0,0,0,0|1,0,0]=2 629 B8R1.11 Cc1nnsc1CS Amb32788540 [1,0,0,0,0,0|1,1,0]=3 630 B8R1.11 Cc1nocc1CBr Amb29850911 [1,0,0,0,0,0|3,0,0]=4 631 B8R1.11 Cc1nocc1CCl Amb25915120 [1,0,0,0,0,0|3,0,0]=4 632 B8R1.11 Cc1nocc1CN Amb22886405 [1,0,0,0,0,0|3,0,0]=4 633 B8R1.11 Cc1nocc1CN Amb8011534 [1,0,0,0,0,0|3,0,0]=4 634 B8R1.11 Cc1nocc1CO Amb24062155 [1,0,0,0,0,0|2,0,0]=3 635 B8R1.11 Cc1nonc1CBr Amb19373785 [1,0,0,0,0,0|3,0,0]=4 636 B8R1.11 Cc1nonc1CCl Amb33527302 [1,0,0,0,0,0|3,0,0]=4 637 B8R1.11 Cc1nonc1CI Amb21811581 [1,0,0,0,0,0|3,0,0]=4 638 B8R1.11 Cc1nonc1CN Amb19272297 [1,0,0,0,0,0|3,0,0]=4 639 B8R1.11 Cc1nonc1CN Amb33527335 [1,0,0,0,0,0|3,0,0]=4 640 B8R1.11 Cc1nonc1CO Amb534150 [1,0,0,0,0,0|2,0,0]=3 641 B8R1.11 Cc1nonc1CS Amb3319153 [1,0,0,0,0,0|2,1,0]=4 642 B8R1.11 Cc1nscc1CN Amb8010486 [1,0,0,0,0,0|3,0,0]=4 643 B8R1.11 Cc1nscc1CO Amb23441231 [1,0,0,0,0,0|2,0,0]=3 644 B8R1.11 Cc1nsnc1CN Amb23592213 [1,0,0,0,0,0|3,0,0]=4 645 B8R1.11 Cc1nsnc1CN Amb29218361 [1,0,0,0,0,0|3,0,0]=4 646 B8R1.11 Cc1occc1CBr Amb18183894 [1,0,0,0,0,0|3,0,0]=4 647 B8R1.11 Cc1occc1CN Amb2724036 [1,0,0,0,0,0|3,0,0]=4 648 B8R1.11 Cc1occc1CN Amb33545796 [1,0,0,0,0,0|3,0,0]=4 649 B8R1.11 Cc1occc1CO Amb33545810 [1,0,0,0,0,0|2,0,0]=3 650 B8R1.11 Cc1occc1CS Amb24538700 [1,0,0,0,0,0|2,1,0]=4 651 B8R1.11 Cc1ocnc1CBr Amb28398019 [1,0,0,0,0,0|3,0,0]=4 652 B8R1.11 Cc1ocnc1CCl Amb22157185 [1,0,0,0,0,0|3,0,0]=4 653 B8R1.11 Cc1ocnc1CN Amb18833092 [1,0,0,0,0,0|3,0,0]=4 654 B8R1.11 Cc1ocnc1CO Amb15701316 [1,0,0,0,0,0|2,0,0]=3 655 B8R1.11 Cc1oncc1CO Amb22754687 [1,0,0,0,0,0|3,0,0]=4 656 B8R1.11 Cc1onnc1CO Amb27209793 [1,0,0,0,0,0|3,0,0]=4 657 B8R1.11 Cc1sccc1CN Amb18203029 [1,0,0,0,0,0|3,0,0]=4 658 B8R1.11 Cc1sccc1CN Amb31156120 [1,0,0,0,0,0|3,0,0]=4 659 B8R1.11 Cc1sccc1CO Amb28048918 [1,0,0,0,0,0|2,0,0]=3 660 B8R1.11 Cc1sccc1CS Amb32788874 [1,0,0,0,0,0|2,1,0]=4 661 B8R1.11 Cc1scnc1CBr Amb22500463 [1,0,0,0,0,0|3,0,0]=4 662 B8R1.11 Cc1scnc1CCl Amb19516837 [1,0,0,0,0,0|3,0,0]=4 663 B8R1.11 Cc1scnc1CCl Amb21961684 [1,0,0,0,0,0|3,0,0]=4 664 B8R1.11 Cc1scnc1CN Amb18202948 [1,0,0,0,0,0|3,0,0]=4 665 B8R1.11 Cc1scnc1CO Amb22587438 [1,0,0,0,0,0|2,0,0]=3 666 B8R1.11 Cc1scnc1CO Amb8388250 [1,0,0,0,0,0|2,0,0]=3 667 B8R1.11 Cc1snnc1CO Amb22886784 [1,0,0,0,0,0|3,0,0]=4 668 B8R1.11 ClCc1sccc1Br Amb10610432 [1,0,0,0,0,0|3,0,0]=4 669 B8R1.11 ClCc1sccc1Cl Amb24620455 [1,0,0,0,0,0|3,0,0]=4 670 B8R1.11 ClCc1scnc1Br Amb24532816 [1,0,0,0,0,0|2,0,0]=3 671 B8R1.11 ClCc1scnc1Cl Amb27982887 [1,0,0,0,0,0|2,0,0]=3 672 B8R1.11 ClCc1snnc1Cl Amb19375576 [1,0,0,0,0,0|3,0,0]=4 673 B8R1.11 Clc1ccsc1CBr Amb27848769 [1,0,0,0,0,0|3,0,0]=4 674 B8R1.11 Clc1ncsc1CBr Amb24449980 [1,0,0,0,0,0|2,0,0]=3 675 B8R1.11 Clc1ncsc1CBr Amb32675146 [1,0,0,0,0,0|2,0,0]=3 676 B8R1.11 Cn1cccc1CO Amb837316 [1,0,0,0,0,0|3,0,0]=4 677 B8R1.11 Cn1ccnc1CO Amb1679789 [1,0,0,0,0,0|3,0,0]=4 678 B8R1.11 Cn1ccnc1CO Amb20668539 [1,0,0,0,0,0|3,0,0]=4 679 B8R1.11 Cn1nccc1CBr Amb18790494 [1,0,0,0,0,0|3,0,0]=4 680 B8R1.11 Cn1nccc1CBr Amb24269193 [1,0,0,0,0,0|3,0,0]=4 681 B8R1.11 Cn1nccc1CCl Amb33547571 [1,0,0,0,0,0|3,0,0]=4 682 B8R1.11 Cn1nccc1CCl Amb6890380 [1,0,0,0,0,0|3,0,0]=4 683 B8R1.11 Cn1nccc1CN Amb1945791 [1,0,0,0,0,0|3,0,0]=4 684 B8R1.11 Cn1nccc1CN Amb21953680 [1,0,0,0,0,0|3,0,0]=4 685 B8R1.11 Cn1nccc1CN Amb2693488 [1,0,0,0,0,0|3,0,0]=4 686 B8R1.11 Cn1nccc1CO Amb6572285 [1,0,0,0,0,0|2,0,0]=3 687 B8R1.11 Cn1nccc1CS Amb27197783 [1,0,0,0,0,0|2,1,0]=4 688 B8R1.11 Cn1ncnc1CBr Amb25788408 [1,0,0,0,0,0|3,0,0]=4 689 B8R1.11 Cn1ncnc1CCl Amb19148189 [1,0,0,0,0,0|3,0,0]=4 690 B8R1.11 Cn1ncnc1CCl Amb22011466 [1,0,0,0,0,0|3,0,0]=4 691 B8R1.11 Cn1ncnc1CN Amb30982614 [1,0,0,0,0,0|3,0,0]=4 692 B8R1.11 Cn1ncnc1CN Amb32708537 [1,0,0,0,0,0|3,0,0]=4 693 B8R1.11 Cn1ncnc1CN Amb8010898 [1,0,0,0,0,0|3,0,0]=4 694 B8R1.11 Cn1ncnc1CO Amb10603121 [1,0,0,0,0,0|2,0,0]=3 695 B8R1.11 Cn1ncnc1CO Amb30585096 [1,0,0,0,0,0|2,0,0]=3 696 B8R1.11 Cn1ncnc1CO Amb32653381 [1,0,0,0,0,0|2,0,0]=3 697 B8R1.11 Cn1ncnc1CS Amb26907983 [1,0,0,0,0,0|2,1,0]=4 698 B8R1.11 Cn1nncc1CO Amb17538038 [1,0,0,0,0,0|3,0,0]=4 699 B8R1.11 Cn1nnnc1CO Amb23450395 [1,0,0,0,0,0|3,0,0]=4 700 B8R1.11 Fc1ccsc1CBr Amb28244697 [1,0,0,0,0,0|3,0,0]=4 701 B8R1.11 N#Cc1scnc1Br Amb18820655 [1,0,0,0,0,0|2,0,1]=4 702 B8R1.11 N#Cc1scnc1Cl Amb23590954 [1,0,0,0,0,0|2,0,1]=4 703 B8R1.11 N#Cc1scnc1F Amb27482759 [1,0,0,0,0,0|2,0,1]=4 704 B8R1.11 N#Cc1scnc1O Amb32716344 [1,0,0,0,0,0|2,0,1]=4 705 B8R1.11 NCc1sccc1Br Amb13951625 [1,0,0,0,0,0|3,0,0]=4 706 B8R1.11 NCc1sccc1Br Amb18280696 [1,0,0,0,0,0|3,0,0]=4 707 B8R1.11 NCc1sccc1Cl Amb10069119 [1,0,0,0,0,0|3,0,0]=4 708 B8R1.11 NCc1sccc1Cl Amb22406102 [1,0,0,0,0,0|3,0,0]=4 709 B8R1.11 NCc1sccc1I Amb27236255 [1,0,0,0,0,0|3,0,0]=4 710 B8R1.11 NCc1scnc1Br Amb18190431 [1,0,0,0,0,0|2,0,0]=3 711 B8R1.11 Nc1ccsc1CO Amb10067607 [1,0,0,0,0,0|2,0,0]=3 712 B8R1.11 Nc1ccsc1CS Amb32788295 [1,0,0,0,0,0|2,1,0]=4 713 B8R1.11 Nc1nonc1CO Amb22527953 [1,0,0,0,0,0|3,0,0]=4 714 B8R1.11 Nc1sccc1CO Amb27781063 [1,0,0,0,0,0|3,0,0]=4 715 B8R1.11 O=C1C=CS\C1=C\O Amb27401611 [1,0,0,0,0,0|2,0,1]=4 716 B8R1.11 O=Cc1scnc1Br Amb22304735 [1,0,0,0,0,0|1,0,2]=4 717 B8R1.11 O=Cc1scnc1Cl Amb6479172 [1,0,0,0,0,0|1,0,2]=4 718 B8R1.11 OCc1ccoc1Br Amb26598755 [1,0,0,0,0,0|3,0,0]=4 719 B8R1.11 OCc1ccoc1Cl Amb26370317 [1,0,0,0,0,0|3,0,0]=4 720 B8R1.11 OCc1ccsc1Br Amb2724058 [1,0,0,0,0,0|3,0,0]=4 721 B8R1.11 OCc1ccsc1Cl Amb27205726 [1,0,0,0,0,0|3,0,0]=4 722 B8R1.11 OCc1conc1Cl Amb27970936 [1,0,0,0,0,0|3,0,0]=4 723 B8R1.11 OCc1ncsc1Br Amb22748664 [1,0,0,0,0,0|3,0,0]=4 724 B8R1.11 OCc1ncsc1Cl Amb23400577 [1,0,0,0,0,0|3,0,0]=4 725 B8R1.11 OCc1ncsc1I Amb28316144 [1,0,0,0,0,0|3,0,0]=4 726 B8R1.11 OCc1occc1Br Amb22498871 [1,0,0,0,0,0|2,1,0]=4 727 B8R1.11 OCc1sccc1Br Amb18330307 [1,0,0,0,0,0|2,0,0]=3 728 B8R1.11 OCc1sccc1Cl Amb21961457 [1,0,0,0,0,0|2,0,0]=3 729 B8R1.11 OCc1sccc1F Amb22490780 [1,0,0,0,0,0|2,0,0]=3 730 B8R1.11 OCc1sccc1I Amb25366864 [1,0,0,0,0,0|2,0,0]=3 731 B8R1.11 OCc1scnc1Br Amb10603160 [1,0,0,0,0,0|1,0,0]=2 732 B8R1.11 OCc1scnc1Cl Amb22276071 [1,0,0,0,0,0|1,0,0]=2 733 B8R1.11 OCc1sncc1Br Amb32664952 [1,0,0,0,0,0|3,0,0]=4 734 B8R1.11 SCc1sccc1Br Amb32788468 [1,0,0,0,0,0|2,1,0]=4 735 B8R1.11 SCc1sccc1Cl Amb32788228 [1,0,0,0,0,0|2,1,0]=4 736 B8R1.11 SCc1scnc1Cl Amb32788057 [1,0,0,0,0,0|1,1,0]=3 737 B8R1.11 [C-]#[N+]c1scnc1C Amb32876039 [1,0,0,0,0,0|1,0,1]=3 738 B10R1.5 C#CCc1sccc1CC Amb32729151 [0,1,0,0,0,0|2,0,1]=4 739 B10R1.5 CCC1=NCCN1CCO Amb27839322 [0,1,0,0,0,0|2,0,1]=4 740 B10R1.5 CCCc1ccoc1CN Amb33188885 [0,1,0,0,0,0|3,0,0]=4 741 B10R1.5 CCCc1ccsc1CN Amb35609338 [0,1,0,0,0,0|3,0,0]=4 742 B10R1.5 CCCc1ccsc1CO Amb27982892 [0,1,0,0,0,0|3,0,0]=4 743 B10R1.5 CCCc1ncoc1CCl Amb27246910 [0,1,0,0,0,0|3,0,0]=4 744 B10R1.5 CCCc1ncsc1CN Amb18841114 [0,1,0,0,0,0|3,0,0]=4 745 B10R1.5 CCCc1ocnc1C=O Amb27200703 [0,1,0,0,0,0|1,1,1]=4 746 B10R1.5 CCCc1ocnc1CBr Amb28128347 [0,1,0,0,0,0|1,1,0]=3 747 B10R1.5 CCCc1sccc1C=O Amb26979790 [0,1,0,0,0,0|2,0,1]=4 748 B10R1.5 CCCn1ccnc1CBr Amb27184915 [0,1,0,0,0,0|3,0,0]=4 749 B10R1.5 CCCn1ccnc1CCl Amb18800073 [0,1,0,0,0,0|3,0,0]=4 750 B10R1.5 CCCn1ccnc1CI Amb32685582 [0,1,0,0,0,0|3,0,0]=4 751 B10R1.5 CCCn1ccnc1CN Amb2693618 [0,1,0,0,0,0|3,0,0]=4 752 B10R1.5 CCCn1ccnc1CO Amb9765583 [0,1,0,0,0,0|3,0,0]=4 753 B10R1.5 CCCn1ccnc1CS Amb24608563 [0,1,0,0,0,0|3,0,0]=4 754 B10R1.5 CCCn1ccnc1SC Amb27652376 [0,1,0,0,0,0|3,0,0]=4 755 B10R1.5 CCCn1ncnc1CCl Amb24480559 [0,1,0,0,0,0|3,0,0]=4 756 B10R1.5 CCCn1ncnc1CCl Amb33313506 [0,1,0,0,0,0|3,0,0]=4 757 B10R1.5 CCCn1ncnc1CN Amb27810656 [0,1,0,0,0,0|3,0,0]=4 758 B10R1.5 CCCn1ncnc1CN Amb35788243 [0,1,0,0,0,0|3,0,0]=4 759 B10R1.5 CCCn1ncnc1CO Amb24075548 [0,1,0,0,0,0|3,0,0]=4 760 B10R1.5 CCSc1sccc1CC Amb27959049 [0,1,0,0,0,0|3,0,0]=4 761 B10R1.5 CCc1ccsc1CC#N Amb28401569 [0,1,0,0,0,0|2,0,1]=4 762 B10R1.5 CCc1ccsc1CC=O Amb32729145 [0,1,0,0,0,0|1,0,2]=4 763 B10R1.5 CCc1ccsc1CCBr Amb33009157 [0,1,0,0,0,0|2,0,0]=3 764 B10R1.5 CCc1ccsc1CCN Amb18830847 [0,1,0,0,0,0|2,0,0]=3 765 B10R1.5 CCc1ccsc1CCO Amb33224753 [0,1,0,0,0,0|1,0,0]=2 766 B10R1.5 CCc1ccsc1CCS Amb32728961 [0,1,0,0,0,0|1,1,0]=3 767 B10R1.5 CCc1ccsc1CNC Amb18977663 [0,1,0,0,0,0|3,0,0]=4 768 B10R1.5 CCc1ccsc1CNN Amb28049572 [0,1,0,0,0,0|3,0,0]=4 769 B10R1.5 CCc1ccsc1CNO Amb32728271 [0,1,0,0,0,0|2,0,0]=3 770 B10R1.5 CCc1ccsc1CON Amb32729176 [0,1,0,0,0,0|3,0,0]=4 771 B10R1.5 CCc1nccn1CCCl Amb8428012 [0,1,0,0,0,0|3,0,0]=4 772 B10R1.5 CCc1nccn1CCCl Amb9173336 [0,1,0,0,0,0|3,0,0]=4 773 B10R1.5 CCc1nccn1CCN Amb10549336 [0,1,0,0,0,0|3,0,0]=4 774 B10R1.5 CCc1nccn1CCN Amb15701258 [0,1,0,0,0,0|3,0,0]=4 775 B10R1.5 CCc1nccn1CCN Amb33098618 [0,1,0,0,0,0|3,0,0]=4 776 B10R1.5 CCc1nccn1CCO Amb8428066 [0,1,0,0,0,0|2,0,0]=3 777 B10R1.5 CCc1nonc1CCN Amb18831741 [0,1,0,0,0,0|3,0,0]=4 778 B10R1.5 CCn1ccnc1CCO Amb25273850 [0,1,0,0,0,0|3,0,0]=4 779 B10R1.5 CCn1nccc1CCBr Amb25146398 [0,1,0,0,0,0|3,0,0]=4 780 B10R1.5 CCn1nccc1CCCl Amb28896020 [0,1,0,0,0,0|3,0,0]=4 781 B10R1.5 CCn1nccc1CCN Amb19651439 [0,1,0,0,0,0|3,0,0]=4 782 B10R1.5 CCn1nccc1CCO Amb23571673 [0,1,0,0,0,0|2,0,0]=3 783 B10R1.5 CCn1nccc1CCS Amb33322838 [0,1,0,0,0,0|2,1,0]=4 784 B10R1.5 CCn1nccc1CNO Amb26887497 [0,1,0,0,0,0|3,0,0]=4 785 B10R1.5 CCn1ncnc1CCBr Amb26874323 [0,1,0,0,0,0|3,0,0]=4 786 B10R1.5 CCn1ncnc1CCCl Amb27619571 [0,1,0,0,0,0|3,0,0]=4 787 B10R1.5 CCn1ncnc1CCN Amb18300410 [0,1,0,0,0,0|3,0,0]=4 788 B10R1.5 CCn1ncnc1CCO Amb25780433 [0,1,0,0,0,0|2,0,0]=3 789 B10R1.5 CCn1ncnc1CCS Amb33416468 [0,1,0,0,0,0|2,1,0]=4 790 B10R1.5 CCn1ncnc1CNO Amb33417262 [0,1,0,0,0,0|3,0,0]=4 791 B10R1.5 CCn1nncc1CCO Amb24479425 [0,1,0,0,0,0|3,0,0]=4 792 B10R1.5 CNCc1sccc1OC Amb9677584 [0,1,0,0,0,0|3,0,0]=4 793 B10R1.5 COCc1ocnc1CCl Amb25257871 [0,1,0,0,0,0|2,1,0]=4 794 B10R1.5 COCc1ocnc1CN Amb18908363 [0,1,0,0,0,0|2,1,0]=4 795 B10R1.5 COCc1ocnc1CN Amb35753072 [0,1,0,0,0,0|2,1,0]=4 796 B10R1.5 COCc1ocnc1CO Amb27758261 [0,1,0,0,0,0|2,1,0]=4 797 B10R1.5 COCc1sccc1CN Amb32660168 [0,1,0,0,0,0|3,0,0]=4 798 B10R1.5 COc1ccsc1CCO Amb27835894 [0,1,0,0,0,0|1,0,0]=2 799 B10R1.5 COc1ccsc1\C=N\O Amb22736438 [0,1,0,0,0,0|2,0,1]=4 800 B10R1.5 COc1ncsc1CCCl Amb26597462 [0,1,0,0,0,0|1,0,0]=2 801 B10R1.5 COc1nscc1CCO Amb32950388 [0,1,0,0,0,0|2,0,0]=3 802 B10R1.5 CSc1nnnn1CCO Amb28282574 [0,1,0,0,0,0|3,0,0]=4 803 B10R1.5 FCCn1ncnc1CCl Amb28041855 [0,1,0,0,0,0|3,0,0]=4 804 B10R1.5 FCCn1ncnc1CCl Amb32651894 [0,1,0,0,0,0|3,0,0]=4 805 B10R1.5 N#Cc1ncsc1CCCl Amb25133796 [0,1,0,0,0,0|1,0,1]=3 806 B10R1.5 NCCn1ccnc1CO Amb27838898 [0,1,0,0,0,0|3,0,0]=4 807 B10R1.5 NCc1nnnn1CCO Amb17567737 [0,1,0,0,0,0|3,0,0]=4 808 B10R1.5 O=Cc1nccn1CCO Amb2592419 [0,1,0,0,0,0|2,0,1]=4 809 B10R1.5 OCCc1sccc1CO Amb27822779 [0,1,0,0,0,0|1,0,0]=2 810 B10R1.5 OCCn1ccnc1CO Amb27661394 [0,1,0,0,0,0|2,0,0]=3 811 B10R1.5 OCCn1ccnc1CO Amb35788151 [0,1,0,0,0,0|2,0,0]=3 812 B10R1.5 OCCn1ncnc1CCl Amb28280029 [0,1,0,0,0,0|2,0,0]=3 813 B10R1.5 [C-]#[N+]Cc1sccc1CC Amb32729197 [0,1,0,0,0,0|3,0,0]=4 814 B10R1.29 BrCCCc1sccc1Br Amb25916454 [0,1,0,0,0,0|3,0,0]=4 815 B10R1.29 C#CCCc1ccnn1C Amb33223891 [0,1,0,0,0,0|3,0,0]=4 816 B10R1.29 C#CCCc1ccoc1C Amb33274354 [0,1,0,0,0,0|3,0,0]=4 817 B10R1.29 C#CCCc1occc1C Amb33343127 [0,1,0,0,0,0|2,1,0]=4 818 B10R1.29 C#CCCc1sccc1Br Amb33387645 [0,1,0,0,0,0|3,0,0]=4 819 B10R1.29 C#CCCc1sccc1C Amb33314447 [0,1,0,0,0,0|2,0,0]=3 820 B10R1.29 C#CCCc1sccc1Cl Amb33257994 [0,1,0,0,0,0|3,0,0]=4 821 B10R1.29 C#CCCc1scnc1C Amb33271240 [0,1,0,0,0,0|1,0,0]=2 822 B10R1.29 C=CCCc1ccnn1C Amb35715626 [0,1,0,0,0,0|3,0,0]=4 823 B10R1.29 C=CCCc1ccsc1C Amb29863400 [0,1,0,0,0,0|3,0,0]=4 824 B10R1.29 C=CCCc1sccc1C Amb29863520 [0,1,0,0,0,0|2,0,0]=3 825 B10R1.29 C=CCCc1scnc1C Amb35636155 [0,1,0,0,0,0|1,0,0]=2 826 B10R1.29 CCCCc1ccnn1C Amb20619523 [0,1,0,0,0,0|3,0,0]=4 827 B10R1.29 CCCCc1scnc1C Amb25913556 [0,1,0,0,0,0|1,0,0]=2 828 B10R1.29 CCCCn1ccnc1C Amb10574358 [0,1,0,0,0,0|3,0,0]=4 829 B10R1.29 CCCOc1ccnn1C Amb25081916 [0,1,0,0,0,0|3,0,0]=4 830 B10R1.29 CCCOc1ocnc1C Amb27421437 [0,1,0,0,0,0|1,1,0]=3 831 B10R1.29 CCCSc1ccoc1C Amb27424928 [0,1,0,0,0,0|3,0,0]=4 832 B10R1.29 CCCSc1snnc1C Amb2424244 [0,1,0,0,0,0|2,0,0]=3 833 B10R1.29 CCNCc1ccnn1C Amb31210196 [0,1,0,0,0,0|3,0,0]=4 834 B10R1.29 CCNCc1ccoc1C Amb8853712 [0,1,0,0,0,0|3,0,0]=4 835 B10R1.29 CCNCc1conc1C Amb18831832 [0,1,0,0,0,0|3,0,0]=4 836 B10R1.29 CCNCc1nonc1C Amb1091878 [0,1,0,0,0,0|3,0,0]=4 837 B10R1.29 CCNCc1occc1C Amb8853709 [0,1,0,0,0,0|2,1,0]=4 838 B10R1.29 CCNCc1sccc1C Amb838292 [0,1,0,0,0,0|2,0,0]=3 839 B10R1.29 CCNCc1sccc1Cl Amb27603108 [0,1,0,0,0,0|3,0,0]=4 840 B10R1.29 CCNCc1sccc1F Amb27456605 [0,1,0,0,0,0|3,0,0]=4 841 B10R1.29 CCNCc1sccc1N Amb28064544 [0,1,0,0,0,0|3,0,0]=4 842 B10R1.29 CCNCc1scnc1C Amb2592080 [0,1,0,0,0,0|1,0,0]=2 843 B10R1.29 CCOCc1ccnn1C Amb24269835 [0,1,0,0,0,0|3,0,0]=4 844 B10R1.29 CCSCc1ccnn1C Amb27218255 [0,1,0,0,0,0|3,0,0]=4 845 B10R1.29 CCSCc1ncnn1C Amb27836570 [0,1,0,0,0,0|3,0,0]=4 846 B10R1.29 CCSCc1ncoc1C Amb27829847 [0,1,0,0,0,0|3,0,0]=4 847 B10R1.29 CCSCc1scnc1C Amb27261034 [0,1,0,0,0,0|1,0,0]=2 848 B10R1.29 CNCCc1ccnn1C Amb27768611 [0,1,0,0,0,0|3,0,0]=4 849 B10R1.29 CNCCc1ccnn1C Amb33299313 [0,1,0,0,0,0|3,0,0]=4 850 B10R1.29 CNCCc1ccoc1C Amb26526948 [0,1,0,0,0,0|3,0,0]=4 851 B10R1.29 CNCCc1ncnn1C Amb18995482 [0,1,0,0,0,0|3,0,0]=4 852 B10R1.29 CNCCc1occc1C Amb24608196 [0,1,0,0,0,0|2,1,0]=4 853 B10R1.29 CNCCc1sccc1Br Amb18293202 [0,1,0,0,0,0|3,0,0]=4 854 B10R1.29 CNCCc1sccc1C Amb25767110 [0,1,0,0,0,0|2,0,0]=3 855 B10R1.29 CNCCc1sccc1Cl Amb24401866 [0,1,0,0,0,0|3,0,0]=4 856 B10R1.29 CNCCc1scnc1C Amb17622292 [0,1,0,0,0,0|1,0,0]=2 857 B10R1.29 CNCCc1scnc1C Amb19134553 [0,1,0,0,0,0|1,0,0]=2 858 B10R1.29 CNCCc1scnc1C Amb3941229 [0,1,0,0,0,0|1,0,0]=2 859 B10R1.29 CNCCn1ccnc1C Amb21954069 [0,1,0,0,0,0|3,0,0]=4 860 B10R1.29 CNCCn1ccnc1C Amb5559945 [0,1,0,0,0,0|3,0,0]=4 861 B10R1.29 CNCCn1ncnc1C Amb18917018 [0,1,0,0,0,0|3,0,0]=4 862 B10R1.29 COCCc1nccn1C Amb27959128 [0,1,0,0,0,0|3,0,0]=4 863 B10R1.29 COCCc1sccc1Br Amb27763658 [0,1,0,0,0,0|2,0,0]=3 864 B10R1.29 COCCn1ccnc1Br Amb17402980 [0,1,0,0,0,0|3,0,0]=4 865 B10R1.29 COCCn1ccnc1C Amb27655369 [0,1,0,0,0,0|2,0,0]=3 866 B10R1.29 COCCn1ccnc1N Amb26514135 [0,1,0,0,0,0|3,0,0]=4 867 B10R1.29 COCCn1nccc1C Amb28203298 [0,1,0,0,0,0|3,0,0]=4 868 B10R1.29 COCCn1nnnc1C Amb28063726 [0,1,0,0,0,0|3,0,0]=4 869 B10R1.29 CONCc1ccnn1C Amb28324906 [0,1,0,0,0,0|3,0,0]=4 870 B10R1.29 CONCc1ccsc1C Amb27595469 [0,1,0,0,0,0|3,0,0]=4 871 B10R1.29 CONCc1ncnn1C Amb27842041 [0,1,0,0,0,0|3,0,0]=4 872 B10R1.29 CONCc1scnc1C Amb28384013 [0,1,0,0,0,0|1,0,0]=2 873 B10R1.29 CONCc1snnc1C Amb27639754 [0,1,0,0,0,0|2,0,0]=3 874 B10R1.29 CO\N=C\c1scnc1C Amb27424932 [0,1,0,0,0,0|1,0,1]=3 875 B10R1.29 Cc1ccnn1CCCO Amb6888918 [0,1,0,0,0,0|3,0,0]=4 876 B10R1.29 Cc1ccoc1CCC#N Amb26551066 [0,1,0,0,0,0|2,1,0]=4 877 B10R1.29 Cc1ccoc1CCC=O Amb33343122 [0,1,0,0,0,0|1,1,1]=4 878 B10R1.29 Cc1ccoc1CCCBr Amb33435124 [0,1,0,0,0,0|2,1,0]=4 879 B10R1.29 Cc1ccoc1CCCN Amb26031202 [0,1,0,0,0,0|2,1,0]=4 880 B10R1.29 Cc1ccoc1CCCO Amb33343123 [0,1,0,0,0,0|1,1,0]=3 881 B10R1.29 Cc1ccoc1CCCS Amb33342788 [0,1,0,0,0,0|1,2,0]=4 882 B10R1.29 Cc1ccoc1CCON Amb33343538 [0,1,0,0,0,0|1,1,0]=3 883 B10R1.29 Cc1ccoc1CSCCl Amb32987581 [0,1,0,0,0,0|2,1,0]=4 884 B10R1.29 Cc1ccoc1OCCN Amb33342798 [0,1,0,0,0,0|2,1,0]=4 885 B10R1.29 Cc1ccoc1\C=C\CO Amb33079472 [0,1,0,0,0,0|1,1,1]=4 886 B10R1.29 Cc1ccsc1C#CCCl Amb28454012 [0,1,0,0,0,0|2,0,1]=4 887 B10R1.29 Cc1ccsc1C#CCO Amb28049586 [0,1,0,0,0,0|1,0,1]=3 888 B10R1.29 Cc1ccsc1CCC#N Amb26584300 [0,1,0,0,0,0|2,0,0]=3 889 B10R1.29 Cc1ccsc1CCC=O Amb26454122 [0,1,0,0,0,0|1,0,1]=3 890 B10R1.29 Cc1ccsc1CCCBr Amb25332880 [0,1,0,0,0,0|2,0,0]=3 891 B10R1.29 Cc1ccsc1CCCN Amb17477777 [0,1,0,0,0,0|2,0,0]=3 892 B10R1.29 Cc1ccsc1CCCO Amb17477781 [0,1,0,0,0,0|1,0,0]=2 893 B10R1.29 Cc1ccsc1CCCS Amb33314446 [0,1,0,0,0,0|1,1,0]=3 894 B10R1.29 Cc1ccsc1CCON Amb33202985 [0,1,0,0,0,0|1,0,0]=2 895 B10R1.29 Cc1ccsc1CN=C=O Amb25340656 [0,1,0,0,0,0|1,0,2]=4 896 B10R1.29 Cc1ccsc1CN=[N+]=[N-] Amb33171949 [0,1,0,0,0,0|3,0,0]=4 897 B10R1.29 Cc1ccsc1OCCN Amb33202573 [0,1,0,0,0,0|2,0,0]=3 898 B10R1.29 Cc1ccsc1SCCO Amb27191658 [0,1,0,0,0,0|1,0,0]=2 899 B10R1.29 Cc1ccsc1\C=C\CCl Amb28146518 [0,1,0,0,0,0|2,0,1]=4 900 B10R1.29 Cc1ccsc1\C=C\CN Amb33136501 [0,1,0,0,0,0|2,0,1]=4 901 B10R1.29 Cc1ccsc1\C=C\CO Amb33136400 [0,1,0,0,0,0|1,0,1]=3 902 B10R1.29 Cc1cnsc1CCCN Amb18200112 [0,1,0,0,0,0|3,0,0]=4 903 B10R1.29 Cc1cocc1CCCO Amb27800767 [0,1,0,0,0,0|3,0,0]=4 904 B10R1.29 Cc1cscc1CCCO Amb33213394 [0,1,0,0,0,0|3,0,0]=4 905 B10R1.29 Cc1cscc1CCON Amb33145889 [0,1,0,0,0,0|3,0,0]=4 906 B10R1.29 Cc1nccn1CCC#N Amb1101960 [0,1,0,0,0,0|3,0,0]=4 907 B10R1.29 Cc1nccn1CCCBr Amb20668459 [0,1,0,0,0,0|3,0,0]=4 908 B10R1.29 Cc1nccn1CCCBr Amb8828108 [0,1,0,0,0,0|3,0,0]=4 909 B10R1.29 Cc1nccn1CCCCl Amb1138794 [0,1,0,0,0,0|3,0,0]=4 910 B10R1.29 Cc1nccn1CCCCl Amb20668223 [0,1,0,0,0,0|3,0,0]=4 911 B10R1.29 Cc1nccn1CCCN Amb1058864 [0,1,0,0,0,0|3,0,0]=4 912 B10R1.29 Cc1nccn1CCCN Amb22757187 [0,1,0,0,0,0|3,0,0]=4 913 B10R1.29 Cc1nccn1CCCN Amb8503294 [0,1,0,0,0,0|3,0,0]=4 914 B10R1.29 Cc1nccn1CCCO Amb21959604 [0,1,0,0,0,0|2,0,0]=3 915 B10R1.29 Cc1nccn1CCCO Amb9370411 [0,1,0,0,0,0|2,0,0]=3 916 B10R1.29 Cc1nccn1CCCS Amb27217980 [0,1,0,0,0,0|2,1,0]=4 917 B10R1.29 Cc1ncnn1CCCN Amb18254879 [0,1,0,0,0,0|3,0,0]=4 918 B10R1.29 Cc1ncsc1C#CCCl Amb35632675 [0,1,0,0,0,0|1,0,1]=3 919 B10R1.29 Cc1ncsc1C#CCN Amb35616599 [0,1,0,0,0,0|1,0,1]=3 920 B10R1.29 Cc1ncsc1C#CCO Amb35616583 [0,1,0,0,0,0|0,0,1]=2 921 B10R1.29 Cc1ncsc1CCC=O Amb24085273 [0,1,0,0,0,0|0,0,1]=2 922 B10R1.29 Cc1ncsc1CCCBr Amb20668875 [0,1,0,0,0,0|1,0,0]=2 923 B10R1.29 Cc1ncsc1CCCCl Amb20668874 [0,1,0,0,0,0|1,0,0]=2 924 B10R1.29 Cc1ncsc1CCCCl Amb33189126 [0,1,0,0,0,0|1,0,0]=2 925 B10R1.29 Cc1ncsc1CCCN Amb13948981 [0,1,0,0,0,0|1,0,0]=2 926 B10R1.29 Cc1ncsc1CCCN Amb8009583 [0,1,0,0,0,0|1,0,0]=2 927 B10R1.29 Cc1ncsc1CCCO Amb22832090 [0,1,0,0,0,0|0,0,0]=1 928 B10R1.29 Cc1ncsc1CCCS Amb33271207 [0,1,0,0,0,0|0,1,0]=2 929 B10R1.29 Cc1ncsc1CCON Amb25125033 [0,1,0,0,0,0|0,0,0]=1 930 B10R1.29 Cc1ncsc1CN=C=O Amb24386190 [0,1,0,0,0,0|0,0,2]=3 931 B10R1.29 Cc1ncsc1CN=[N+]=[N-] Amb32876825 [0,1,0,0,0,0|2,0,0]=3 932 B10R1.29 Cc1ncsc1NCCN Amb35591177 [0,1,0,0,0,0|1,0,0]=2 933 B10R1.29 Cc1ncsc1OCCN Amb33271216 [0,1,0,0,0,0|1,0,0]=2 934 B10R1.29 Cc1ncsc1\C=C\C#N Amb27204078 [0,1,0,0,0,0|1,0,2]=4 935 B10R1.29 Cc1ncsc1\C=C\C=O Amb33358465 [0,1,0,0,0,0|0,0,3]=4 936 B10R1.29 Cc1ncsc1\C=C\CBr Amb28050909 [0,1,0,0,0,0|1,0,1]=3 937 B10R1.29 Cc1ncsc1\C=C\CN Amb33474881 [0,1,0,0,0,0|1,0,1]=3 938 B10R1.29 Cc1ncsc1\C=C\CO Amb33172520 [0,1,0,0,0,0|0,0,1]=2 939 B10R1.29 Cc1nnsc1CCCBr Amb26381821 [0,1,0,0,0,0|2,0,0]=3 940 B10R1.29 Cc1nnsc1CCCCl Amb25744247 [0,1,0,0,0,0|2,0,0]=3 941 B10R1.29 Cc1nnsc1CCCN Amb27459253 [0,1,0,0,0,0|2,0,0]=3 942 B10R1.29 Cc1nnsc1CN=[N+]=[N-] Amb27459513 [0,1,0,0,0,0|3,0,0]=4 943 B10R1.29 Cc1nnsc1CNC#N Amb27434544 [0,1,0,0,0,0|2,0,1]=4 944 B10R1.29 Cc1nnsc1CNC=O Amb28145317 [0,1,0,0,0,0|1,0,2]=4 945 B10R1.29 Cc1nnsc1SCCN Amb2424234 [0,1,0,0,0,0|2,0,0]=3 946 B10R1.29 Cc1nnsc1\C=C\CBr Amb27428746 [0,1,0,0,0,0|2,0,1]=4 947 B10R1.29 Cc1nnsc1\C=C\CO Amb28244887 [0,1,0,0,0,0|1,0,1]=3 948 B10R1.29 Cc1nocc1CCCN Amb18831877 [0,1,0,0,0,0|3,0,0]=4 949 B10R1.29 Cc1nocc1CCCN Amb33483669 [0,1,0,0,0,0|3,0,0]=4 950 B10R1.29 Cc1nonc1CSCI Amb29838171 [0,1,0,0,0,0|3,0,0]=4 951 B10R1.29 Cc1nonc1OCCN Amb10607606 [0,1,0,0,0,0|3,0,0]=4 952 B10R1.29 Cc1nonc1OCCN Amb22492348 [0,1,0,0,0,0|3,0,0]=4 953 B10R1.29 Cc1nonc1OCCN Amb22586900 [0,1,0,0,0,0|3,0,0]=4 954 B10R1.29 Cc1nscc1CCCN Amb18200111 [0,1,0,0,0,0|3,0,0]=4 955 B10R1.29 Cc1nsnc1CCCN Amb18830580 [0,1,0,0,0,0|3,0,0]=4 956 B10R1.29 Cc1occc1CCC#N Amb33473291 [0,1,0,0,0,0|3,0,0]=4 957 B10R1.29 Cc1occc1CCC=O Amb33274350 [0,1,0,0,0,0|2,0,1]=4 958 B10R1.29 Cc1occc1CCCBr Amb33432632 [0,1,0,0,0,0|3,0,0]=4 959 B10R1.29 Cc1occc1CCCN Amb18832013 [0,1,0,0,0,0|3,0,0]=4 960 B10R1.29 Cc1occc1CCCO Amb33274327 [0,1,0,0,0,0|2,0,0]=3 961 B10R1.29 Cc1occc1CCCS Amb33274021 [0,1,0,0,0,0|2,1,0]=4 962 B10R1.29 Cc1occc1CCON Amb33275066 [0,1,0,0,0,0|2,0,0]=3 963 B10R1.29 Cc1occc1OCCN Amb33274284 [0,1,0,0,0,0|3,0,0]=4 964 B10R1.29 Cc1occc1SCCS Amb27603824 [0,1,0,0,0,0|2,1,0]=4 965 B10R1.29 Cc1occc1\C=C\CO Amb33274772 [0,1,0,0,0,0|2,0,1]=4 966 B10R1.29 Cc1ocnc1CCCN Amb18831878 [0,1,0,0,0,0|3,0,0]=4 967 B10R1.29 Cc1oncc1CCCO Amb33361130 [0,1,0,0,0,0|3,0,0]=4 968 B10R1.29 Cc1oncc1CCON Amb33361645 [0,1,0,0,0,0|3,0,0]=4 969 B10R1.29 Cc1sccc1CCC#N Amb27436730 [0,1,0,0,0,0|3,0,0]=4 970 B10R1.29 Cc1sccc1CCC=O Amb27424876 [0,1,0,0,0,0|2,0,1]=4 971 B10R1.29 Cc1sccc1CCCN Amb18830831 [0,1,0,0,0,0|3,0,0]=4 972 B10R1.29 ClCCCc1sccc1Br Amb25856509 [0,1,0,0,0,0|3,0,0]=4 973 B10R1.29 ClCCCc1sccc1Cl Amb25831723 [0,1,0,0,0,0|3,0,0]=4 974 B10R1.29 ClCCCc1scnc1Cl Amb32690323 [0,1,0,0,0,0|2,0,0]=3 975 B10R1.29 Clc1ccsc1CCCBr Amb27614975 [0,1,0,0,0,0|3,0,0]=4 976 B10R1.29 Clc1ncsc1CCCBr Amb32690266 [0,1,0,0,0,0|2,0,0]=3 977 B10R1.29 Cn1cccc1CCCO Amb24446322 [0,1,0,0,0,0|3,0,0]=4 978 B10R1.29 Cn1cccc1CCON Amb33314746 [0,1,0,0,0,0|3,0,0]=4 979 B10R1.29 Cn1cccc1NCCO Amb26923252 [0,1,0,0,0,0|3,0,0]=4 980 B10R1.29 Cn1ccnc1CCCO Amb26932566 [0,1,0,0,0,0|3,0,0]=4 981 B10R1.29 Cn1ccnc1CCON Amb25314030 [0,1,0,0,0,0|3,0,0]=4 982 B10R1.29 Cn1ccnc1NCCO Amb18295710 [0,1,0,0,0,0|3,0,0]=4 983 B10R1.29 Cn1ccnc1SCCO Amb2778345 [0,1,0,0,0,0|3,0,0]=4 984 B10R1.29 Cn1nccc1C#CCO Amb28282046 [0,1,0,0,0,0|2,0,1]=4 985 B10R1.29 Cn1nccc1CCC#N Amb26065070 [0,1,0,0,0,0|3,0,0]=4 986 B10R1.29 Cn1nccc1CCC=O Amb26936802 [0,1,0,0,0,0|2,0,1]=4 987 B10R1.29 Cn1nccc1CCCBr Amb25921231 [0,1,0,0,0,0|3,0,0]=4 988 B10R1.29 Cn1nccc1CCCN Amb27401570 [0,1,0,0,0,0|3,0,0]=4 989 B10R1.29 Cn1nccc1CCCN Amb35789713 [0,1,0,0,0,0|3,0,0]=4 990 B10R1.29 Cn1nccc1CCCO Amb26951085 [0,1,0,0,0,0|2,0,0]=3 991 B10R1.29 Cn1nccc1CCCS Amb33322379 [0,1,0,0,0,0|2,1,0]=4 992 B10R1.29 Cn1nccc1CCON Amb27759099 [0,1,0,0,0,0|2,0,0]=3 993 B10R1.29 Cn1nccc1NCCN Amb33141014 [0,1,0,0,0,0|3,0,0]=4 994 B10R1.29 Cn1nccc1OCCN Amb25218783 [0,1,0,0,0,0|3,0,0]=4 995 B10R1.29 Cn1nccc1\C=C\CO Amb33359468 [0,1,0,0,0,0|2,0,1]=4 996 B10R1.29 Cn1ncnc1CCC#N Amb27648199 [0,1,0,0,0,0|3,0,0]=4 997 B10R1.29 Cn1ncnc1CCCBr Amb25738273 [0,1,0,0,0,0|3,0,0]=4 998 B10R1.29 Cn1ncnc1CCCCl Amb24697106 [0,1,0,0,0,0|3,0,0]=4 999 B10R1.29 Cn1ncnc1CCCN Amb18995480 [0,1,0,0,0,0|3,0,0]=4 1000 B10R1.29 Cn1ncnc1CCCN Amb28555461 [0,1,0,0,0,0|3,0,0]=4 1001 B10R1.29 Cn1ncnc1CCCN Amb32664313 [0,1,0,0,0,0|3,0,0]=4 1002 B10R1.29 Cn1ncnc1CCCO Amb25952218 [0,1,0,0,0,0|2,0,0]=3 1003 B10R1.29 Cn1ncnc1CCNN Amb27776104 [0,1,0,0,0,0|3,0,0]=4 1004 B10R1.29 Cn1ncnc1NCCN Amb19651397 [0,1,0,0,0,0|3,0,0]=4 1005 B10R1.29 Cn1ncnc1SCCN Amb27770471 [0,1,0,0,0,0|3,0,0]=4 1006 B10R1.29 Cn1nncc1CCCO Amb27253878 [0,1,0,0,0,0|3,0,0]=4 1007 B10R1.29 Cn1nncc1CCON Amb33145627 [0,1,0,0,0,0|3,0,0]=4 1008 B10R1.29 Cn1nncc1NCCO Amb27812699 [0,1,0,0,0,0|3,0,0]=4 1009 B10R1.29 Cn1nnnc1CCCO Amb32944550 [0,1,0,0,0,0|3,0,0]=4 1010 B10R1.29 Cn1nnnc1NCCO Amb27808123 [0,1,0,0,0,0|3,0,0]=4 1011 B10R1.29 N#CCCc1sccc1Br Amb27158451 [0,1,0,0,0,0|3,0,0]=4 1012 B10R1.29 N#CCCc1sccc1Cl Amb26631169 [0,1,0,0,0,0|3,0,0]=4 1013 B10R1.29 NCCCc1sccc1Br Amb18301839 [0,1,0,0,0,0|3,0,0]=4 1014 B10R1.29 NCCCc1sccc1Cl Amb27413792 [0,1,0,0,0,0|3,0,0]=4 1015 B10R1.29 NCCOc1sccc1Br Amb33387967 [0,1,0,0,0,0|3,0,0]=4 1016 B10R1.29 NCCOc1sccc1Cl Amb33257969 [0,1,0,0,0,0|3,0,0]=4 1017 B10R1.29 NNCCc1sccc1Br Amb28341016 [0,1,0,0,0,0|3,0,0]=4 1018 B10R1.29 NOCCc1sccc1Br Amb33387186 [0,1,0,0,0,0|2,0,0]=3 1019 B10R1.29 NOCCc1sccc1Cl Amb33257925 [0,1,0,0,0,0|2,0,0]=3 1020 B10R1.29 Nc1nccn1CCCO Amb33165745 [0,1,0,0,0,0|3,0,0]=4 1021 B10R1.29 Nc1nonc1CCCO Amb18107855 [0,1,0,0,0,0|3,0,0]=4 1022 B10R1.29 O=CCCc1sccc1Br Amb25838062 [0,1,0,0,0,0|2,0,1]=4 1023 B10R1.29 O=CCCc1sccc1Cl Amb26969365 [0,1,0,0,0,0|2,0,1]=4 1024 B10R1.29 OCCCc1ccsc1Br Amb25187302 [0,1,0,0,0,0|3,0,0]=4 1025 B10R1.29 OCCCc1ccsc1Cl Amb25772720 [0,1,0,0,0,0|3,0,0]=4 1026 B10R1.29 OCCCc1sccc1Br Amb24495718 [0,1,0,0,0,0|2,0,0]=3 1027 B10R1.29 OCCCc1sccc1Cl Amb27595656 [0,1,0,0,0,0|2,0,0]=3 1028 B10R1.29 OCCCc1scnc1Cl Amb32945035 [0,1,0,0,0,0|1,0,0]=2 1029 B10R1.29 OCCCc1sncc1Br Amb32950803 [0,1,0,0,0,0|3,0,0]=4 1030 B10R1.29 OC\C=C\c1sccc1Br Amb33241635 [0,1,0,0,0,0|2,0,1]=4 1031 B10R1.29 OC\C=C\c1sccc1Cl Amb27964959 [0,1,0,0,0,0|2,0,1]=4 1032 B10R1.29 SCCCc1sccc1Br Amb33387985 [0,1,0,0,0,0|2,1,0]=4 1033 B10R1.29 SCCCc1sccc1Cl Amb33258005 [0,1,0,0,0,0|2,1,0]=4 1034 B10R1.29 [C-]#[N+]CCc1ccnn1C Amb33323526 [0,1,0,0,0,0|3,0,0]=4 1035 B10R1.29 [C-]#[N+]CCc1ccoc1C Amb33275128 [0,1,0,0,0,0|3,0,0]=4 1036 B10R1.29 [C-]#[N+]CCc1occc1C Amb33343553 [0,1,0,0,0,0|2,1,0]=4 1037 B10R1.29 [C-]#[N+]CCc1sccc1Br Amb33387161 [0,1,0,0,0,0|3,0,0]=4 1038 B10R1.29 [C-]#[N+]CCc1sccc1C Amb33203310 [0,1,0,0,0,0|2,0,0]=3 1039 B10R1.29 [C-]#[N+]CCc1sccc1Cl Amb33257626 [0,1,0,0,0,0|3,0,0]=4 1040 B10R1.29 [C-]#[N+]CCc1scnc1C Amb33224352 [0,1,0,0,0,0|1,0,0]=2 1041 B10R1.64 CC(=O)Cc1sccc1C Amb17477801 [0,1,0,0,0,0|1,0,2]=4 1042 B10R1.64 CC(=O)Cc1scnc1C Amb32877659 [0,1,0,0,0,0|0,0,2]=3 1043 B10R1.64 CC(Br)Cc1ccnn1C Amb33434147 [0,1,0,0,0,0|3,0,0]=4 1044 B10R1.64 CC(Br)Cc1sccc1Br Amb33389299 [0,1,0,0,0,0|3,0,0]=4 1045 B10R1.64 CC(Br)Cc1sccc1Cl Amb33335596 [0,1,0,0,0,0|3,0,0]=4 1046 B10R1.64 CC(C)Cc1sccc1N Amb18644764 [0,1,0,0,0,0|3,0,0]=4 1047 B10R1.64 CC(Cl)Cc1sccc1Cl Amb27252605 [0,1,0,0,0,0|3,0,0]=4 1048 B10R1.64 CC(N)Cc1ccnn1C Amb19652084 [0,1,0,0,0,0|3,0,0]=4 1049 B10R1.64 CC(N)Cc1ncnn1C Amb18963486 [0,1,0,0,0,0|3,0,0]=4 1050 B10R1.64 CC(O)Cc1cccn1C Amb17593531 [0,1,0,0,0,0|3,0,0]=4 1051 B10R1.64 CC(O)Cc1ccnn1C Amb33361297 [0,1,0,0,0,0|2,0,0]=3 1052 B10R1.64 CC(O)Cc1ccsc1Cl Amb30027568 [0,1,0,0,0,0|3,0,0]=4 1053 B10R1.64 CC(O)Cc1cnnn1C Amb33146538 [0,1,0,0,0,0|3,0,0]=4 1054 B10R1.64 CC(O)Cc1nccn1C Amb27790703 [0,1,0,0,0,0|3,0,0]=4 1055 B10R1.64 CC(O)Cc1ncnn1C Amb27161992 [0,1,0,0,0,0|2,0,0]=3 1056 B10R1.64 CC(O)Cc1sccc1Br Amb25693375 [0,1,0,0,0,0|2,0,0]=3 1057 B10R1.64 CC(O)Cc1sccc1Cl Amb26516986 [0,1,0,0,0,0|2,0,0]=3 1058 B10R1.64 CC(O)Cn1ccnc1N Amb33165744 [0,1,0,0,0,0|3,0,0]=4 1059 B10R1.64 CN(C)Cc1scnc1Br Amb18765463 [0,1,0,0,0,0|3,0,0]=4 1060 B10R1.64 CN(C)Cc1scnc1N Amb27475973 [0,1,0,0,0,0|3,0,0]=4 1061 B10R1.64 CN(O)Cc1ccnn1C Amb33323889 [0,1,0,0,0,0|3,0,0]=4 1062 B10R1.64 CN(O)Cc1sccc1Br Amb33450962 [0,1,0,0,0,0|3,0,0]=4 1063 B10R1.64 CN(O)Cc1sccc1Cl Amb33257601 [0,1,0,0,0,0|3,0,0]=4 1064 B10R1.64 C[C@@H](N)Cc1ccnn1C Amb33079609 [0,1,0,0,0,0|3,0,0]=4 1065 B10R1.64 C[C@@H](N)Cc1sccc1Br Amb33450886 [0,1,0,0,0,0|3,0,0]=4 1066 B10R1.64 C[C@@H](N)Cc1sccc1Cl Amb33407059 [0,1,0,0,0,0|3,0,0]=4 1067 B10R1.64 C[C@@H](O)Cc1cccn1C Amb33314480 [0,1,0,0,0,0|3,0,0]=4 1068 B10R1.64 C[C@@H](O)Cc1ccnn1C Amb33323503 [0,1,0,0,0,0|2,0,0]=3 1069 B10R1.64 C[C@@H](O)Cc1cnnn1C Amb33146042 [0,1,0,0,0,0|3,0,0]=4 1070 B10R1.64 C[C@@H](O)Cc1nccn1C Amb33427280 [0,1,0,0,0,0|3,0,0]=4 1071 B10R1.64 C[C@@H](O)Cc1sccc1Br Amb33387169 [0,1,0,0,0,0|2,0,0]=3 1072 B10R1.64 C[C@@H](O)Cc1sccc1Cl Amb33257927 [0,1,0,0,0,0|2,0,0]=3 1073 B10R1.64 C[C@H](N)Cc1sccc1Br Amb33387153 [0,1,0,0,0,0|3,0,0]=4 1074 B10R1.64 C[C@H](N)Cc1sccc1Cl Amb24470801 [0,1,0,0,0,0|3,0,0]=4 1075 B10R1.64 C[C@H](O)Cc1cccn1C Amb33226564 [0,1,0,0,0,0|3,0,0]=4 1076 B10R1.64 C[C@H](O)Cc1ccnn1C Amb33323504 [0,1,0,0,0,0|2,0,0]=3 1077 B10R1.64 C[C@H](O)Cc1cnnn1C Amb33146043 [0,1,0,0,0,0|3,0,0]=4 1078 B10R1.64 C[C@H](O)Cc1nccn1C Amb33427282 [0,1,0,0,0,0|3,0,0]=4 1079 B10R1.64 C[C@H](O)Cc1sccc1Br Amb33387167 [0,1,0,0,0,0|2,0,0]=3 1080 B10R1.64 C[C@H](O)Cc1sccc1Cl Amb33257812 [0,1,0,0,0,0|2,0,0]=3 1081 B10R1.64 Cc1ccoc1CC(=O)O Amb27787871 [0,1,0,0,0,0|1,1,1]=4 1082 B10R1.64 Cc1ccoc1CC(C)Br Amb33434756 [0,1,0,0,0,0|2,1,0]=4 1083 B10R1.64 Cc1ccoc1CC(C)O Amb27642707 [0,1,0,0,0,0|1,1,0]=3 1084 B10R1.64 Cc1ccoc1CN(C)O Amb33343970 [0,1,0,0,0,0|2,1,0]=4 1085 B10R1.64 Cc1ccoc1C[C@@H](C)N Amb33502173 [0,1,0,0,0,0|2,1,0]=4 1086 B10R1.64 Cc1ccoc1C[C@@H](C)O Amb33343821 [0,1,0,0,0,0|1,1,0]=3 1087 B10R1.64 Cc1ccoc1C[C@H](C)N Amb33501953 [0,1,0,0,0,0|2,1,0]=4 1088 B10R1.64 Cc1ccoc1C[C@H](C)O Amb33343822 [0,1,0,0,0,0|1,1,0]=3 1089 B10R1.64 Cc1ccsc1CC(=N)N Amb33202591 [0,1,0,0,0,0|2,0,1]=4 1090 B10R1.64 Cc1ccsc1CC(=O)O Amb33530091 [0,1,0,0,0,0|1,0,1]=3 1091 B10R1.64 Cc1ccsc1CC(C)Br Amb33335026 [0,1,0,0,0,0|2,0,0]=3 1092 B10R1.64 Cc1ccsc1CC(C)N Amb2592461 [0,1,0,0,0,0|2,0,0]=3 1093 B10R1.64 Cc1ccsc1CC(C)O Amb17477782 [0,1,0,0,0,0|1,0,0]=2 1094 B10R1.64 Cc1ccsc1CC(N)=O Amb27770390 [0,1,0,0,0,0|1,0,2]=4 1095 B10R1.64 Cc1ccsc1CC(N)=S Amb33202590 [0,1,0,0,0,0|1,1,1]=4 1096 B10R1.64 Cc1ccsc1CN(C)O Amb33197573 [0,1,0,0,0,0|2,0,0]=3 1097 B10R1.64 Cc1ccsc1C[C@@H](C)N Amb33359891 [0,1,0,0,0,0|2,0,0]=3 1098 B10R1.64 Cc1ccsc1C[C@@H](C)O Amb33202961 [0,1,0,0,0,0|1,0,0]=2 1099 B10R1.64 Cc1ccsc1C[C@H](C)N Amb24562308 [0,1,0,0,0,0|2,0,0]=3 1100 B10R1.64 Cc1ccsc1C[C@H](C)O Amb33202962 [0,1,0,0,0,0|1,0,0]=2 1101 B10R1.64 Cc1ccsc1C[N+](=O)[O-] Amb33202952 [0,1,0,0,0,0|2,0,1]=4 1102 B10R1.64 Cc1cscc1CC(C)O Amb33146678 [0,1,0,0,0,0|3,0,0]=4 1103 B10R1.64 Cc1cscc1C[C@@H](C)O Amb33146034 [0,1,0,0,0,0|3,0,0]=4 1104 B10R1.64 Cc1cscc1C[C@H](C)O Amb33146036 [0,1,0,0,0,0|3,0,0]=4 1105 B10R1.64 Cc1nccn1CC(=O)O Amb1126098 [0,1,0,0,0,0|2,0,1]=4 1106 B10R1.64 Cc1nccn1CC(=O)O Amb9677412 [0,1,0,0,0,0|2,0,1]=4 1107 B10R1.64 Cc1nccn1CC(C)C Amb24698442 [0,1,0,0,0,0|3,0,0]=4 1108 B10R1.64 Cc1nccn1CC(C)N Amb1139840 [0,1,0,0,0,0|3,0,0]=4 1109 B10R1.64 Cc1nccn1CC(C)N Amb29844588 [0,1,0,0,0,0|3,0,0]=4 1110 B10R1.64 Cc1nccn1CC(C)O Amb20628164 [0,1,0,0,0,0|2,0,0]=3 1111 B10R1.64 Cc1nccn1CC(C)O Amb29844587 [0,1,0,0,0,0|2,0,0]=3 1112 B10R1.64 Cc1ncnn1CC(=O)O Amb18254896 [0,1,0,0,0,0|2,0,1]=4 1113 B10R1.64 Cc1ncoc1CC(=O)O Amb17399865 [0,1,0,0,0,0|0,1,1]=3 1114 B10R1.64 Cc1ncoc1CC(C)C Amb28344045 [0,1,0,0,0,0|1,1,0]=3 1115 B10R1.64 Cc1ncsc1C=C(Br)Br Amb26949254 [0,1,0,0,0,0|1,0,2]=4 1116 B10R1.64 Cc1ncsc1CC(=N)N Amb33271182 [0,1,0,0,0,0|1,0,1]=3 1117 B10R1.64 Cc1ncsc1CC(=O)O Amb8385791 [0,1,0,0,0,0|0,0,1]=2 1118 B10R1.64 Cc1ncsc1CC(C)Br Amb33006856 [0,1,0,0,0,0|1,0,0]=2 1119 B10R1.64 Cc1ncsc1CC(C)Cl Amb28385639 [0,1,0,0,0,0|1,0,0]=2 1120 B10R1.64 Cc1ncsc1CC(C)O Amb33474314 [0,1,0,0,0,0|0,0,0]=1 1121 B10R1.64 Cc1ncsc1CC(N)=S Amb33272489 [0,1,0,0,0,0|0,1,1]=3 1122 B10R1.64 Cc1ncsc1CN(C)C Amb24072786 [0,1,0,0,0,0|2,0,0]=3 1123 B10R1.64 Cc1ncsc1CN(C)O Amb32876340 [0,1,0,0,0,0|1,0,0]=2 1124 B10R1.64 Cc1ncsc1C[C@@H](C)N Amb32875944 [0,1,0,0,0,0|1,0,0]=2 1125 B10R1.64 Cc1ncsc1C[C@@H](C)O Amb32875998 [0,1,0,0,0,0|0,0,0]=1 1126 B10R1.64 Cc1ncsc1C[C@H](C)N Amb32875943 [0,1,0,0,0,0|1,0,0]=2 1127 B10R1.64 Cc1ncsc1C[C@H](C)O Amb32875999 [0,1,0,0,0,0|0,0,0]=1 1128 B10R1.64 Cc1ncsc1C[N+](=O)[O-] Amb32875933 [0,1,0,0,0,0|1,0,1]=3 1129 B10R1.64 Cc1nnsc1CC(=O)O Amb18830500 [0,1,0,0,0,0|1,0,1]=3 1130 B10R1.64 Cc1nnsc1CC(N)=O Amb27238641 [0,1,0,0,0,0|1,0,2]=4 1131 B10R1.64 Cc1nnsc1SC(C)C Amb2420974 [0,1,0,0,0,0|3,0,0]=4 1132 B10R1.64 Cc1nocc1CC(=O)O Amb18202769 [0,1,0,0,0,0|2,0,1]=4 1133 B10R1.64 Cc1nonc1CC(=O)O Amb1099155 [0,1,0,0,0,0|2,0,1]=4 1134 B10R1.64 Cc1nscc1CC(=O)O Amb27791791 [0,1,0,0,0,0|2,0,1]=4 1135 B10R1.64 Cc1occc1CC(=O)O Amb17593534 [0,1,0,0,0,0|2,0,1]=4 1136 B10R1.64 Cc1occc1CC(C)Br Amb33432749 [0,1,0,0,0,0|3,0,0]=4 1137 B10R1.64 Cc1occc1CC(C)N Amb28077048 [0,1,0,0,0,0|3,0,0]=4 1138 B10R1.64 Cc1occc1CC(C)O Amb33447429 [0,1,0,0,0,0|2,0,0]=3 1139 B10R1.64 Cc1occc1CN(C)O Amb33473298 [0,1,0,0,0,0|3,0,0]=4 1140 B10R1.64 Cc1occc1C[C@@H](C)N Amb33274782 [0,1,0,0,0,0|3,0,0]=4 1141 B10R1.64 Cc1occc1C[C@@H](C)O Amb33445904 [0,1,0,0,0,0|2,0,0]=3 1142 B10R1.64 Cc1occc1C[C@H](C)N Amb33274781 [0,1,0,0,0,0|3,0,0]=4 1143 B10R1.64 Cc1occc1C[C@H](C)O Amb33445910 [0,1,0,0,0,0|2,0,0]=3 1144 B10R1.64 Cc1ocnc1CC(=O)O Amb33624646 [0,1,0,0,0,0|2,0,1]=4 1145 B10R1.64 Cc1oncc1CC(C)O Amb33361683 [0,1,0,0,0,0|3,0,0]=4 1146 B10R1.64 Cc1oncc1C[C@@H](C)O Amb33361421 [0,1,0,0,0,0|3,0,0]=4 1147 B10R1.64 Cc1oncc1C[C@H](C)O Amb33361422 [0,1,0,0,0,0|3,0,0]=4 1148 B10R1.64 Cc1sccc1CC(=O)O Amb4141718 [0,1,0,0,0,0|2,0,1]=4 1149 B10R1.64 Cn1nccc1CC(=O)O Amb18202914 [0,1,0,0,0,0|2,0,1]=4 1150 B10R1.64 Cn1nccc1CC(=O)O Amb32658030 [0,1,0,0,0,0|2,0,1]=4 1151 B10R1.64 Cn1ncnc1CB(O)O Amb27410247 [0,1,0,0,0,0|3,0,0]=4 1152 B10R1.64 Cn1ncnc1CC(=O)O Amb18287001 [0,1,0,0,0,0|2,0,1]=4 1153 B10R1.64 Cn1ncnc1CC(=O)O Amb32652786 [0,1,0,0,0,0|2,0,1]=4 1154 B10R1.64 Nc1ccsc1CC(=O)O Amb22499925 [0,1,0,0,0,0|2,0,1]=4 1155 B10R1.64 O=C(O)Cc1sccc1Br Amb18283686 [0,1,0,0,0,0|2,0,1]=4 1156 B10R1.64 O=C(O)Cc1sccc1Cl Amb27160571 [0,1,0,0,0,0|2,0,1]=4 1157 B10R1.64 O=C(O)Cc1scnc1Br Amb18161023 [0,1,0,0,0,0|1,0,1]=3 1158 B10R1.64 OB(O)Cc1sccc1Cl Amb27219547 [0,1,0,0,0,0|3,0,0]=4 1159 B10R1.94 CCCc1scc(N)c1C Amb27473543 [0,1,0,0,0,0|2,0,0]=3 1160 B10R1.94 CCCc1scc(N)c1N Amb27425047 [0,1,0,0,0,0|3,0,0]=4 1161 B10R1.94 Cc1c(Br)csc1CCO Amb27951798 [0,1,0,0,0,0|1,0,0]=2 1162 B10R1.94 Cc1c(CCN)ccn1C Amb18832144 [0,1,0,0,0,0|2,0,1]=4 1163 B10R1.94 Cc1c(CCN)ncn1C Amb27494040 [0,1,0,0,0,0|2,0,1]=4 1164 B10R1.94 Cc1c(CCO)cnn1C Amb25851803 [0,1,0,0,0,0|2,0,1]=4 1165 B10R1.94 Cc1c(CCO)nnn1C Amb17538060 [0,1,0,0,0,0|2,0,1]=4 1166 B10R1.94 Cc1c(CCO)sc[n+]1C Amb9786527 [0,1,0,0,0,0|0,0,1]=2 1167 B10R1.94 Cc1c(N)cnn1CCO Amb18283302 [0,1,0,0,0,0|3,0,0]=4 1168 B10R1.94 Cc1c(N)cnn1CCO Amb24271122 [0,1,0,0,0,0|3,0,0]=4 1169 B10R1.94 Cc1cnn(CCO)c1C Amb27651022 [0,1,0,0,0,0|3,0,0]=4 1170 B10R1.94 Cc1csc(CCBr)c1Br Amb33434242 [0,1,0,0,0,0|3,0,0]=4 1171 B10R1.94 Cc1csc(CCBr)c1Cl Amb33431249 [0,1,0,0,0,0|3,0,0]=4 1172 B10R1.94 Cc1csc(CCN)c1Br Amb33433190 [0,1,0,0,0,0|3,0,0]=4 1173 B10R1.94 Cc1csc(CCN)c1C Amb24554763 [0,1,0,0,0,0|2,0,0]=3 1174 B10R1.94 Cc1csc(CCO)c1Br Amb33433889 [0,1,0,0,0,0|2,0,0]=3 1175 B10R1.94 Cc1csc(CCS)c1Br Amb33432436 [0,1,0,0,0,0|2,1,0]=4 1176 B10R1.94 Cc1csc(CNO)c1Br Amb33433195 [0,1,0,0,0,0|3,0,0]=4 1177 B10R1.94 Cc1n(CCO)cc[n+]1C Amb28139400 [0,1,0,0,0,0|2,0,1]=4 1178 B10R1.130 CC1=C(CCN)NC(=O)N1 Amb18202735 [0,1,0,0,0,0|2,0,1]=4 1179 B10R1.130 CC1=C(CCN)OC(=O)N1 Amb18202631 [0,1,0,0,0,0|1,1,1]=4 1180 B10R1.130 CC1=C(CCN)SC(=O)N1 Amb18251548 [0,1,0,0,0,0|1,0,1]=3 1181 B10R1.130 CC1=C(CCN)SC(=S)N1 Amb18908978 [0,1,0,0,0,0|1,0,1]=3 1182 B10R1.130 CCCC1=C(C)NC(=O)N1 Amb27751358 [0,1,0,0,0,0|2,0,1]=4 1183 B10R1.130 CCCC1=C(C)NC(=O)S1 Amb27444422 [0,1,0,0,0,0|1,0,1]=3 1184 B10R1.130 CCCC1SC(N)=NC1=O Amb26516543 [0,1,0,0,0,0|2,0,1]=4 1185 B10R1.130 CCCN1SC(N)=NC1=O Amb23580008 [0,1,0,0,0,0|3,0,0]=4 1186 B10R1.130 CCCc1cc(N)nn1C Amb27953110 [0,1,0,0,0,0|3,0,0]=4 1187 B10R1.130 CCCc1nc(Br)nn1C Amb32757898 [0,1,0,0,0,0|3,0,0]=4 1188 B10R1.130 CCCc1nc(I)nn1C Amb32757932 [0,1,0,0,0,0|3,0,0]=4 1189 B10R1.130 CCCc1nc(N)nn1C Amb32757872 [0,1,0,0,0,0|3,0,0]=4 1190 B10R1.130 CCCc1nc(N)sc1C Amb25129409 [0,1,0,0,0,0|3,0,0]=4 1191 B10R1.130 CCCc1oc(I)nc1C Amb27974131 [0,1,0,0,0,0|1,1,0]=3 1192 B10R1.130 CCCc1sc(C)nc1C Amb27476453 [0,1,0,0,0,0|1,0,0]=2 1193 B10R1.130 CCCc1sc(N)nc1C Amb28458350 [0,1,0,0,0,0|1,0,0]=2 1194 B10R1.130 CCCn1cc(Br)nc1C Amb24317702 [0,1,0,0,0,0|3,0,0]=4 1195 B10R1.130 CCCn1cc(N)nc1C Amb18831980 [0,1,0,0,0,0|3,0,0]=4 1196 B10R1.130 CCCn1nc(N)nc1C Amb15701478 [0,1,0,0,0,0|3,0,0]=4 1197 B10R1.130 CCOC1=C(C)NC(=O)S1 Amb27971399 [0,1,0,0,0,0|2,0,1]=4 1198 B10R1.130 CCOc1sc(C)nc1Br Amb27482571 [0,1,0,0,0,0|3,0,0]=4 1199 B10R1.130 CN1NC(=O)C=C1CCO Amb27968083 [0,1,0,0,0,0|2,0,1]=4 1200 B10R1.130 CNCc1oc(C)nc1C Amb27212672 [0,1,0,0,0,0|2,1,0]=4 1201 B10R1.130 CNCc1sc(C)nc1C Amb17518072 [0,1,0,0,0,0|2,0,0]=3 1202 B10R1.130 CNCc1sc(N)nc1C Amb18281970 [0,1,0,0,0,0|2,0,0]=3 1203 B10R1.130 COCc1sc(Br)nc1C Amb27976477 [0,1,0,0,0,0|2,0,0]=3 1204 B10R1.130 COCc1sc(Cl)nc1C Amb18178398 [0,1,0,0,0,0|2,0,0]=3 1205 B10R1.130 Cc1cc(Br)c(CCBr)s1 Amb33434365 [0,1,0,0,0,0|3,0,0]=4 1206 B10R1.130 Cc1cc(Br)c(CCN)s1 Amb25108919 [0,1,0,0,0,0|3,0,0]=4 1207 B10R1.130 Cc1cc(Br)c(CCO)s1 Amb33434361 [0,1,0,0,0,0|2,0,0]=3 1208 B10R1.130 Cc1cc(Br)c(CCS)s1 Amb33431626 [0,1,0,0,0,0|2,1,0]=4 1209 B10R1.130 Cc1cc(Br)c(CNO)s1 Amb33431343 [0,1,0,0,0,0|3,0,0]=4 1210 B10R1.130 Cc1cc(Br)oc1CCBr Amb33450781 [0,1,0,0,0,0|2,1,0]=4 1211 B10R1.130 Cc1cc(Br)oc1CCN Amb33452150 [0,1,0,0,0,0|2,1,0]=4 1212 B10R1.130 Cc1cc(Br)oc1CCO Amb33450694 [0,1,0,0,0,0|1,1,0]=3 1213 B10R1.130 Cc1cc(Br)oc1CCS Amb33387504 [0,1,0,0,0,0|1,2,0]=4 1214 B10R1.130 Cc1cc(Br)oc1CNO Amb33451848 [0,1,0,0,0,0|2,1,0]=4 1215 B10R1.130 Cc1cc(Br)sc1CCN Amb28133194 [0,1,0,0,0,0|2,0,0]=3 1216 B10R1.130 Cc1cc(C)c(CC=O)s1 Amb32676233 [0,1,0,0,0,0|1,0,2]=4 1217 B10R1.130 Cc1cc(C)c(CCBr)s1 Amb32676236 [0,1,0,0,0,0|2,0,0]=3 1218 B10R1.130 Cc1cc(C)c(CCCl)s1 Amb32676235 [0,1,0,0,0,0|2,0,0]=3 1219 B10R1.130 Cc1cc(C)c(CCN)s1 Amb18125900 [0,1,0,0,0,0|2,0,0]=3 1220 B10R1.130 Cc1cc(C)c(CCO)s1 Amb32676234 [0,1,0,0,0,0|1,0,0]=2 1221 B10R1.130 Cc1cc(C)n(CCO)n1 Amb2437036 [0,1,0,0,0,0|3,0,0]=4 1222 B10R1.130 Cc1cc(CCBr)c(C)o1 Amb33432509 [0,1,0,0,0,0|3,0,0]=4 1223 B10R1.130 Cc1cc(CCBr)c(C)s1 Amb24361674 [0,1,0,0,0,0|3,0,0]=4 1224 B10R1.130 Cc1cc(CCBr)n(C)n1 Amb33337345 [0,1,0,0,0,0|3,0,0]=4 1225 B10R1.130 Cc1cc(CCCl)n(C)n1 Amb24725628 [0,1,0,0,0,0|3,0,0]=4 1226 B10R1.130 Cc1cc(CCN)c(C)o1 Amb18832019 [0,1,0,0,0,0|3,0,0]=4 1227 B10R1.130 Cc1cc(CCN)c(C)s1 Amb8010042 [0,1,0,0,0,0|3,0,0]=4 1228 B10R1.130 Cc1cc(CCN)n(C)n1 Amb18831990 [0,1,0,0,0,0|3,0,0]=4 1229 B10R1.130 Cc1cc(CCO)c(C)o1 Amb26350139 [0,1,0,0,0,0|2,0,0]=3 1230 B10R1.130 Cc1cc(CCO)c(C)s1 Amb25103613 [0,1,0,0,0,0|2,0,0]=3 1231 B10R1.130 Cc1cc(CCO)n(C)n1 Amb25190465 [0,1,0,0,0,0|2,0,0]=3 1232 B10R1.130 Cc1cc(CCS)c(C)o1 Amb33342235 [0,1,0,0,0,0|2,1,0]=4 1233 B10R1.130 Cc1cc(CCS)c(C)s1 Amb33149523 [0,1,0,0,0,0|2,1,0]=4 1234 B10R1.130 Cc1cc(CCS)n(C)n1 Amb33417548 [0,1,0,0,0,0|2,1,0]=4 1235 B10R1.130 Cc1cc(CNO)c(C)o1 Amb24730618 [0,1,0,0,0,0|3,0,0]=4 1236 B10R1.130 Cc1cc(CNO)c(C)s1 Amb25172845 [0,1,0,0,0,0|3,0,0]=4 1237 B10R1.130 Cc1cc(CNO)n(C)n1 Amb33319593 [0,1,0,0,0,0|3,0,0]=4 1238 B10R1.130 Cc1cc(Cl)sc1CCN Amb27200780 [0,1,0,0,0,0|2,0,0]=3 1239 B10R1.130 Cc1cc(N)nn1CCO Amb18963252 [0,1,0,0,0,0|3,0,0]=4 1240 B10R1.130 Cc1cn(C)nc1CCO Amb33503378 [0,1,0,0,0,0|3,0,0]=4 1241 B10R1.130 Cc1cn(CCN)c(C)n1 Amb18254865 [0,1,0,0,0,0|3,0,0]=4 1242 B10R1.130 Cc1cn(CCO)c(O)n1 Amb35665857 [0,1,0,0,0,0|3,0,0]=4 1243 B10R1.130 Cc1nc(Br)sc1CCCl Amb24463693 [0,1,0,0,0,0|1,0,0]=2 1244 B10R1.130 Cc1nc(Br)sc1CCO Amb27777475 [0,1,0,0,0,0|0,0,0]=1 1245 B10R1.130 Cc1nc(C)c(CC#N)s1 Amb2793854 [0,1,0,0,0,0|1,0,1]=3 1246 B10R1.130 Cc1nc(C)c(CCBr)s1 Amb18062588 [0,1,0,0,0,0|1,0,0]=2 1247 B10R1.130 Cc1nc(C)c(CCCl)s1 Amb17194187 [0,1,0,0,0,0|1,0,0]=2 1248 B10R1.130 Cc1nc(C)c(CCN)o1 Amb18831880 [0,1,0,0,0,0|1,1,0]=3 1249 B10R1.130 Cc1nc(C)c(CCN)s1 Amb16233806 [0,1,0,0,0,0|1,0,0]=2 1250 B10R1.130 Cc1nc(C)c(CCO)o1 Amb28349474 [0,1,0,0,0,0|0,1,0]=2 1251 B10R1.130 Cc1nc(C)c(CCO)s1 Amb18062321 [0,1,0,0,0,0|0,0,0]=1 1252 B10R1.130 Cc1nc(C)c(CNO)s1 Amb27270718 [0,1,0,0,0,0|1,0,0]=2 1253 B10R1.130 Cc1nc(C)n(CCCl)n1 Amb18177674 [0,1,0,0,0,0|3,0,0]=4 1254 B10R1.130 Cc1nc(C)n(CCCl)n1 Amb20623321 [0,1,0,0,0,0|3,0,0]=4 1255 B10R1.130 Cc1nc(C)n(CCN)n1 Amb22587126 [0,1,0,0,0,0|3,0,0]=4 1256 B10R1.130 Cc1nc(C)n(CCN)n1 Amb2793411 [0,1,0,0,0,0|3,0,0]=4 1257 B10R1.130 Cc1nc(C)n(CCN)n1 Amb33715408 [0,1,0,0,0,0|3,0,0]=4 1258 B10R1.130 Cc1nc(C)n(CCO)n1 Amb10608062 [0,1,0,0,0,0|2,0,0]=3 1259 B10R1.130 Cc1nc(CCN)c(C)o1 Amb5732296 [0,1,0,0,0,0|3,0,0]=4 1260 B10R1.130 Cc1nc(CCN)c(C)s1 Amb18200114 [0,1,0,0,0,0|3,0,0]=4 1261 B10R1.130 Cc1nc(CCO)c(C)o1 Amb5732357 [0,1,0,0,0,0|2,0,0]=3 1262 B10R1.130 Cc1nc(Cl)c(CCN)s1 Amb28348703 [0,1,0,0,0,0|2,0,0]=3 1263 B10R1.130 Cc1nc(Cl)oc1CCCl Amb28051358 [0,1,0,0,0,0|1,1,0]=3 1264 B10R1.130 Cc1nc(Cl)sc1CCCl Amb24442567 [0,1,0,0,0,0|1,0,0]=2 1265 B10R1.130 Cc1nc(Cl)sc1CCO Amb24053882 [0,1,0,0,0,0|0,0,0]=1 1266 B10R1.130 Cc1nc(Cl)sc1CNN Amb19664386 [0,1,0,0,0,0|2,0,0]=3 1267 B10R1.130 Cc1nc(F)sc1CCCl Amb27868438 [0,1,0,0,0,0|1,0,0]=2 1268 B10R1.130 Cc1nc(F)sc1CCO Amb24054298 [0,1,0,0,0,0|0,0,0]=1 1269 B10R1.130 Cc1nc(N)sc1CCBr Amb25887990 [0,1,0,0,0,0|1,0,0]=2 1270 B10R1.130 Cc1nc(N)sc1CCN Amb18251537 [0,1,0,0,0,0|1,0,0]=2 1271 B10R1.130 Cc1nc(N)sc1CCN Amb32646107 [0,1,0,0,0,0|1,0,0]=2 1272 B10R1.130 Cc1nc(N)sc1CCO Amb17593964 [0,1,0,0,0,0|0,0,0]=1 1273 B10R1.130 Cc1nc(S)sc1CCO Amb4025616 [0,1,0,0,0,0|0,0,0]=1 1274 B10R1.130 Cc1nn(C)cc1CCBr Amb25102896 [0,1,0,0,0,0|3,0,0]=4 1275 B10R1.130 Cc1nn(C)cc1CCN Amb18831983 [0,1,0,0,0,0|3,0,0]=4 1276 B10R1.130 Cc1nn(C)cc1CCO Amb24366959 [0,1,0,0,0,0|2,0,0]=3 1277 B10R1.130 Cc1nn(C)cc1CCS Amb33269381 [0,1,0,0,0,0|2,1,0]=4 1278 B10R1.130 Cc1nn(C)cc1CNO Amb25773788 [0,1,0,0,0,0|3,0,0]=4 1279 B10R1.130 Cc1nn(C)nc1CCN Amb18831823 [0,1,0,0,0,0|3,0,0]=4 1280 B10R1.130 Cc1oc(Cl)cc1CCN Amb28364072 [0,1,0,0,0,0|3,0,0]=4 1281 B10R1.130 Cc1sc(Br)nc1CCO Amb24597047 [0,1,0,0,0,0|2,0,0]=3 1282 B10R1.130 Cc1sc(N)nc1CCN Amb27409405 [0,1,0,0,0,0|3,0,0]=4 1283 B10R1.130 Cc1sc(N)nc1CCO Amb17593965 [0,1,0,0,0,0|2,0,0]=3 1284 B10R1.130 Cc1sc(O)nc1CCN Amb27607951 [0,1,0,0,0,0|3,0,0]=4 1285 B10R1.130 Cn1nc(Br)cc1CCBr Amb33436178 [0,1,0,0,0,0|3,0,0]=4 1286 B10R1.130 Cn1nc(Br)cc1CCCl Amb35719244 [0,1,0,0,0,0|3,0,0]=4 1287 B10R1.130 Cn1nc(Br)cc1CCN Amb33435705 [0,1,0,0,0,0|3,0,0]=4 1288 B10R1.130 Cn1nc(Br)cc1CCO Amb33078479 [0,1,0,0,0,0|2,0,0]=3 1289 B10R1.130 Cn1nc(Br)cc1CCS Amb33430606 [0,1,0,0,0,0|2,1,0]=4 1290 B10R1.130 Cn1nc(Br)cc1CNO Amb33435706 [0,1,0,0,0,0|3,0,0]=4 1291 B10R1.130 Cn1nc(Br)nc1CCF Amb32757901 [0,1,0,0,0,0|3,0,0]=4 1292 B10R1.130 Cn1nc(Cl)nc1CCO Amb27842208 [0,1,0,0,0,0|2,0,0]=3 1293 B10R1.130 Cn1nc(I)nc1CCF Amb32757937 [0,1,0,0,0,0|3,0,0]=4 1294 B10R1.130 Cn1nc(N)nc1CCF Amb32757894 [0,1,0,0,0,0|3,0,0]=4 1295 B10R1.130 NC1=NC(=O)C(CCCl)S1 Amb9833172 [0,1,0,0,0,0|2,0,1]=4 1296 B10R1.130 NC1=NC(=O)C(CCO)S1 Amb20413885 [0,1,0,0,0,0|1,0,1]=3 1297 B10R1.130 NCCc1oc(N)nc1Cl Amb28196446 [0,1,0,0,0,0|2,1,0]=4 1298 B10R1.130 NCCc1sc(Br)cc1Br Amb33006534 [0,1,0,0,0,0|3,0,0]=4 1299 B10R1.130 Nc1nc(Br)n(CCO)n1 Amb24479629 [0,1,0,0,0,0|3,0,0]=4 1300 B10R1.130 Nc1nc(N)n(CCO)n1 Amb28186287 [0,1,0,0,0,0|3,0,0]=4 1301 B10R1.130 O=C1C=C(CCO)C(=O)N1 Amb28368214 [0,1,0,0,0,0|2,0,1]=4 1302 B10R1.130 OCCc1cc(Cl)sc1Br Amb27772602 [0,1,0,0,0,0|3,0,0]=4 1303 B10R1.130 OCCc1sc(Br)cc1Br Amb33006772 [0,1,0,0,0,0|2,0,0]=3 1304 B10R1.130 OCCn1nc(Cl)nc1Cl Amb4134469 [0,1,0,0,0,0|3,0,0]=4 1305 B10R1.130 ONCc1sc(Br)cc1Br Amb33006541 [0,1,0,0,0,0|3,0,0]=4 1306 B10R1.130 O\N=C\c1sc(Cl)nc1Cl Amb2444788 [0,1,0,0,0,0|2,0,1]=4 1307 B10R1.149 C#CC(C)c1sccc1C Amb33202959 [0,1,0,0,0,0|2,0,1]=4 1308 B10R1.149 C#CC(C)c1scnc1C Amb32875941 [0,1,0,0,0,0|1,0,1]=3 1309 B10R1.149 C#C[C@@H](O)c1sccc1C Amb27878086 [0,1,0,0,0,0|2,0,1]=4 1310 B10R1.149 C=C(CBr)c1sccc1C Amb33335010 [0,1,0,0,0,0|2,0,1]=4 1311 B10R1.149 C=C(CBr)c1scnc1C Amb33008020 [0,1,0,0,0,0|1,0,1]=3 1312 B10R1.149 C=C(CCl)c1sccc1C Amb33259520 [0,1,0,0,0,0|2,0,1]=4 1313 B10R1.149 C=C(CCl)c1scnc1C Amb33057374 [0,1,0,0,0,0|1,0,1]=3 1314 B10R1.149 C=C(CN)c1sccc1C Amb33202953 [0,1,0,0,0,0|2,0,1]=4 1315 B10R1.149 C=C(CN)c1scnc1C Amb32875934 [0,1,0,0,0,0|1,0,1]=3 1316 B10R1.149 C=CC(=O)c1scnc1C Amb24573560 [0,1,0,0,0,0|1,0,2]=4 1317 B10R1.149 C=CC(N)c1snnc1C Amb28050295 [0,1,0,0,0,0|2,0,1]=4 1318 B10R1.149 C=CC(O)c1sccc1C Amb26869480 [0,1,0,0,0,0|2,0,1]=4 1319 B10R1.149 C=CC(O)c1scnc1C Amb24747488 [0,1,0,0,0,0|1,0,1]=3 1320 B10R1.149 C=CC(O)c1snnc1C Amb28120740 [0,1,0,0,0,0|2,0,1]=4 1321 B10R1.149 CC(CBr)c1ccnn1C Amb33434168 [0,1,0,0,0,0|3,0,0]=4 1322 B10R1.149 CC(CBr)c1sccc1Br Amb33387490 [0,1,0,0,0,0|3,0,0]=4 1323 B10R1.149 CC(CBr)c1sccc1Cl Amb33335927 [0,1,0,0,0,0|3,0,0]=4 1324 B10R1.149 CC(CN)c1ccnn1C Amb24669922 [0,1,0,0,0,0|3,0,0]=4 1325 B10R1.149 CC(CN)c1ncnn1C Amb18287015 [0,1,0,0,0,0|3,0,0]=4 1326 B10R1.149 CC(CN)c1sccc1Br Amb26594093 [0,1,0,0,0,0|3,0,0]=4 1327 B10R1.149 CC(CN)c1sccc1Cl Amb28041099 [0,1,0,0,0,0|3,0,0]=4 1328 B10R1.149 CCC(=O)c1ocnc1C Amb27613104 [0,1,0,0,0,0|1,1,1]=4 1329 B10R1.149 CCC(=O)c1sccc1C Amb18791602 [0,1,0,0,0,0|2,0,1]=4 1330 B10R1.149 CCC(=O)c1scnc1C Amb24364730 [0,1,0,0,0,0|1,0,1]=3 1331 B10R1.149 CCC(C)c1sccc1N Amb28130480 [0,1,0,0,0,0|3,0,0]=4 1332 B10R1.149 CCC(Cl)c1sccc1Cl Amb27603109 [0,1,0,0,0,0|3,0,0]=4 1333 B10R1.149 CCC(Cl)c1scnc1C Amb35635992 [0,1,0,0,0,0|1,0,0]=2 1334 B10R1.149 CCC(N)c1ccnn1C Amb10607925 [0,1,0,0,0,0|3,0,0]=4 1335 B10R1.149 CCC(N)c1ncnn1C Amb10669476 [0,1,0,0,0,0|3,0,0]=4 1336 B10R1.149 CCC(N)c1occc1C Amb18832026 [0,1,0,0,0,0|2,1,0]=4 1337 B10R1.149 CCC(N)c1sccc1C Amb18283288 [0,1,0,0,0,0|2,0,0]=3 1338 B10R1.149 CCC(N)c1sccc1C Amb35745713 [0,1,0,0,0,0|2,0,0]=3 1339 B10R1.149 CCC(N)c1sccc1Cl Amb27593874 [0,1,0,0,0,0|3,0,0]=4 1340 B10R1.149 CCC(O)c1ncnn1C Amb28137544 [0,1,0,0,0,0|3,0,0]=4 1341 B10R1.149 CCC(O)c1sccc1Cl Amb28249685 [0,1,0,0,0,0|3,0,0]=4 1342 B10R1.149 CCC(O)c1sccc1I Amb28282826 [0,1,0,0,0,0|3,0,0]=4 1343 B10R1.149 CCC(O)c1sccc1N Amb27617103 [0,1,0,0,0,0|3,0,0]=4 1344 B10R1.149 CCC(O)c1snnc1C Amb27805352 [0,1,0,0,0,0|2,0,0]=3 1345 B10R1.149 CC[C@@H](N)c1ccoc1C Amb28315842 [0,1,0,0,0,0|3,0,0]=4 1346 B10R1.149 CC[C@@H](N)c1ccsc1C Amb28239603 [0,1,0,0,0,0|3,0,0]=4 1347 B10R1.149 CC[C@@H](N)c1sccc1Cl Amb27862462 [0,1,0,0,0,0|3,0,0]=4 1348 B10R1.149 CC[C@@H](N)c1sccc1I Amb28057355 [0,1,0,0,0,0|3,0,0]=4 1349 B10R1.149 CC[C@@H](O)c1ccoc1C Amb27801991 [0,1,0,0,0,0|3,0,0]=4 1350 B10R1.149 CC[C@H](N)c1sccc1Br Amb27973107 [0,1,0,0,0,0|3,0,0]=4 1351 B10R1.149 CC[C@H](N)c1sccc1Cl Amb27861835 [0,1,0,0,0,0|3,0,0]=4 1352 B10R1.149 CC[C@H](O)c1sccc1Br Amb28141636 [0,1,0,0,0,0|3,0,0]=4 1353 B10R1.149 CNC(C)c1sccc1C Amb18955617 [0,1,0,0,0,0|3,0,0]=4 1354 B10R1.149 CNC(C)c1snnc1C Amb27823207 [0,1,0,0,0,0|3,0,0]=4 1355 B10R1.149 COC(=O)c1scnc1C Amb2445239 [0,1,0,0,0,0|2,0,1]=4 1356 B10R1.149 C\C(=N/O)c1scnc1C Amb7969605 [0,1,0,0,0,0|1,0,1]=3 1357 B10R1.149 Cc1cccn1C(C)CO Amb27838011 [0,1,0,0,0,0|3,0,0]=4 1358 B10R1.149 Cc1cccn1[C@@H](C)CO Amb27615074 [0,1,0,0,0,0|3,0,0]=4 1359 B10R1.149 Cc1ccnn1C(C)CO Amb32584028 [0,1,0,0,0,0|3,0,0]=4 1360 B10R1.149 Cc1ccoc1C(C)CBr Amb33434759 [0,1,0,0,0,0|2,1,0]=4 1361 B10R1.149 Cc1ccoc1C(C)CN Amb33344750 [0,1,0,0,0,0|2,1,0]=4 1362 B10R1.149 Cc1ccoc1C(F)CN Amb33343548 [0,1,0,0,0,0|2,1,0]=4 1363 B10R1.149 Cc1ccoc1C(N)CO Amb24477422 [0,1,0,0,0,0|1,1,0]=3 1364 B10R1.149 Cc1ccoc1C(O)CBr Amb33434765 [0,1,0,0,0,0|2,1,0]=4 1365 B10R1.149 Cc1ccoc1C(O)CCl Amb33222479 [0,1,0,0,0,0|2,1,0]=4 1366 B10R1.149 Cc1ccoc1C(O)CF Amb33343119 [0,1,0,0,0,0|2,1,0]=4 1367 B10R1.149 Cc1ccoc1C(O)CN Amb18831769 [0,1,0,0,0,0|2,1,0]=4 1368 B10R1.149 Cc1ccoc1C(O)CO Amb33343175 [0,1,0,0,0,0|1,1,0]=3 1369 B10R1.149 Cc1ccoc1[C@@H](N)CO Amb26349263 [0,1,0,0,0,0|1,1,0]=3 1370 B10R1.149 Cc1ccoc1[C@@H](O)CN Amb33343541 [0,1,0,0,0,0|2,1,0]=4 1371 B10R1.149 Cc1ccoc1[C@H](N)CO Amb24435367 [0,1,0,0,0,0|1,1,0]=3 1372 B10R1.149 Cc1ccoc1[C@H](O)CN Amb33343546 [0,1,0,0,0,0|2,1,0]=4 1373 B10R1.149 Cc1ccsc1C(=O)CCl Amb18180346 [0,1,0,0,0,0|2,0,1]=4 1374 B10R1.149 Cc1ccsc1C(=O)CN Amb18251480 [0,1,0,0,0,0|2,0,1]=4 1375 B10R1.149 Cc1ccsc1C(C)C#N Amb27831167 [0,1,0,0,0,0|2,0,1]=4 1376 B10R1.149 Cc1ccsc1C(C)C=O Amb33172140 [0,1,0,0,0,0|1,0,2]=4 1377 B10R1.149 Cc1ccsc1C(C)CBr Amb33335030 [0,1,0,0,0,0|2,0,0]=3 1378 B10R1.149 Cc1ccsc1C(C)CN Amb28285426 [0,1,0,0,0,0|2,0,0]=3 1379 B10R1.149 Cc1ccsc1C(C)NO Amb27832465 [0,1,0,0,0,0|2,0,0]=3 1380 B10R1.149 Cc1ccsc1C(C)ON Amb33202981 [0,1,0,0,0,0|3,0,0]=4 1381 B10R1.149 Cc1ccsc1C(Cl)C#N Amb18177955 [0,1,0,0,0,0|2,0,1]=4 1382 B10R1.149 Cc1ccsc1C(F)CN Amb26048388 [0,1,0,0,0,0|2,0,0]=3 1383 B10R1.149 Cc1ccsc1C(N)CN Amb9380698 [0,1,0,0,0,0|2,0,0]=3 1384 B10R1.149 Cc1ccsc1C(N)CO Amb18953607 [0,1,0,0,0,0|1,0,0]=2 1385 B10R1.149 Cc1ccsc1C(N)CO Amb20622400 [0,1,0,0,0,0|1,0,0]=2 1386 B10R1.149 Cc1ccsc1C(O)C=O Amb28049618 [0,1,0,0,0,0|1,0,2]=4 1387 B10R1.149 Cc1ccsc1C(O)CBr Amb26539780 [0,1,0,0,0,0|2,0,0]=3 1388 B10R1.149 Cc1ccsc1C(O)CCl Amb26616435 [0,1,0,0,0,0|2,0,0]=3 1389 B10R1.149 Cc1ccsc1C(O)CF Amb33202956 [0,1,0,0,0,0|2,0,0]=3 1390 B10R1.149 Cc1ccsc1C(O)CN Amb1109038 [0,1,0,0,0,0|2,0,0]=3 1391 B10R1.149 Cc1ccsc1C(O)CO Amb25145667 [0,1,0,0,0,0|1,0,0]=2 1392 B10R1.149 Cc1ccsc1[C@@H](C)NO Amb27242935 [0,1,0,0,0,0|2,0,0]=3 1393 B10R1.149 Cc1ccsc1[C@@H](N)CO Amb25076309 [0,1,0,0,0,0|1,0,0]=2 1394 B10R1.149 Cc1ccsc1[C@@H](O)C#N Amb28460908 [0,1,0,0,0,0|2,0,1]=4 1395 B10R1.149 Cc1ccsc1[C@@H](O)CN Amb24479580 [0,1,0,0,0,0|2,0,0]=3 1396 B10R1.149 Cc1ccsc1[C@H](C)NO Amb27946188 [0,1,0,0,0,0|2,0,0]=3 1397 B10R1.149 Cc1ccsc1[C@H](N)CO Amb24505236 [0,1,0,0,0,0|1,0,0]=2 1398 B10R1.149 Cc1ccsc1[C@H](O)CN Amb25837661 [0,1,0,0,0,0|2,0,0]=3 1399 B10R1.149 Cc1ccsc1\C(N)=N\O Amb9210503 [0,1,0,0,0,0|2,0,1]=4 1400 B10R1.149 Cc1cocc1[C@H](N)CO Amb28049518 [0,1,0,0,0,0|3,0,0]=4 1401 B10R1.149 Cc1cscc1C(N)CO Amb24398564 [0,1,0,0,0,0|3,0,0]=4 1402 B10R1.149 Cc1cscc1C(O)CO Amb33102212 [0,1,0,0,0,0|3,0,0]=4 1403 B10R1.149 Cc1cscc1[C@@H](N)CO Amb26565681 [0,1,0,0,0,0|3,0,0]=4 1404 B10R1.149 Cc1cscc1[C@H](N)CO Amb24408913 [0,1,0,0,0,0|3,0,0]=4 1405 B10R1.149 Cc1nccn1C(C)CO Amb10608127 [0,1,0,0,0,0|2,0,0]=3 1406 B10R1.149 Cc1ncoc1C(=O)CCl Amb25736195 [0,1,0,0,0,0|1,1,1]=4 1407 B10R1.149 Cc1ncoc1C(=O)CO Amb27476279 [0,1,0,0,0,0|0,1,1]=3 1408 B10R1.149 Cc1ncoc1C(=O)NO Amb28049397 [0,1,0,0,0,0|1,1,1]=4 1409 B10R1.149 Cc1ncoc1C(Br)C#N Amb27617043 [0,1,0,0,0,0|1,1,1]=4 1410 B10R1.149 Cc1ncoc1C(N)C#N Amb27197098 [0,1,0,0,0,0|1,1,1]=4 1411 B10R1.149 Cc1ncsc1C(=O)C=O Amb27816606 [0,1,0,0,0,0|0,0,3]=4 1412 B10R1.149 Cc1ncsc1C(=O)CCl Amb26480845 [0,1,0,0,0,0|1,0,1]=3 1413 B10R1.149 Cc1ncsc1C(=O)CN Amb18830749 [0,1,0,0,0,0|1,0,1]=3 1414 B10R1.149 Cc1ncsc1C(=O)NN Amb6254701 [0,1,0,0,0,0|2,0,1]=4 1415 B10R1.149 Cc1ncsc1C(C)C#N Amb32876338 [0,1,0,0,0,0|1,0,1]=3 1416 B10R1.149 Cc1ncsc1C(C)C=O Amb27828807 [0,1,0,0,0,0|0,0,2]=3 1417 B10R1.149 Cc1ncsc1C(C)CBr Amb33006859 [0,1,0,0,0,0|1,0,0]=2 1418 B10R1.149 Cc1ncsc1C(C)CN Amb18830714 [0,1,0,0,0,0|1,0,0]=2 1419 B10R1.149 Cc1ncsc1C(C)ON Amb32876001 [0,1,0,0,0,0|2,0,0]=3 1420 B10R1.149 Cc1ncsc1C(F)CN Amb32877634 [0,1,0,0,0,0|1,0,0]=2 1421 B10R1.149 Cc1ncsc1C(N)CO Amb32876347 [0,1,0,0,0,0|0,0,0]=1 1422 B10R1.149 Cc1ncsc1C(O)C=O Amb35632367 [0,1,0,0,0,0|0,0,2]=3 1423 B10R1.149 Cc1ncsc1C(O)CBr Amb25364050 [0,1,0,0,0,0|1,0,0]=2 1424 B10R1.149 Cc1ncsc1C(O)CCl Amb25322053 [0,1,0,0,0,0|1,0,0]=2 1425 B10R1.149 Cc1ncsc1C(O)CF Amb32875937 [0,1,0,0,0,0|1,0,0]=2 1426 B10R1.149 Cc1ncsc1C(O)CN Amb2592498 [0,1,0,0,0,0|1,0,0]=2 1427 B10R1.149 Cc1ncsc1C(O)CO Amb24593869 [0,1,0,0,0,0|0,0,0]=1 1428 B10R1.149 Cc1ncsc1[C@@H](N)CO Amb33079379 [0,1,0,0,0,0|0,0,0]=1 1429 B10R1.149 Cc1ncsc1[C@@H](O)CN Amb32876033 [0,1,0,0,0,0|1,0,0]=2 1430 B10R1.149 Cc1ncsc1[C@H](N)CO Amb33171651 [0,1,0,0,0,0|0,0,0]=1 1431 B10R1.149 Cc1ncsc1[C@H](O)CN Amb32876032 [0,1,0,0,0,0|1,0,0]=2 1432 B10R1.149 Cc1ncsc1\C(N)=N\O Amb25771751 [0,1,0,0,0,0|1,0,1]=3 1433 B10R1.149 Cc1nnsc1C(=O)CCl Amb26643283 [0,1,0,0,0,0|2,0,1]=4 1434 B10R1.149 Cc1nnsc1C(Cl)C#N Amb27201094 [0,1,0,0,0,0|2,0,1]=4 1435 B10R1.149 Cc1nnsc1C(N)CO Amb28067212 [0,1,0,0,0,0|1,0,0]=2 1436 B10R1.149 Cc1nnsc1\C(N)=N\O Amb4450352 [0,1,0,0,0,0|2,0,1]=4 1437 B10R1.149 Cc1occc1C(C)CBr Amb33432724 [0,1,0,0,0,0|3,0,0]=4 1438 B10R1.149 Cc1occc1C(C)CN Amb18832007 [0,1,0,0,0,0|3,0,0]=4 1439 B10R1.149 Cc1occc1C(F)CN Amb33275079 [0,1,0,0,0,0|3,0,0]=4 1440 B10R1.149 Cc1occc1C(N)CO Amb27667068 [0,1,0,0,0,0|2,0,0]=3 1441 B10R1.149 Cc1occc1C(O)CBr Amb33432720 [0,1,0,0,0,0|3,0,0]=4 1442 B10R1.149 Cc1occc1C(O)CF Amb33274777 [0,1,0,0,0,0|3,0,0]=4 1443 B10R1.149 Cc1occc1C(O)CN Amb24394520 [0,1,0,0,0,0|3,0,0]=4 1444 B10R1.149 Cc1occc1C(O)CO Amb33456742 [0,1,0,0,0,0|2,0,0]=3 1445 B10R1.149 Cc1occc1[C@@H](N)CO Amb26926209 [0,1,0,0,0,0|2,0,0]=3 1446 B10R1.149 Cc1occc1[C@@H](O)CN Amb33275078 [0,1,0,0,0,0|3,0,0]=4 1447 B10R1.149 Cc1occc1[C@H](N)CO Amb24436540 [0,1,0,0,0,0|2,0,0]=3 1448 B10R1.149 Cc1occc1[C@H](O)CN Amb33275077 [0,1,0,0,0,0|3,0,0]=4 1449 B10R1.149 Cc1oncc1C(N)CO Amb18202606 [0,1,0,0,0,0|3,0,0]=4 1450 B10R1.149 Cc1oncc1C(O)CO Amb33361413 [0,1,0,0,0,0|3,0,0]=4 1451 B10R1.149 Cc1oncc1[C@@H](N)CO Amb33361655 [0,1,0,0,0,0|3,0,0]=4 1452 B10R1.149 Cc1oncc1[C@H](N)CO Amb33361637 [0,1,0,0,0,0|3,0,0]=4 1453 B10R1.149 Cc1onnc1C(N)CO Amb27188164 [0,1,0,0,0,0|3,0,0]=4 1454 B10R1.149 Cc1sccc1C(C)CN Amb28185255 [0,1,0,0,0,0|3,0,0]=4 1455 B10R1.149 Cc1sccc1C(N)CN Amb27412909 [0,1,0,0,0,0|3,0,0]=4 1456 B10R1.149 Cc1sccc1C(N)CO Amb27768571 [0,1,0,0,0,0|2,0,0]=3 1457 B10R1.149 Cc1sccc1C(O)CO Amb27593577 [0,1,0,0,0,0|2,0,0]=3 1458 B10R1.149 Cn1cccc1C(N)CO Amb27876319 [0,1,0,0,0,0|3,0,0]=4 1459 B10R1.149 Cn1cccc1C(O)CO Amb27835065 [0,1,0,0,0,0|3,0,0]=4 1460 B10R1.149 Cn1cccc1[C@@H](N)CO Amb27630696 [0,1,0,0,0,0|3,0,0]=4 1461 B10R1.149 Cn1cccc1[C@H](N)CO Amb27391267 [0,1,0,0,0,0|3,0,0]=4 1462 B10R1.149 Cn1ccnc1C(N)CO Amb25282873 [0,1,0,0,0,0|3,0,0]=4 1463 B10R1.149 Cn1ccnc1C(O)CO Amb27870346 [0,1,0,0,0,0|3,0,0]=4 1464 B10R1.149 Cn1ccnc1[C@@H](N)CO Amb33359738 [0,1,0,0,0,0|3,0,0]=4 1465 B10R1.149 Cn1ccnc1[C@H](N)CO Amb33448680 [0,1,0,0,0,0|3,0,0]=4 1466 B10R1.149 Cn1nccc1C(F)CN Amb26024554 [0,1,0,0,0,0|3,0,0]=4 1467 B10R1.149 Cn1nccc1C(F)CO Amb27623538 [0,1,0,0,0,0|2,0,0]=3 1468 B10R1.149 Cn1nccc1C(N)CN Amb35714406 [0,1,0,0,0,0|3,0,0]=4 1469 B10R1.149 Cn1nccc1C(N)CO Amb25214605 [0,1,0,0,0,0|2,0,0]=3 1470 B10R1.149 Cn1nccc1C(O)CBr Amb27815698 [0,1,0,0,0,0|3,0,0]=4 1471 B10R1.149 Cn1nccc1C(O)CCl Amb27945335 [0,1,0,0,0,0|3,0,0]=4 1472 B10R1.149 Cn1nccc1C(O)CF Amb33323045 [0,1,0,0,0,0|3,0,0]=4 1473 B10R1.149 Cn1nccc1C(O)CN Amb24458230 [0,1,0,0,0,0|3,0,0]=4 1474 B10R1.149 Cn1nccc1C(O)CO Amb33456770 [0,1,0,0,0,0|2,0,0]=3 1475 B10R1.149 Cn1nccc1[C@@H](N)CO Amb32954564 [0,1,0,0,0,0|2,0,0]=3 1476 B10R1.149 Cn1nccc1[C@@H](O)CN Amb26079020 [0,1,0,0,0,0|3,0,0]=4 1477 B10R1.149 Cn1nccc1[C@H](N)CO Amb33474410 [0,1,0,0,0,0|2,0,0]=3 1478 B10R1.149 Cn1nccc1[C@H](O)CN Amb24630094 [0,1,0,0,0,0|3,0,0]=4 1479 B10R1.149 Cn1ncnc1C(N)CO Amb18963466 [0,1,0,0,0,0|2,0,0]=3 1480 B10R1.149 Cn1ncnc1C(O)CN Amb27465628 [0,1,0,0,0,0|3,0,0]=4 1481 B10R1.149 Cn1ncnc1C(O)CO Amb32796168 [0,1,0,0,0,0|2,0,0]=3 1482 B10R1.149 Cn1nncc1C(N)CO Amb33147441 [0,1,0,0,0,0|3,0,0]=4 1483 B10R1.149 Cn1nncc1C(O)CO Amb33145379 [0,1,0,0,0,0|3,0,0]=4 1484 B10R1.149 Cn1nncc1[C@@H](N)CO Amb33146583 [0,1,0,0,0,0|3,0,0]=4 1485 B10R1.149 Cn1nncc1[C@H](N)CO Amb33146584 [0,1,0,0,0,0|3,0,0]=4 1486 B10R1.149 NC(CO)c1ccoc1F Amb28048702 [0,1,0,0,0,0|3,0,0]=4 1487 B10R1.149 NC(CO)c1ccoc1O Amb27875140 [0,1,0,0,0,0|3,0,0]=4 1488 B10R1.149 NC(CO)c1ccsc1Cl Amb28072892 [0,1,0,0,0,0|3,0,0]=4 1489 B10R1.149 NC(CO)c1ccsc1F Amb27424820 [0,1,0,0,0,0|3,0,0]=4 1490 B10R1.149 NC(CO)c1sccc1Br Amb24354670 [0,1,0,0,0,0|2,0,0]=3 1491 B10R1.149 NC(CO)c1sccc1Cl Amb26346794 [0,1,0,0,0,0|2,0,0]=3 1492 B10R1.149 NC(CO)c1sccc1F Amb27454630 [0,1,0,0,0,0|2,0,0]=3 1493 B10R1.149 NCC(F)c1sccc1Br Amb24760872 [0,1,0,0,0,0|3,0,0]=4 1494 B10R1.149 NCC(F)c1sccc1Cl Amb25871198 [0,1,0,0,0,0|3,0,0]=4 1495 B10R1.149 NCC(N)c1sccc1Br Amb28315662 [0,1,0,0,0,0|3,0,0]=4 1496 B10R1.149 NCC(N)c1sccc1I Amb27593001 [0,1,0,0,0,0|3,0,0]=4 1497 B10R1.149 NCC(O)c1sccc1Br Amb24688375 [0,1,0,0,0,0|3,0,0]=4 1498 B10R1.149 NCC(O)c1sccc1Cl Amb28430349 [0,1,0,0,0,0|3,0,0]=4 1499 B10R1.149 NC[C@@H](N)c1sccc1Cl Amb28050258 [0,1,0,0,0,0|3,0,0]=4 1500 B10R1.149 NC[C@@H](O)c1sccc1Br Amb33387172 [0,1,0,0,0,0|3,0,0]=4 1501 B10R1.149 NC[C@@H](O)c1sccc1Cl Amb33263126 [0,1,0,0,0,0|3,0,0]=4 1502 B10R1.149 NC[C@H](O)c1sccc1Br Amb33387168 [0,1,0,0,0,0|3,0,0]=4 1503 B10R1.149 NC[C@H](O)c1sccc1Cl Amb33257636 [0,1,0,0,0,0|3,0,0]=4 1504 B10R1.149 N[C@@H](CO)c1ccoc1F Amb28400088 [0,1,0,0,0,0|3,0,0]=4 1505 B10R1.149 N[C@@H](CO)c1ccoc1O Amb27615673 [0,1,0,0,0,0|3,0,0]=4 1506 B10R1.149 N[C@@H](CO)c1ccsc1Br Amb27817221 [0,1,0,0,0,0|3,0,0]=4 1507 B10R1.149 N[C@@H](CO)c1ccsc1Cl Amb28398637 [0,1,0,0,0,0|3,0,0]=4 1508 B10R1.149 N[C@@H](CO)c1occc1Br Amb27965479 [0,1,0,0,0,0|2,1,0]=4 1509 B10R1.149 N[C@@H](CO)c1occc1Cl Amb28126764 [0,1,0,0,0,0|2,1,0]=4 1510 B10R1.149 N[C@@H](CO)c1occc1F Amb27439133 [0,1,0,0,0,0|2,1,0]=4 1511 B10R1.149 N[C@@H](CO)c1occc1O Amb28143762 [0,1,0,0,0,0|2,1,0]=4 1512 B10R1.149 N[C@@H](CO)c1sccc1Br Amb25690961 [0,1,0,0,0,0|2,0,0]=3 1513 B10R1.149 N[C@@H](CO)c1sccc1Cl Amb28045426 [0,1,0,0,0,0|2,0,0]=3 1514 B10R1.149 N[C@@H](CO)c1sccc1I Amb28315754 [0,1,0,0,0,0|2,0,0]=3 1515 B10R1.149 N[C@H](CO)c1ccoc1Br Amb28315865 [0,1,0,0,0,0|3,0,0]=4 1516 B10R1.149 N[C@H](CO)c1ccoc1F Amb28049425 [0,1,0,0,0,0|3,0,0]=4 1517 B10R1.149 N[C@H](CO)c1ccsc1Br Amb28049542 [0,1,0,0,0,0|3,0,0]=4 1518 B10R1.149 N[C@H](CO)c1ccsc1O Amb27827928 [0,1,0,0,0,0|3,0,0]=4 1519 B10R1.149 N[C@H](CO)c1occc1Br Amb28239845 [0,1,0,0,0,0|2,1,0]=4 1520 B10R1.149 N[C@H](CO)c1occc1O Amb27424798 [0,1,0,0,0,0|2,1,0]=4 1521 B10R1.149 N[C@H](CO)c1sccc1Br Amb26636121 [0,1,0,0,0,0|2,0,0]=3 1522 B10R1.149 N[C@H](CO)c1sccc1Cl Amb27834331 [0,1,0,0,0,0|2,0,0]=3 1523 B10R1.149 N[C@H](CO)c1sccc1F Amb27800815 [0,1,0,0,0,0|2,0,0]=3 1524 B10R1.149 N[C@H](CO)c1sccc1I Amb27982358 [0,1,0,0,0,0|2,0,0]=3 1525 B10R1.149 N[C@H](CO)c1sccc1O Amb27231435 [0,1,0,0,0,0|2,0,0]=3 1526 B10R1.149 Nc1ccoc1C(N)CO Amb27640755 [0,1,0,0,0,0|2,1,0]=4 1527 B10R1.149 Nc1ccsc1[C@@H](N)CO Amb28049382 [0,1,0,0,0,0|2,0,0]=3 1528 B10R1.149 Nc1occc1[C@@H](N)CO Amb28315871 [0,1,0,0,0,0|3,0,0]=4 1529 B10R1.149 Nc1sccc1[C@H](N)CO Amb28207833 [0,1,0,0,0,0|3,0,0]=4 1530 B10R1.149 O=C(NO)c1scnc1Cl Amb27980130 [0,1,0,0,0,0|2,0,1]=4 1531 B10R1.149 OC(CBr)c1sccc1Br Amb33387597 [0,1,0,0,0,0|3,0,0]=4 1532 B10R1.149 OC(CBr)c1sccc1Cl Amb33335934 [0,1,0,0,0,0|3,0,0]=4 1533 B10R1.149 OC(CCl)c1sccc1Br Amb33387600 [0,1,0,0,0,0|3,0,0]=4 1534 B10R1.149 OC(CCl)c1sccc1Cl Amb24482216 [0,1,0,0,0,0|3,0,0]=4 1535 B10R1.149 OC(CF)c1sccc1Br Amb33387608 [0,1,0,0,0,0|3,0,0]=4 1536 B10R1.149 OC(CF)c1sccc1Cl Amb33257964 [0,1,0,0,0,0|3,0,0]=4 1537 B10R1.149 OCC(O)c1sccc1Br Amb27775559 [0,1,0,0,0,0|2,0,0]=3 1538 B10R1.149 OCC(O)c1sccc1Cl Amb33456766 [0,1,0,0,0,0|2,0,0]=3 1539 B10R1.149 [C-]#[N+]C(C)c1sccc1C Amb33203311 [0,1,0,0,0,0|3,0,0]=4 1540 B10R1.149 [C-]#[N+]C(C)c1scnc1C Amb32876037 [0,1,0,0,0,0|2,0,0]=3 1541 B10R1.187 CC1=C(CCO)C(=O)CC1 Amb27192282 [0,1,0,0,0,0|2,0,1]=4 1542 B10R1.187 CC1=C(CCO)C(=O)N=N1 Amb27668019 [0,1,0,0,0,0|2,0,0]=3 1543 B10R1.187 CC1=C(CCO)C(=O)NN1 Amb19329459 [0,1,0,0,0,0|2,0,1]=4 1544 B10R1.187 CC1=NNC(=O)C1CCO Amb9716193 [0,1,0,0,0,0|2,0,1]=4 1545 B10R1.187 CC1=NNC(=O)N1CCO Amb27604382 [0,1,0,0,0,0|3,0,0]=4 1546 B10R1.187 CCCc1c(Br)cnn1C Amb25675768 [0,1,0,0,0,0|3,0,0]=4 1547 B10R1.187 CCCc1c(C)noc1N Amb23503965 [0,1,0,0,0,0|3,0,0]=4 1548 B10R1.187 CCCc1c(C)noc1O Amb6537620 [0,1,0,0,0,0|3,0,0]=4 1549 B10R1.187 CCCc1c(Cl)cnn1C Amb33188878 [0,1,0,0,0,0|3,0,0]=4 1550 B10R1.187 CCCc1c(N)cnn1C Amb26991300 [0,1,0,0,0,0|3,0,0]=4 1551 B10R1.187 Cc1ccc(C)n1CCO Amb6739952 [0,1,0,0,0,0|3,0,0]=4 1552 B10R1.187 Cc1ccn(C)c1CCN Amb18202996 [0,1,0,0,0,0|3,0,0]=4 1553 B10R1.187 Cc1cnc(C)n1CCN Amb27422883 [0,1,0,0,0,0|3,0,0]=4 1554 B10R1.187 Cc1cnc(N)n1CCO Amb27166295 [0,1,0,0,0,0|3,0,0]=4 1555 B10R1.187 Cc1cnc(O)n1CCO Amb27202165 [0,1,0,0,0,0|3,0,0]=4 1556 B10R1.187 Cc1cnn(C)c1CCBr Amb26367694 [0,1,0,0,0,0|3,0,0]=4 1557 B10R1.187 Cc1cnn(C)c1CCN Amb18831985 [0,1,0,0,0,0|3,0,0]=4 1558 B10R1.187 Cc1cnn(C)c1CCO Amb24428519 [0,1,0,0,0,0|2,0,0]=3 1559 B10R1.187 Cc1cnn(C)c1CCS Amb33320110 [0,1,0,0,0,0|2,1,0]=4 1560 B10R1.187 Cc1cnn(C)c1CNO Amb24589947 [0,1,0,0,0,0|3,0,0]=4 1561 B10R1.187 Cc1csc(C)c1CCO Amb32950332 [0,1,0,0,0,0|2,0,0]=3 1562 B10R1.187 Cc1ncc(Cl)n1CCN Amb27230100 [0,1,0,0,0,0|3,0,0]=4 1563 B10R1.187 Cc1ncc(N)n1CCO Amb9782472 [0,1,0,0,0,0|2,0,0]=3 1564 B10R1.187 Cc1ncn(C)c1CC#N Amb27596563 [0,1,0,0,0,0|2,0,1]=4 1565 B10R1.187 Cc1noc(C)c1CCBr Amb535330 [0,1,0,0,0,0|3,0,0]=4 1566 B10R1.187 Cc1noc(C)c1CCCl Amb2228628 [0,1,0,0,0,0|3,0,0]=4 1567 B10R1.187 Cc1noc(C)c1CCN Amb22587648 [0,1,0,0,0,0|3,0,0]=4 1568 B10R1.187 Cc1noc(C)c1CCN Amb6356024 [0,1,0,0,0,0|3,0,0]=4 1569 B10R1.187 Cc1noc(C)c1CCO Amb6740587 [0,1,0,0,0,0|2,0,0]=3 1570 B10R1.187 Cc1noc(C)c1CCS Amb9173920 [0,1,0,0,0,0|2,1,0]=4 1571 B10R1.187 Cc1noc(C)c1CNO Amb24334477 [0,1,0,0,0,0|3,0,0]=4 1572 B10R1.187 Cc1nsc(C)c1CCN Amb18200106 [0,1,0,0,0,0|3,0,0]=4 1573 B10R1.187 Cc1onc(O)c1CCO Amb28119271 [0,1,0,0,0,0|3,0,0]=4 1574 B10R1.187 Cn1cnc(Cl)c1CCBr Amb33431476 [0,1,0,0,0,0|3,0,0]=4 1575 B10R1.187 Cn1cnc(Cl)c1CCN Amb33056761 [0,1,0,0,0,0|3,0,0]=4 1576 B10R1.187 Cn1cnc(Cl)c1CCO Amb33057121 [0,1,0,0,0,0|2,0,0]=3 1577 B10R1.187 Cn1cnc(Cl)c1CCS Amb33222523 [0,1,0,0,0,0|2,1,0]=4 1578 B10R1.187 Cn1cnc(Cl)c1CNO Amb33056767 [0,1,0,0,0,0|3,0,0]=4 1579 B10R1.187 Cn1cnc(I)c1CCN Amb27181121 [0,1,0,0,0,0|3,0,0]=4 1580 B10R1.187 Cn1cnc(O)c1CCN Amb18831730 [0,1,0,0,0,0|3,0,0]=4 1581 B10R1.187 Cn1ncc(Br)c1CCCl Amb27412750 [0,1,0,0,0,0|3,0,0]=4 1582 B10R1.187 Cn1ncc(Br)c1CCN Amb16185639 [0,1,0,0,0,0|3,0,0]=4 1583 B10R1.187 Cn1ncc(Br)c1CCN Amb24053519 [0,1,0,0,0,0|3,0,0]=4 1584 B10R1.187 Cn1ncc(Br)c1CCO Amb27405432 [0,1,0,0,0,0|2,0,0]=3 1585 B10R1.187 Cn1ncc(Br)c1CNO Amb27205558 [0,1,0,0,0,0|3,0,0]=4 1586 B10R1.187 Cn1ncc(Cl)c1CCBr Amb27880738 [0,1,0,0,0,0|3,0,0]=4 1587 B10R1.187 Cn1ncc(Cl)c1CCO Amb26326741 [0,1,0,0,0,0|2,0,0]=3 1588 B10R1.187 Cn1ncc(N)c1CCF Amb33195725 [0,1,0,0,0,0|3,0,0]=4 1589 B10R1.187 Cn1ncc(N)c1CCN Amb25147504 [0,1,0,0,0,0|3,0,0]=4 1590 B10R1.187 Cn1ncc(N)c1CCO Amb27198532 [0,1,0,0,0,0|2,0,0]=3 1591 B10R1.187 Cn1ncc(O)c1CCN Amb18831752 [0,1,0,0,0,0|3,0,0]=4 1592 B10R1.187 Cn1nnc(Br)c1CCO Amb27175470 [0,1,0,0,0,0|3,0,0]=4 1593 B8R0.1 C=CC\C(C)=C/CCBr Amb28312905 [0,0,1,0,0,0|3,0,0]=4 1594 B8R0.1 C=CC\C(C)=C/CCN Amb27838470 [0,0,1,0,0,0|3,0,0]=4 1595 B8R0.1 CC#C\C(C)=C\CCO Amb28321567 [0,0,1,0,0,0|2,0,1]=4 1596 B8R0.1 C\C(=C/CCO)CCBr Amb27489112 [0,0,1,0,0,0|2,0,1]=4 1597 B8R0.3 CCCC(=O)\C(C)=N\O Amb27627435 [0,0,1,0,0,0|2,1,0]=4 1598 B8R0.3 C\C(CO)=C(/C)CCO Amb17593379 [0,0,1,0,0,0|3,0,0]=4 1599 B8R0.3 C\C(CO)=C(\C)CCO Amb27214011 [0,0,1,0,0,0|3,0,0]=4 1600 B8R0.4 CCCC=C=CCCO Amb17593316 [0,0,1,0,0,0|2,0,1]=4 1601 B8R0.4 CO\C=C\C=C\CCO Amb27660890 [0,0,1,0,0,0|3,0,0]=4 1602 B8R0.4 CO\N=C\CCCCO Amb28049141 [0,0,1,0,0,0|2,0,1]=4 1603 B8R0.4 C\C=C\C=C=CCCO Amb27812339 [0,0,1,0,0,0|2,0,0]=3 1604 B8R0.4 C\C=C\C=C\CCCO Amb17593323 [0,0,1,0,0,0|2,0,1]=4 1605 B8R0.4 C\C=C\C\C=C\CCO Amb27978414 [0,0,1,0,0,0|2,0,1]=4 1606 B8R0.15 C=CN(CCO)C(C)=O Amb24389512 [0,0,1,0,0,0|3,0,0]=4 1607 B8R0.15 CC(=O)\C(CCO)=N\O Amb27256423 [0,0,1,0,0,0|3,0,0]=4 1608 B10R2.2 CC1Cc2ccnn2C1 Amb33715074 [0,0,0,1,0,0|3,0,0]=4 1609 B10R2.2 NC1Cc2nccn2C1 Amb18832948 [0,0,0,1,0,0|3,0,0]=4 1610 B10R2.2 O=C1Cc2ccsc2C1 Amb18203007 [0,0,0,1,0,0|1,0,2]=4 1611 B10R2.2 OC1Cc2ccnn2C1 Amb27838531 [0,0,0,1,0,0|2,0,0]=3 1612 B10R2.2 OC1Cc2nccn2C1 Amb26430255 [0,0,0,1,0,0|2,0,0]=3 1613 B10R2.2 OC1Cc2ncnn2C1 Amb24071786 [0,0,0,1,0,0|2,0,0]=3 1614 B10R2.2 O[C@@H]1Cc2nccn2C1 Amb24068722 [0,0,0,1,0,0|2,0,0]=3 1615 B10R2.2 O[C@H]1Cc2nccn2C1 Amb26564262 [0,0,0,1,0,0|2,0,0]=3 1616 B10R2.7 C1=CC2=C(C1)CCCC2 Amb15692830 [0,0,0,1,0,0|3,0,0]=4 1617 B10R2.7 C1=NC2=COCN=C2S1 Amb26001671 [0,0,0,1,0,0|1,0,1]=3 1618 B10R2.7 C1CNc2snnc2C1 Amb18202716 [0,0,0,1,0,0|3,0,0]=4 1619 B10R2.7 C1Cc2nnsc2CN1 Amb18202718 [0,0,0,1,0,0|3,0,0]=4 1620 B10R2.7 C1Cc2nonc2CN1 Amb18832827 [0,0,0,1,0,0|3,0,0]=4 1621 B10R2.7 C1Cc2snnc2CN1 Amb18202717 [0,0,0,1,0,0|2,0,0]=3 1622 B10R2.7 c1cc2c(o1)CCCC2 Amb25146994 [0,0,0,1,0,0|2,1,0]=4 1623 B10R2.7 c1cc2c(o1)CCNC2 Amb6252739 [0,0,0,1,0,0|2,1,0]=4 1624 B10R2.7 c1cc2c(o1)CNCC2 Amb6252729 [0,0,0,1,0,0|3,0,0]=4 1625 B10R2.7 c1cc2c(s1)CCCC2 Amb22411420 [0,0,0,1,0,0|2,0,0]=3 1626 B10R2.7 c1cc2c(s1)CCCN2 Amb18831964 [0,0,0,1,0,0|3,0,0]=4 1627 B10R2.7 c1cc2c(s1)CCNC2 Amb2371747 [0,0,0,1,0,0|2,0,0]=3 1628 B10R2.7 c1cc2c(s1)CCNC2 Amb6609012 [0,0,0,1,0,0|2,0,0]=3 1629 B10R2.7 c1cc2c(s1)CNCC2 Amb10067653 [0,0,0,1,0,0|3,0,0]=4 1630 B10R2.7 c1cc2c(s1)CNCC2 Amb33542629 [0,0,0,1,0,0|3,0,0]=4 1631 B10R2.7 c1cc2n(n1)CCCC2 Amb24073868 [0,0,0,1,0,0|3,0,0]=4 1632 B10R2.7 c1cn2c(n1)CCCC2 Amb18540667 [0,0,0,1,0,0|3,0,0]=4 1633 B10R2.7 c1cn2c(n1)CNCC2 Amb10067677 [0,0,0,1,0,0|3,0,0]=4 1634 B10R2.7 c1cn2c(n1)CNCC2 Amb17740020 [0,0,0,1,0,0|3,0,0]=4 1635 B10R2.7 c1cn2c(n1)CNCC2 Amb8351633 [0,0,0,1,0,0|3,0,0]=4 1636 B10R2.7 c1cn2c(n1)COCC2 Amb27978721 [0,0,0,1,0,0|2,0,0]=3 1637 B10R2.7 c1nc2c(o1)CCCC2 Amb28125115 [0,0,0,1,0,0|1,1,0]=3 1638 B10R2.7 c1nc2c(o1)CCCN2 Amb27860228 [0,0,0,1,0,0|2,1,0]=4 1639 B10R2.7 c1nc2c(o1)CCNC2 Amb18832907 [0,0,0,1,0,0|1,1,0]=3 1640 B10R2.7 c1nc2c(o1)CCNC2 Amb31198031 [0,0,0,1,0,0|1,1,0]=3 1641 B10R2.7 c1nc2c(o1)CCOC2 Amb28205290 [0,0,0,1,0,0|0,1,0]=2 1642 B10R2.7 c1nc2c(s1)CCCC2 Amb24055433 [0,0,0,1,0,0|1,0,0]=2 1643 B10R2.7 c1nc2c(s1)CCCN2 Amb18202839 [0,0,0,1,0,0|2,0,0]=3 1644 B10R2.7 c1nc2c(s1)CCNC2 Amb18831815 [0,0,0,1,0,0|1,0,0]=2 1645 B10R2.7 c1nc2c(s1)CNCC2 Amb17190919 [0,0,0,1,0,0|2,0,0]=3 1646 B10R2.7 c1nc2c(s1)CNCC2 Amb21857001 [0,0,0,1,0,0|2,0,0]=3 1647 B10R2.7 c1nc2c(s1)CNCC2 Amb32412179 [0,0,0,1,0,0|2,0,0]=3 1648 B10R2.7 c1nc2c(s1)COCC2 Amb23597006 [0,0,0,1,0,0|2,0,0]=3 1649 B10R2.7 c1nc2n(n1)CCCC2 Amb18340979 [0,0,0,1,0,0|3,0,0]=4 1650 B10R2.7 c1nc2n(n1)CCNC2 Amb8629885 [0,0,0,1,0,0|3,0,0]=4 1651 B10R2.7 c1nsc2c1CCCC2 Amb27242837 [0,0,0,1,0,0|3,0,0]=4 1652 B10R2.7 c1nsc2c1CNCC2 Amb18202841 [0,0,0,1,0,0|3,0,0]=4 1653 B10R2.7 c1onc2c1CCNC2 Amb18832903 [0,0,0,1,0,0|3,0,0]=4 1654 B10R2.7 c1snc2c1CCNC2 Amb18831801 [0,0,0,1,0,0|3,0,0]=4 1655 B10R2.21 Brc1ccsc1C2CO2 Amb24452268 [0,0,0,1,0,0|2,0,0]=3 1656 B10R2.21 Brc1ccsc1[C@@H]2CO2 Amb27878862 [0,0,0,1,0,0|2,0,0]=3 1657 B10R2.21 Brc1ccsc1[C@H]2CO2 Amb27445424 [0,0,0,1,0,0|2,0,0]=3 1658 B10R2.21 Brc1ncoc1C2CC2 Amb35747102 [0,0,0,1,0,0|2,1,0]=4 1659 B10R2.21 Brc1ncsc1C2CC2 Amb18785177 [0,0,0,1,0,0|2,0,0]=3 1660 B10R2.21 Cc1ccoc1C2CO2 Amb33343955 [0,0,0,1,0,0|1,1,0]=3 1661 B10R2.21 Cc1ccoc1[C@@H]2CO2 Amb33342409 [0,0,0,1,0,0|1,1,0]=3 1662 B10R2.21 Cc1ccoc1[C@H]2CO2 Amb33342496 [0,0,0,1,0,0|1,1,0]=3 1663 B10R2.21 Cc1ccsc1C2CO2 Amb28124553 [0,0,0,1,0,0|1,0,0]=2 1664 B10R2.21 Cc1ccsc1[C@@H]2CO2 Amb25975847 [0,0,0,1,0,0|1,0,0]=2 1665 B10R2.21 Cc1ccsc1[C@H]2CO2 Amb27180500 [0,0,0,1,0,0|1,0,0]=2 1666 B10R2.21 Cc1cscc1C2CO2 Amb33146700 [0,0,0,1,0,0|3,0,0]=4 1667 B10R2.21 Cc1cscc1[C@@H]2CO2 Amb33144394 [0,0,0,1,0,0|3,0,0]=4 1668 B10R2.21 Cc1cscc1[C@H]2CO2 Amb33144395 [0,0,0,1,0,0|3,0,0]=4 1669 B10R2.21 Cc1ncsc1C2CO2 Amb27400942 [0,0,0,1,0,0|0,0,0]=1 1670 B10R2.21 Cc1ncsc1[C@@H]2CO2 Amb33271155 [0,0,0,1,0,0|0,0,0]=1 1671 B10R2.21 Cc1ncsc1[C@H]2CO2 Amb33271156 [0,0,0,1,0,0|0,0,0]=1 1672 B10R2.21 Cc1occc1C2CO2 Amb24532881 [0,0,0,1,0,0|2,0,0]=3 1673 B10R2.21 Cc1occc1[C@@H]2CO2 Amb33273991 [0,0,0,1,0,0|2,0,0]=3 1674 B10R2.21 Cc1occc1[C@H]2CO2 Amb33273992 [0,0,0,1,0,0|2,0,0]=3 1675 B10R2.21 Cc1oncc1C2CO2 Amb26569568 [0,0,0,1,0,0|3,0,0]=4 1676 B10R2.21 Cc1oncc1[C@@H]2CO2 Amb33361084 [0,0,0,1,0,0|3,0,0]=4 1677 B10R2.21 Cc1oncc1[C@H]2CO2 Amb33361086 [0,0,0,1,0,0|3,0,0]=4 1678 B10R2.21 Clc1ccsc1C2CO2 Amb33257483 [0,0,0,1,0,0|2,0,0]=3 1679 B10R2.21 Clc1ccsc1[C@@H]2CO2 Amb33258283 [0,0,0,1,0,0|2,0,0]=3 1680 B10R2.21 Clc1ccsc1[C@H]2CO2 Amb33258280 [0,0,0,1,0,0|2,0,0]=3 1681 B10R2.21 Cn1cccc1C2CO2 Amb25877695 [0,0,0,1,0,0|3,0,0]=4 1682 B10R2.21 Cn1cccc1[C@@H]2CO2 Amb33374256 [0,0,0,1,0,0|3,0,0]=4 1683 B10R2.21 Cn1cccc1[C@H]2CO2 Amb33374257 [0,0,0,1,0,0|3,0,0]=4 1684 B10R2.21 Cn1ccnc1[C@@H]2CO2 Amb33426581 [0,0,0,1,0,0|3,0,0]=4 1685 B10R2.21 Cn1ccnc1[C@H]2CO2 Amb33426583 [0,0,0,1,0,0|3,0,0]=4 1686 B10R2.21 Cn1nccc1C2CC2 Amb6890440 [0,0,0,1,0,0|3,0,0]=4 1687 B10R2.21 Cn1nccc1C2CO2 Amb33456888 [0,0,0,1,0,0|2,0,0]=3 1688 B10R2.21 Cn1nccc1[C@@H]2CO2 Amb24412663 [0,0,0,1,0,0|2,0,0]=3 1689 B10R2.21 Cn1nccc1[C@H]2CO2 Amb28454072 [0,0,0,1,0,0|2,0,0]=3 1690 B10R2.21 Cn1nncc1C2CO2 Amb33145960 [0,0,0,1,0,0|3,0,0]=4 1691 B10R2.21 Cn1nncc1[C@@H]2CO2 Amb33144486 [0,0,0,1,0,0|3,0,0]=4 1692 B10R2.21 Cn1nncc1[C@H]2CO2 Amb33144488 [0,0,0,1,0,0|3,0,0]=4 1693 B10R2.21 Nc1ncsc1C2CC2 Amb24317508 [0,0,0,1,0,0|2,0,0]=3 1694 B10R2.21 Nc1ncsc1C2CC2 Amb30585219 [0,0,0,1,0,0|2,0,0]=3 1695 B10R2.32 Brc1occ2c1CCO2 Amb18187193 [0,0,0,1,0,0|3,0,0]=4 1696 B10R2.32 Brc1scc2c1CCO2 Amb18782411 [0,0,0,1,0,0|3,0,0]=4 1697 B10R2.32 Cc1ccn2c1CCC2 Amb27423615 [0,0,0,1,0,0|3,0,0]=4 1698 B10R2.32 Cn1ncc2c1CCN2 Amb18832950 [0,0,0,1,0,0|3,0,0]=4 1699 B10R1.4 BrCCc1cccnc1Br Amb33389472 [0,0,0,0,0,1|3,0,0]=4 1700 B10R1.4 BrCCc1ccncc1Br Amb33242646 [0,0,0,0,0,1|3,0,0]=4 1701 B10R1.4 C#CCc1cccnc1C Amb32878982 [0,0,0,0,0,1|2,0,1]=4 1702 B10R1.4 C#CCc1ccncc1C Amb33424639 [0,0,0,0,0,1|2,0,1]=4 1703 B10R1.4 C#CCc1cncnc1C Amb33268112 [0,0,0,0,0,1|2,0,1]=4 1704 B10R1.4 C#CCc1nccnc1C Amb33142189 [0,0,0,0,0,1|2,0,1]=4 1705 B10R1.4 CC1=C(CCCl)SCCO1 Amb27233584 [0,0,0,0,0,1|2,0,1]=4 1706 B10R1.4 CCCc1ccccc1C Amb22227985 [0,0,0,0,0,1|3,0,0]=4 1707 B10R1.4 CCCc1cccnc1Br Amb24319271 [0,0,0,0,0,1|3,0,0]=4 1708 B10R1.4 CCCc1cccnc1Cl Amb24319272 [0,0,0,0,0,1|3,0,0]=4 1709 B10R1.4 CCCc1cccnc1N Amb8386852 [0,0,0,0,0,1|3,0,0]=4 1710 B10R1.4 CCCc1cccnc1O Amb24319273 [0,0,0,0,0,1|3,0,0]=4 1711 B10R1.4 CCCc1ccncc1Br Amb24320559 [0,0,0,0,0,1|3,0,0]=4 1712 B10R1.4 CCCc1ccncc1N Amb18203088 [0,0,0,0,0,1|3,0,0]=4 1713 B10R1.4 CCCc1cnccc1C Amb26366029 [0,0,0,0,0,1|3,0,0]=4 1714 B10R1.4 CCCc1cncnc1Br Amb24323117 [0,0,0,0,0,1|3,0,0]=4 1715 B10R1.4 CCCc1cncnc1Cl Amb10607977 [0,0,0,0,0,1|3,0,0]=4 1716 B10R1.4 CCCc1cncnc1N Amb25756869 [0,0,0,0,0,1|3,0,0]=4 1717 B10R1.4 CCCc1ncccc1C Amb28293496 [0,0,0,0,0,1|3,0,0]=4 1718 B10R1.4 CCCc1nccnc1Br Amb27958765 [0,0,0,0,0,1|3,0,0]=4 1719 B10R1.4 CCCc1nccnc1C Amb8515907 [0,0,0,0,0,1|2,0,0]=3 1720 B10R1.4 CCCc1nccnc1Cl Amb27955319 [0,0,0,0,0,1|3,0,0]=4 1721 B10R1.4 CCCc1nccnc1F Amb35598360 [0,0,0,0,0,1|3,0,0]=4 1722 B10R1.4 CCCc1nccnc1I Amb35598358 [0,0,0,0,0,1|3,0,0]=4 1723 B10R1.4 CCCc1nccnc1N Amb27393644 [0,0,0,0,0,1|3,0,0]=4 1724 B10R1.4 CCCc1nccnc1O Amb18643252 [0,0,0,0,0,1|3,0,0]=4 1725 B10R1.4 CCCc1nccnc1S Amb35602544 [0,0,0,0,0,1|3,0,0]=4 1726 B10R1.4 CCCc1ncncc1Br Amb10068152 [0,0,0,0,0,1|3,0,0]=4 1727 B10R1.4 CCNc1cccnc1C Amb27224954 [0,0,0,0,0,1|3,0,0]=4 1728 B10R1.4 CCNc1cncnc1C Amb22271030 [0,0,0,0,0,1|3,0,0]=4 1729 B10R1.4 CCNc1nccnc1C Amb24459938 [0,0,0,0,0,1|3,0,0]=4 1730 B10R1.4 CCOc1cccnc1C Amb24057152 [0,0,0,0,0,1|3,0,0]=4 1731 B10R1.4 CCOc1nccnc1C Amb8384177 [0,0,0,0,0,1|3,0,0]=4 1732 B10R1.4 CCSc1ccncc1C Amb28386407 [0,0,0,0,0,1|3,0,0]=4 1733 B10R1.4 CNCc1cccnc1C Amb18216945 [0,0,0,0,0,1|3,0,0]=4 1734 B10R1.4 CNCc1ccncc1C Amb10607510 [0,0,0,0,0,1|3,0,0]=4 1735 B10R1.4 CNCc1ccncc1C Amb8503308 [0,0,0,0,0,1|3,0,0]=4 1736 B10R1.4 CNCc1cncnc1C Amb26980689 [0,0,0,0,0,1|3,0,0]=4 1737 B10R1.4 CSCc1ccncc1C Amb27851528 [0,0,0,0,0,1|3,0,0]=4 1738 B10R1.4 C[n+]1ccccc1CCO Amb27173561 [0,0,0,0,0,1|3,0,0]=4 1739 B10R1.4 Cc1ccccc1CCBr Amb2685163 [0,0,0,0,0,1|3,0,0]=4 1740 B10R1.4 Cc1ccccc1CCCl Amb9004323 [0,0,0,0,0,1|3,0,0]=4 1741 B10R1.4 Cc1ccccc1CCI Amb27246006 [0,0,0,0,0,1|3,0,0]=4 1742 B10R1.4 Cc1ccccc1CCN Amb1212557 [0,0,0,0,0,1|3,0,0]=4 1743 B10R1.4 Cc1ccccc1CCN Amb20622598 [0,0,0,0,0,1|3,0,0]=4 1744 B10R1.4 Cc1ccccc1CCO Amb3939095 [0,0,0,0,0,1|2,0,0]=3 1745 B10R1.4 Cc1ccccc1CCS Amb17399938 [0,0,0,0,0,1|2,1,0]=4 1746 B10R1.4 Cc1ccccc1CNO Amb25343987 [0,0,0,0,0,1|3,0,0]=4 1747 B10R1.4 Cc1cccnc1CCBr Amb24641164 [0,0,0,0,0,1|3,0,0]=4 1748 B10R1.4 Cc1cccnc1CCI Amb35711451 [0,0,0,0,0,1|3,0,0]=4 1749 B10R1.4 Cc1cccnc1CCN Amb1995200 [0,0,0,0,0,1|3,0,0]=4 1750 B10R1.4 Cc1cccnc1CCN Amb32662795 [0,0,0,0,0,1|3,0,0]=4 1751 B10R1.4 Cc1cccnc1CCN Amb32664156 [0,0,0,0,0,1|3,0,0]=4 1752 B10R1.4 Cc1cccnc1CCO Amb2694545 [0,0,0,0,0,1|2,0,0]=3 1753 B10R1.4 Cc1cccnc1CCS Amb33361011 [0,0,0,0,0,1|2,1,0]=4 1754 B10R1.4 Cc1cccnc1CNO Amb33429076 [0,0,0,0,0,1|3,0,0]=4 1755 B10R1.4 Cc1ccncc1CCBr Amb24693233 [0,0,0,0,0,1|3,0,0]=4 1756 B10R1.4 Cc1ccncc1CCCl Amb27875306 [0,0,0,0,0,1|3,0,0]=4 1757 B10R1.4 Cc1ccncc1CCN Amb18832435 [0,0,0,0,0,1|3,0,0]=4 1758 B10R1.4 Cc1ccncc1CCO Amb27467536 [0,0,0,0,0,1|2,0,0]=3 1759 B10R1.4 Cc1ccncc1CCS Amb33375261 [0,0,0,0,0,1|2,1,0]=4 1760 B10R1.4 Cc1ccncc1CNO Amb25135601 [0,0,0,0,0,1|3,0,0]=4 1761 B10R1.4 Cc1cnccc1CC=O Amb25368595 [0,0,0,0,0,1|1,0,2]=4 1762 B10R1.4 Cc1cnccc1CCBr Amb24548352 [0,0,0,0,0,1|2,0,0]=3 1763 B10R1.4 Cc1cnccc1CCN Amb22059435 [0,0,0,0,0,1|2,0,0]=3 1764 B10R1.4 Cc1cnccc1CCO Amb26539673 [0,0,0,0,0,1|1,0,0]=2 1765 B10R1.4 Cc1cnccc1CCS Amb25197336 [0,0,0,0,0,1|1,1,0]=3 1766 B10R1.4 Cc1cnccc1CNN Amb26516871 [0,0,0,0,0,1|3,0,0]=4 1767 B10R1.4 Cc1cnccc1CNO Amb26925533 [0,0,0,0,0,1|2,0,0]=3 1768 B10R1.4 Cc1cnccc1CON Amb33079980 [0,0,0,0,0,1|3,0,0]=4 1769 B10R1.4 Cc1cnccc1\C=N\O Amb27963736 [0,0,0,0,0,1|2,0,1]=4 1770 B10R1.4 Cc1cncnc1\C=N\O Amb24518427 [0,0,0,0,0,1|2,0,1]=4 1771 B10R1.4 Cc1ncccc1CC#N Amb18851748 [0,0,0,0,0,1|2,0,1]=4 1772 B10R1.4 Cc1ncccc1CC=O Amb32879665 [0,0,0,0,0,1|1,0,2]=4 1773 B10R1.4 Cc1ncccc1CCBr Amb33432583 [0,0,0,0,0,1|2,0,0]=3 1774 B10R1.4 Cc1ncccc1CCN Amb18203091 [0,0,0,0,0,1|2,0,0]=3 1775 B10R1.4 Cc1ncccc1CCO Amb24061576 [0,0,0,0,0,1|1,0,0]=2 1776 B10R1.4 Cc1ncccc1CCS Amb32878314 [0,0,0,0,0,1|1,1,0]=3 1777 B10R1.4 Cc1ncccc1CNN Amb24596259 [0,0,0,0,0,1|3,0,0]=4 1778 B10R1.4 Cc1ncccc1CNO Amb32880816 [0,0,0,0,0,1|2,0,0]=3 1779 B10R1.4 Cc1ncccc1CON Amb28144547 [0,0,0,0,0,1|3,0,0]=4 1780 B10R1.4 Cc1nccnc1CC#N Amb24614930 [0,0,0,0,0,1|2,0,1]=4 1781 B10R1.4 Cc1nccnc1CC=O Amb33142538 [0,0,0,0,0,1|1,0,2]=4 1782 B10R1.4 Cc1nccnc1CCBr Amb28066231 [0,0,0,0,0,1|2,0,0]=3 1783 B10R1.4 Cc1nccnc1CCN Amb18832320 [0,0,0,0,0,1|2,0,0]=3 1784 B10R1.4 Cc1nccnc1CCO Amb2695470 [0,0,0,0,0,1|1,0,0]=2 1785 B10R1.4 Cc1nccnc1CCS Amb24478509 [0,0,0,0,0,1|1,1,0]=3 1786 B10R1.4 Cc1nccnc1CNN Amb33456733 [0,0,0,0,0,1|3,0,0]=4 1787 B10R1.4 Cc1nccnc1CNO Amb33143106 [0,0,0,0,0,1|2,0,0]=3 1788 B10R1.4 Cc1nccnc1CON Amb33142991 [0,0,0,0,0,1|3,0,0]=4 1789 B10R1.4 Cc1nccnc1\C=N/O Amb22900074 [0,0,0,0,0,1|2,0,1]=4 1790 B10R1.4 Cc1nccnc1\C=N\O Amb26953186 [0,0,0,0,0,1|2,0,1]=4 1791 B10R1.4 Cc1ncncc1CC#N Amb27423367 [0,0,0,0,0,1|2,0,1]=4 1792 B10R1.4 Cc1ncncc1CC=O Amb33268106 [0,0,0,0,0,1|1,0,2]=4 1793 B10R1.4 Cc1ncncc1CCBr Amb33006843 [0,0,0,0,0,1|2,0,0]=3 1794 B10R1.4 Cc1ncncc1CCN Amb18832325 [0,0,0,0,0,1|2,0,0]=3 1795 B10R1.4 Cc1ncncc1CCO Amb24063133 [0,0,0,0,0,1|1,0,0]=2 1796 B10R1.4 Cc1ncncc1CCS Amb32876670 [0,0,0,0,0,1|1,1,0]=3 1797 B10R1.4 Cc1ncncc1CNN Amb27959644 [0,0,0,0,0,1|3,0,0]=4 1798 B10R1.4 Cc1ncncc1CNO Amb33266582 [0,0,0,0,0,1|2,0,0]=3 1799 B10R1.4 Cc1ncncc1CON Amb33268118 [0,0,0,0,0,1|3,0,0]=4 1800 B10R1.4 Cc1ncnnc1CCN Amb27865321 [0,0,0,0,0,1|2,0,0]=3 1801 B10R1.4 Cc1nncnc1CCN Amb25377848 [0,0,0,0,0,1|2,0,0]=3 1802 B10R1.4 ClCCc1cccnc1Cl Amb33329271 [0,0,0,0,0,1|3,0,0]=4 1803 B10R1.4 ClCCc1ccncc1Cl Amb27615771 [0,0,0,0,0,1|3,0,0]=4 1804 B10R1.4 ClCCc1cncnc1Cl Amb24373187 [0,0,0,0,0,1|3,0,0]=4 1805 B10R1.4 Clc1cnccc1CCBr Amb25076266 [0,0,0,0,0,1|3,0,0]=4 1806 B10R1.4 Clc1ncccc1CCBr Amb33389001 [0,0,0,0,0,1|3,0,0]=4 1807 B10R1.4 Fc1cnccc1CCBr Amb25172854 [0,0,0,0,0,1|3,0,0]=4 1808 B10R1.4 Fc1cnccc1CCS Amb33316476 [0,0,0,0,0,1|2,1,0]=4 1809 B10R1.4 Fc1ncccc1CCBr Amb33450421 [0,0,0,0,0,1|3,0,0]=4 1810 B10R1.4 Fc1ncccc1CCS Amb33376783 [0,0,0,0,0,1|2,1,0]=4 1811 B10R1.4 NCCc1cccnc1Br Amb25190186 [0,0,0,0,0,1|3,0,0]=4 1812 B10R1.4 NCCc1cccnc1Cl Amb24551153 [0,0,0,0,0,1|3,0,0]=4 1813 B10R1.4 NCCc1cccnc1Cl Amb33299325 [0,0,0,0,0,1|3,0,0]=4 1814 B10R1.4 NCCc1cccnc1F Amb24062493 [0,0,0,0,0,1|3,0,0]=4 1815 B10R1.4 NCCc1cccnc1N Amb25714008 [0,0,0,0,0,1|3,0,0]=4 1816 B10R1.4 NCCc1cccnc1O Amb26550960 [0,0,0,0,0,1|3,0,0]=4 1817 B10R1.4 NCCc1ccncc1Br Amb26565968 [0,0,0,0,0,1|3,0,0]=4 1818 B10R1.4 NCCc1ccncc1Cl Amb23596506 [0,0,0,0,0,1|3,0,0]=4 1819 B10R1.4 NCCc1ccncc1F Amb24383725 [0,0,0,0,0,1|3,0,0]=4 1820 B10R1.4 NCCc1ccncc1N Amb28423471 [0,0,0,0,0,1|3,0,0]=4 1821 B10R1.4 NCCc1cncnc1Cl Amb18830516 [0,0,0,0,0,1|3,0,0]=4 1822 B10R1.4 NCCc1cncnc1N Amb18832166 [0,0,0,0,0,1|3,0,0]=4 1823 B10R1.4 NCCc1cncnc1O Amb18832090 [0,0,0,0,0,1|3,0,0]=4 1824 B10R1.4 NCCc1ncncc1Br Amb27857057 [0,0,0,0,0,1|3,0,0]=4 1825 B10R1.4 NCCc1ncncc1Cl Amb28280690 [0,0,0,0,0,1|3,0,0]=4 1826 B10R1.4 Nc1ccccc1CCO Amb33733822 [0,0,0,0,0,1|3,0,0]=4 1827 B10R1.4 Nc1ccccc1CCO Amb4605841 [0,0,0,0,0,1|3,0,0]=4 1828 B10R1.4 Nc1cccnc1CCO Amb26398866 [0,0,0,0,0,1|3,0,0]=4 1829 B10R1.4 Nc1ccncc1CCO Amb24062498 [0,0,0,0,0,1|3,0,0]=4 1830 B10R1.4 Nc1ncccc1CCCl Amb27256835 [0,0,0,0,0,1|3,0,0]=4 1831 B10R1.4 Nc1ncccc1CCO Amb21858404 [0,0,0,0,0,1|2,0,0]=3 1832 B10R1.4 O=C1C=NC=CN1CCO Amb27206460 [0,0,0,0,0,1|3,0,0]=4 1833 B10R1.4 O=C1NC=CC=C1CCO Amb27241736 [0,0,0,0,0,1|2,0,1]=4 1834 B10R1.4 OCCc1ccccc1Br Amb3939212 [0,0,0,0,0,1|3,0,0]=4 1835 B10R1.4 OCCc1ccccc1Cl Amb3939106 [0,0,0,0,0,1|3,0,0]=4 1836 B10R1.4 OCCc1ccccc1F Amb2688283 [0,0,0,0,0,1|3,0,0]=4 1837 B10R1.4 OCCc1ccccc1I Amb22753529 [0,0,0,0,0,1|3,0,0]=4 1838 B10R1.4 OCCc1ccccc1O Amb3940101 [0,0,0,0,0,1|3,0,0]=4 1839 B10R1.4 OCCc1cccnc1Br Amb27200606 [0,0,0,0,0,1|2,0,0]=3 1840 B10R1.4 OCCc1cccnc1Cl Amb28050705 [0,0,0,0,0,1|2,0,0]=3 1841 B10R1.4 OCCc1cccnc1F Amb24513826 [0,0,0,0,0,1|2,0,0]=3 1842 B10R1.4 OCCc1ccncc1Br Amb24482101 [0,0,0,0,0,1|2,0,0]=3 1843 B10R1.4 OCCc1ccncc1Cl Amb25890041 [0,0,0,0,0,1|2,0,0]=3 1844 B10R1.4 OCCc1ccncc1F Amb25776747 [0,0,0,0,0,1|2,0,0]=3 1845 B10R1.4 OCCc1cnccc1F Amb25865877 [0,0,0,0,0,1|3,0,0]=4 1846 B10R1.4 OCCc1ncccc1Br Amb22896751 [0,0,0,0,0,1|3,0,0]=4 1847 B10R1.4 OCCc1ncccc1Cl Amb28288389 [0,0,0,0,0,1|3,0,0]=4 1848 B10R1.4 OCCc1ncccc1F Amb26024787 [0,0,0,0,0,1|3,0,0]=4 1849 B10R1.4 ONCc1cccnc1Br Amb33387397 [0,0,0,0,0,1|3,0,0]=4 1850 B10R1.4 ONCc1cccnc1Cl Amb21847006 [0,0,0,0,0,1|3,0,0]=4 1851 B10R1.4 ONCc1cccnc1F Amb33378660 [0,0,0,0,0,1|3,0,0]=4 1852 B10R1.4 ONCc1ccncc1Br Amb33242569 [0,0,0,0,0,1|3,0,0]=4 1853 B10R1.4 ONCc1ccncc1Cl Amb33052755 [0,0,0,0,0,1|3,0,0]=4 1854 B10R1.4 ONCc1ccncc1F Amb33318031 [0,0,0,0,0,1|3,0,0]=4 1855 B10R1.4 SCCc1cccnc1Br Amb33388044 [0,0,0,0,0,1|2,1,0]=4 1856 B10R1.4 SCCc1cccnc1Cl Amb33257708 [0,0,0,0,0,1|2,1,0]=4 1857 B10R1.4 SCCc1ccncc1Br Amb33389013 [0,0,0,0,0,1|2,1,0]=4 1858 B10R1.4 SCCc1ccncc1Cl Amb33413845 [0,0,0,0,0,1|2,1,0]=4 1859 B10R1.4 SCCc1nccnc1Cl Amb26940275 [0,0,0,0,0,1|2,1,0]=4 1860 B10R1.4 [C-]#[N+]Cc1cccnc1C Amb23591032 [0,0,0,0,0,1|3,0,0]=4 1861 B10R1.4 [C-]#[N+]Cc1ccncc1C Amb23591038 [0,0,0,0,0,1|3,0,0]=4 1862 B10R1.4 [C-]#[N+]Cc1cncnc1C Amb33465811 [0,0,0,0,0,1|3,0,0]=4 1863 B10R1.10 C#CCc1ccnc(C)c1 Amb25173946 [0,0,0,0,0,1|2,0,1]=4 1864 B10R1.10 CCCc1cc(Br)ncn1 Amb10600013 [0,0,0,0,0,1|3,0,0]=4 1865 B10R1.10 CCCc1cc(C)ccn1 Amb25844521 [0,0,0,0,0,1|3,0,0]=4 1866 B10R1.10 CCCc1cc(Cl)ncn1 Amb9174458 [0,0,0,0,0,1|3,0,0]=4 1867 B10R1.10 CCCc1cc(F)ncn1 Amb35653805 [0,0,0,0,0,1|3,0,0]=4 1868 B10R1.10 CCCc1cc(N)ncn1 Amb10600014 [0,0,0,0,0,1|3,0,0]=4 1869 B10R1.10 CCCc1cc(O)ncn1 Amb9174445 [0,0,0,0,0,1|3,0,0]=4 1870 B10R1.10 CCCc1cc(S)ncn1 Amb18787529 [0,0,0,0,0,1|3,0,0]=4 1871 B10R1.10 CCCc1cccc(C)c1 Amb22232362 [0,0,0,0,0,1|3,0,0]=4 1872 B10R1.10 CCCc1ccnc(Br)c1 Amb10599856 [0,0,0,0,0,1|3,0,0]=4 1873 B10R1.10 CCCc1ccnc(Br)n1 Amb13884146 [0,0,0,0,0,1|3,0,0]=4 1874 B10R1.10 CCCc1ccnc(Cl)c1 Amb28125661 [0,0,0,0,0,1|3,0,0]=4 1875 B10R1.10 CCCc1ccnc(Cl)n1 Amb10068234 [0,0,0,0,0,1|3,0,0]=4 1876 B10R1.10 CCCc1ccnc(F)c1 Amb27812043 [0,0,0,0,0,1|3,0,0]=4 1877 B10R1.10 CCCc1ccnc(N)c1 Amb2694181 [0,0,0,0,0,1|3,0,0]=4 1878 B10R1.10 CCCc1ccnc(N)n1 Amb13884387 [0,0,0,0,0,1|3,0,0]=4 1879 B10R1.10 CCCc1ccnc(O)c1 Amb10599858 [0,0,0,0,0,1|3,0,0]=4 1880 B10R1.10 CCCc1ccnc(O)n1 Amb13884388 [0,0,0,0,0,1|3,0,0]=4 1881 B10R1.10 CCCc1ncnc(Cl)n1 Amb24319363 [0,0,0,0,0,1|3,0,0]=4 1882 B10R1.10 CCCc1ncnc(N)n1 Amb24319366 [0,0,0,0,0,1|3,0,0]=4 1883 B10R1.10 CCNc1ccnc(C)n1 Amb18964291 [0,0,0,0,0,1|3,0,0]=4 1884 B10R1.10 CCOc1cc(C)ncn1 Amb8386958 [0,0,0,0,0,1|3,0,0]=4 1885 B10R1.10 CCOc1ccnc(C)c1 Amb24687076 [0,0,0,0,0,1|3,0,0]=4 1886 B10R1.10 CCOc1ccnc(C)n1 Amb2610087 [0,0,0,0,0,1|3,0,0]=4 1887 B10R1.10 CCSc1ccnc(C)c1 Amb28252456 [0,0,0,0,0,1|3,0,0]=4 1888 B10R1.10 CCSc1ccnc(C)n1 Amb27777508 [0,0,0,0,0,1|3,0,0]=4 1889 B10R1.10 CNCc1cc(C)ncn1 Amb18964074 [0,0,0,0,0,1|3,0,0]=4 1890 B10R1.10 CNCc1ccnc(C)c1 Amb10607835 [0,0,0,0,0,1|3,0,0]=4 1891 B10R1.10 CNCc1ccnc(C)n1 Amb16187150 [0,0,0,0,0,1|3,0,0]=4 1892 B10R1.10 Cc1cc(CC#N)ccn1 Amb20247909 [0,0,0,0,0,1|2,0,1]=4 1893 B10R1.10 Cc1cc(CC=O)ccn1 Amb32732937 [0,0,0,0,0,1|1,0,2]=4 1894 B10R1.10 Cc1cc(CCBr)ccn1 Amb33004944 [0,0,0,0,0,1|2,0,0]=3 1895 B10R1.10 Cc1cc(CCN)ccn1 Amb18203094 [0,0,0,0,0,1|2,0,0]=3 1896 B10R1.10 Cc1cc(CCN)ccn1 Amb33309646 [0,0,0,0,0,1|2,0,0]=3 1897 B10R1.10 Cc1cc(CCO)ccn1 Amb24568116 [0,0,0,0,0,1|1,0,0]=2 1898 B10R1.10 Cc1cc(CCS)ccn1 Amb32732786 [0,0,0,0,0,1|1,1,0]=3 1899 B10R1.10 Cc1cc(CNN)ccn1 Amb13883480 [0,0,0,0,0,1|3,0,0]=4 1900 B10R1.10 Cc1cc(CNO)ccn1 Amb33449918 [0,0,0,0,0,1|2,0,0]=3 1901 B10R1.10 Cc1cc(CON)ccn1 Amb33172246 [0,0,0,0,0,1|3,0,0]=4 1902 B10R1.10 Cc1cc(\C=N\O)ccn1 Amb22170539 [0,0,0,0,0,1|2,0,1]=4 1903 B10R1.10 Cc1cc(\C=N\O)ncn1 Amb28320384 [0,0,0,0,0,1|2,0,1]=4 1904 B10R1.10 Cc1ccc[n+](CCO)c1 Amb27588939 [0,0,0,0,0,1|3,0,0]=4 1905 B10R1.10 Cc1cccc(CCBr)c1 Amb2685164 [0,0,0,0,0,1|3,0,0]=4 1906 B10R1.10 Cc1cccc(CCBr)n1 Amb2695438 [0,0,0,0,0,1|3,0,0]=4 1907 B10R1.10 Cc1cccc(CCBr)n1 Amb8630116 [0,0,0,0,0,1|3,0,0]=4 1908 B10R1.10 Cc1cccc(CCCl)c1 Amb18181942 [0,0,0,0,0,1|3,0,0]=4 1909 B10R1.10 Cc1cccc(CCI)c1 Amb26332327 [0,0,0,0,0,1|3,0,0]=4 1910 B10R1.10 Cc1cccc(CCN)c1 Amb1126573 [0,0,0,0,0,1|3,0,0]=4 1911 B10R1.10 Cc1cccc(CCN)c1 Amb13952645 [0,0,0,0,0,1|3,0,0]=4 1912 B10R1.10 Cc1cccc(CCN)n1 Amb1995202 [0,0,0,0,0,1|3,0,0]=4 1913 B10R1.10 Cc1cccc(CCN)n1 Amb33378982 [0,0,0,0,0,1|3,0,0]=4 1914 B10R1.10 Cc1cccc(CCN)n1 Amb33378983 [0,0,0,0,0,1|3,0,0]=4 1915 B10R1.10 Cc1cccc(CCO)c1 Amb3939096 [0,0,0,0,0,1|2,0,0]=3 1916 B10R1.10 Cc1cccc(CCO)n1 Amb8630091 [0,0,0,0,0,1|2,0,0]=3 1917 B10R1.10 Cc1cccc(CCS)c1 Amb17399939 [0,0,0,0,0,1|2,1,0]=4 1918 B10R1.10 Cc1cccc(CCS)n1 Amb24388552 [0,0,0,0,0,1|2,1,0]=4 1919 B10R1.10 Cc1cccc(CNO)c1 Amb25784359 [0,0,0,0,0,1|3,0,0]=4 1920 B10R1.10 Cc1cccc(CNO)n1 Amb33200760 [0,0,0,0,0,1|3,0,0]=4 1921 B10R1.10 Cc1ccnc(CCBr)c1 Amb26973853 [0,0,0,0,0,1|3,0,0]=4 1922 B10R1.10 Cc1ccnc(CCN)c1 Amb1995201 [0,0,0,0,0,1|3,0,0]=4 1923 B10R1.10 Cc1ccnc(CCN)n1 Amb17074352 [0,0,0,0,0,1|3,0,0]=4 1924 B10R1.10 Cc1ccnc(CCO)c1 Amb25679639 [0,0,0,0,0,1|2,0,0]=3 1925 B10R1.10 Cc1ccnc(CCO)n1 Amb25943732 [0,0,0,0,0,1|2,0,0]=3 1926 B10R1.10 Cc1ccnc(CCS)c1 Amb33317782 [0,0,0,0,0,1|2,1,0]=4 1927 B10R1.10 Cc1ccnc(CNO)c1 Amb33316100 [0,0,0,0,0,1|3,0,0]=4 1928 B10R1.10 Cc1cncc(CCO)c1 Amb2695472 [0,0,0,0,0,1|3,0,0]=4 1929 B10R1.10 Cc1cncc(CCO)n1 Amb26424098 [0,0,0,0,0,1|3,0,0]=4 1930 B10R1.10 Cc1nccc(CNN)n1 Amb23586398 [0,0,0,0,0,1|3,0,0]=4 1931 B10R1.10 Cc1nccc(CNO)n1 Amb23586397 [0,0,0,0,0,1|2,0,0]=3 1932 B10R1.10 Cc1nccc(\C=N\O)n1 Amb6892095 [0,0,0,0,0,1|2,0,1]=4 1933 B10R1.10 Cc1nncc(CCN)n1 Amb18203025 [0,0,0,0,0,1|3,0,0]=4 1934 B10R1.10 Clc1cc(CCBr)ccn1 Amb33452116 [0,0,0,0,0,1|3,0,0]=4 1935 B10R1.10 NCCc1cc(Cl)ncn1 Amb22411589 [0,0,0,0,0,1|3,0,0]=4 1936 B10R1.10 NCCc1cc(O)ncn1 Amb18223356 [0,0,0,0,0,1|3,0,0]=4 1937 B10R1.10 NCCc1ccnc(Br)c1 Amb26974330 [0,0,0,0,0,1|3,0,0]=4 1938 B10R1.10 NCCc1ccnc(Cl)c1 Amb26080294 [0,0,0,0,0,1|3,0,0]=4 1939 B10R1.10 NCCc1ccnc(F)c1 Amb25992462 [0,0,0,0,0,1|3,0,0]=4 1940 B10R1.10 NCCc1ccnc(N)c1 Amb28555504 [0,0,0,0,0,1|3,0,0]=4 1941 B10R1.10 NCCc1ccnc(N)c1 Amb33532630 [0,0,0,0,0,1|3,0,0]=4 1942 B10R1.10 NCCc1ccnc(N)n1 Amb18203035 [0,0,0,0,0,1|3,0,0]=4 1943 B10R1.10 NCCc1ccnc(O)c1 Amb32670801 [0,0,0,0,0,1|3,0,0]=4 1944 B10R1.10 NCCc1ccnc(O)n1 Amb25377264 [0,0,0,0,0,1|3,0,0]=4 1945 B10R1.10 NCCc1ccnc(O)n1 Amb33457721 [0,0,0,0,0,1|3,0,0]=4 1946 B10R1.10 Nc1cc(CCCl)ccn1 Amb27256820 [0,0,0,0,0,1|3,0,0]=4 1947 B10R1.10 Nc1cc(CCO)ccn1 Amb33545323 [0,0,0,0,0,1|2,0,0]=3 1948 B10R1.10 Nc1cccc(CCO)c1 Amb21857105 [0,0,0,0,0,1|3,0,0]=4 1949 B10R1.10 Nc1cccc(CCO)n1 Amb24401500 [0,0,0,0,0,1|3,0,0]=4 1950 B10R1.10 Nc1ccnc(CCO)c1 Amb25027828 [0,0,0,0,0,1|3,0,0]=4 1951 B10R1.10 Nc1ccnc(CCO)n1 Amb24583224 [0,0,0,0,0,1|3,0,0]=4 1952 B10R1.10 O=C1C=CC=C(CCO)N1 Amb28049556 [0,0,0,0,0,1|3,0,0]=4 1953 B10R1.10 O=C1N=C(CCO)C=CN1 Amb24639313 [0,0,0,0,0,1|2,0,1]=4 1954 B10R1.10 O=C1N=CC=C(OCO)N1 Amb28252484 [0,0,0,0,0,1|3,0,0]=4 1955 B10R1.10 OCCc1cc(Br)ccn1 Amb24065849 [0,0,0,0,0,1|3,0,0]=4 1956 B10R1.10 OCCc1cc(Cl)ccn1 Amb26631453 [0,0,0,0,0,1|3,0,0]=4 1957 B10R1.10 OCCc1cc(F)ccn1 Amb25032462 [0,0,0,0,0,1|3,0,0]=4 1958 B10R1.10 OCCc1cccc(Br)c1 Amb3939211 [0,0,0,0,0,1|3,0,0]=4 1959 B10R1.10 OCCc1cccc(Br)n1 Amb13883481 [0,0,0,0,0,1|3,0,0]=4 1960 B10R1.10 OCCc1cccc(Cl)c1 Amb3939105 [0,0,0,0,0,1|3,0,0]=4 1961 B10R1.10 OCCc1cccc(Cl)n1 Amb27478282 [0,0,0,0,0,1|3,0,0]=4 1962 B10R1.10 OCCc1cccc(F)c1 Amb3939215 [0,0,0,0,0,1|3,0,0]=4 1963 B10R1.10 OCCc1cccc(F)n1 Amb25076783 [0,0,0,0,0,1|3,0,0]=4 1964 B10R1.10 OCCc1cccc(I)c1 Amb24524319 [0,0,0,0,0,1|3,0,0]=4 1965 B10R1.10 OCCc1cccc(O)c1 Amb3940102 [0,0,0,0,0,1|3,0,0]=4 1966 B10R1.10 OCCc1cccc(S)c1 Amb27961582 [0,0,0,0,0,1|3,0,0]=4 1967 B10R1.10 OCCc1ccnc(Cl)c1 Amb22754705 [0,0,0,0,0,1|2,0,0]=3 1968 B10R1.10 OCCc1ccnc(F)c1 Amb27963558 [0,0,0,0,0,1|2,0,0]=3 1969 B10R1.10 OCCc1nccc(O)n1 Amb24454001 [0,0,0,0,0,1|3,0,0]=4 1970 B10R1.10 [C-]#[N+]Cc1ccnc(C)c1 Amb23591039 [0,0,0,0,0,1|3,0,0]=4 1971 B7R0.1 CC=C=C\C=C\CO Amb27853778 [1,0,1,0,0,0|1,0,1]=4 1972 B7R0.1 CCC\C=C/CCO Amb22052625 [1,0,1,0,0,0|1,0,1]=4 1973 B7R0.1 CCC\C=C\CCO Amb22730273 [1,0,1,0,0,0|1,0,1]=4 1974 B7R0.1 CCO\C=C\CCO Amb28189265 [1,0,1,0,0,0|1,0,1]=4 1975 B7R0.1 C\C=C/CCCCO Amb4019856 [1,0,1,0,0,0|1,0,1]=4 1976 B7R0.1 C\C=C\C#CCCO Amb15695309 [1,0,1,0,0,0|1,0,1]=4 1977 B7R0.1 C\C=C\C=C\CCBr Amb28201639 [1,0,1,0,0,0|2,0,0]=4 1978 B7R0.1 C\C=C\C=C\CCC Amb27493119 [1,0,1,0,0,0|2,0,0]=4 1979 B7R0.1 C\C=C\C=C\CCN Amb28245294 [1,0,1,0,0,0|2,0,0]=4 1980 B7R0.1 C\C=C\C=C\CCO Amb27459750 [1,0,1,0,0,0|1,0,0]=3 1981 B7R0.1 C\C=C\CSCCO Amb9362982 [1,0,1,0,0,0|1,0,1]=4 1982 B7R0.1 C\C=C\SSCCC Amb25865705 [1,0,1,0,0,0|2,0,0]=4 1983 B7R0.1 O\C=C\C=C\CCO Amb27605420 [1,0,1,0,0,0|1,1,0]=4 1984 B7R0.3 C#C\C(C)=C\CCO Amb28206463 [1,0,1,0,0,0|1,0,1]=4 1985 B7R0.3 C=C=C(C)CCCO Amb28321385 [1,0,1,0,0,0|1,0,1]=4 1986 B7R0.3 C=C=C(C)OCCO Amb28350116 [1,0,1,0,0,0|2,0,0]=4 1987 B7R0.3 C=C\C(C)=C/CCN Amb27494431 [1,0,1,0,0,0|2,0,0]=4 1988 B7R0.3 C=C\C(C)=C\CCCl Amb28282554 [1,0,1,0,0,0|2,0,0]=4 1989 B7R0.3 CC\C(C)=C/CCO Amb25264354 [1,0,1,0,0,0|1,0,1]=4 1990 B7R0.3 CC\C(C)=C\CCO Amb28388883 [1,0,1,0,0,0|1,0,1]=4 1991 B7R0.3 C\C(C=O)=C/CCO Amb28255738 [1,0,1,0,0,0|0,1,0]=3 1992 B7R0.3 C\C(CCCO)=N/O Amb28207168 [1,0,1,0,0,0|0,1,1]=4 1993 B7R0.3 O=C\C(Br)=C/CCO Amb27841266 [1,0,1,0,0,0|1,1,0]=4 1994 B7R0.3 O=C\C(F)=C\CCO Amb27798298 [1,0,1,0,0,0|1,1,0]=4 1995 B7R0.7 C=CC\C(C)=C\CC Amb26515782 [1,0,1,0,0,0|2,0,0]=4 1996 B7R0.7 CC(=C=CBr)CCO Amb27983700 [1,0,1,0,0,0|2,0,0]=4 1997 B7R0.7 CC(\C=C\Cl)=C/CO Amb27659253 [1,0,1,0,0,0|2,0,0]=4 1998 B7R0.7 CC\C=C(\C)N=C=O Amb27842944 [1,0,1,0,0,0|0,1,1]=4 1999 B7R0.7 C\C=N\N(C)CCO Amb27260211 [1,0,1,0,0,0|2,0,0]=4 2000 B7R0.5 C=C(C)C(=C)CCN Amb33199210 [1,0,1,0,0,0|2,0,0]=4 2001 B7R0.5 C=C(C)C(=O)CCC Amb25862437 [1,0,1,0,0,0|1,1,0]=4 2002 B7R0.5 C=C(C)C(=O)CCN Amb25694471 [1,0,1,0,0,0|1,1,0]=4 2003 B7R0.5 C=C(C)C(=O)NCO Amb6869615 [1,0,1,0,0,0|1,1,0]=4 2004 B7R0.5 C=C(C)C(C)CCO Amb27766618 [1,0,1,0,0,0|1,0,1]=4 2005 B7R0.5 C=C(C)C(N)CCO Amb27391185 [1,0,1,0,0,0|1,0,1]=4 2006 B7R0.5 C=C(C)\C(Br)=C\CO Amb27651853 [1,0,1,0,0,0|1,0,1]=4 2007 B7R0.5 C=C(CCO)C(=O)O Amb27173904 [1,0,1,0,0,0|2,0,0]=4 2008 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [1,0,1,0,0,0|1,1,0]=4 2009 B7R0.5 CC(=O)C(S)CCO Amb25831127 [1,0,1,0,0,0|1,0,1]=4 2010 B7R0.5 CC(C)=C(C)CCO Amb26370445 [1,0,1,0,0,0|1,0,1]=4 2011 B7R0.10 CCC(=O)\C(C)=N/N Amb28126724 [1,0,1,0,0,0|1,1,0]=4 2012 B7R0.10 CCC(=O)\C(C)=N/O Amb10552519 [1,0,1,0,0,0|1,1,0]=4 2013 B7R0.10 CCC(=O)\C(C)=N\C Amb27260482 [1,0,1,0,0,0|0,1,1]=4 2014 B7R0.10 CCC(=O)\C(C)=N\O Amb27460236 [1,0,1,0,0,0|1,1,0]=4 2015 B7R0.10 C\C(=N\O)C(=O)CO Amb28249683 [1,0,1,0,0,0|1,1,0]=4 2016 B7R0.12 C=C=C(CCO)OC Amb17593187 [1,0,1,0,0,0|2,0,0]=4 2017 B7R0.12 C=C=C(CCO)SC Amb17593380 [1,0,1,0,0,0|2,0,0]=4 2018 B7R0.12 C\C=C(/CC)CCO Amb27783044 [1,0,1,0,0,0|1,0,1]=4 2019 B7R0.12 C\C=C(\C=O)CCC Amb27435435 [1,0,1,0,0,0|2,0,0]=4 2020 B7R1.1 BrCc1cccs1 Amb10602501 [2,0,0,0,0,0|2,0,0]=4 2021 B7R1.1 BrCc1cnns1 Amb24442353 [2,0,0,0,0,0|2,0,0]=4 2022 B7R1.1 BrCc1cnns1 Amb32652960 [2,0,0,0,0,0|2,0,0]=4 2023 B7R1.1 BrCc1nncs1 Amb24065108 [2,0,0,0,0,0|2,0,0]=4 2024 B7R1.1 C#Cc1cncs1 Amb24071349 [2,0,0,0,0,0|0,0,2]=4 2025 B7R1.1 C=Cc1cncs1 Amb24395972 [2,0,0,0,0,0|0,0,2]=4 2026 B7R1.1 CCc1ccco1 Amb8393153 [2,0,0,0,0,0|1,1,0]=4 2027 B7R1.1 CCc1cccs1 Amb2687955 [2,0,0,0,0,0|1,0,0]=3 2028 B7R1.1 CCc1ccoc1 Amb28059964 [2,0,0,0,0,0|2,0,0]=4 2029 B7R1.1 CCc1ccsc1 Amb2687956 [2,0,0,0,0,0|2,0,0]=4 2030 B7R1.1 CCc1cnco1 Amb22490969 [2,0,0,0,0,0|0,1,0]=3 2031 B7R1.1 CCc1cncs1 Amb25663104 [2,0,0,0,0,0|0,0,0]=2 2032 B7R1.1 CCc1cnns1 Amb27949026 [2,0,0,0,0,0|1,0,0]=3 2033 B7R1.1 CCc1cnsc1 Amb32670956 [2,0,0,0,0,0|2,0,0]=4 2034 B7R1.1 CCc1cocn1 Amb25073231 [2,0,0,0,0,0|2,0,0]=4 2035 B7R1.1 CCc1cscn1 Amb13884091 [2,0,0,0,0,0|2,0,0]=4 2036 B7R1.1 CCc1nccs1 Amb10601013 [2,0,0,0,0,0|2,0,0]=4 2037 B7R1.1 CCc1nnco1 Amb2208686 [2,0,0,0,0,0|1,1,0]=4 2038 B7R1.1 CCn1ccnc1 Amb7093335 [2,0,0,0,0,0|2,0,0]=4 2039 B7R1.1 CCn1cncn1 Amb8386342 [2,0,0,0,0,0|2,0,0]=4 2040 B7R1.1 CNc1cnco1 Amb22490689 [2,0,0,0,0,0|1,1,0]=4 2041 B7R1.1 CNc1cnco1 Amb25932132 [2,0,0,0,0,0|1,1,0]=4 2042 B7R1.1 CNc1cncs1 Amb22492450 [2,0,0,0,0,0|1,0,0]=3 2043 B7R1.1 CNc1cnns1 Amb24745773 [2,0,0,0,0,0|2,0,0]=4 2044 B7R1.1 CNc1nncs1 Amb18276942 [2,0,0,0,0,0|2,0,0]=4 2045 B7R1.1 COc1cccs1 Amb2689282 [2,0,0,0,0,0|2,0,0]=4 2046 B7R1.1 COc1cncs1 Amb28050388 [2,0,0,0,0,0|1,0,0]=3 2047 B7R1.1 COc1nncs1 Amb19651018 [2,0,0,0,0,0|2,0,0]=4 2048 B7R1.1 CSc1cccs1 Amb2724421 [2,0,0,0,0,0|2,0,0]=4 2049 B7R1.1 CSc1cncs1 Amb26647426 [2,0,0,0,0,0|1,0,0]=3 2050 B7R1.1 ClCc1cccs1 Amb6717230 [2,0,0,0,0,0|2,0,0]=4 2051 B7R1.1 ClCc1cnco1 Amb21520456 [2,0,0,0,0,0|1,1,0]=4 2052 B7R1.1 ClCc1cnco1 Amb33624970 [2,0,0,0,0,0|1,1,0]=4 2053 B7R1.1 ClCc1cncs1 Amb18917909 [2,0,0,0,0,0|1,0,0]=3 2054 B7R1.1 ClCc1cncs1 Amb33550110 [2,0,0,0,0,0|1,0,0]=3 2055 B7R1.1 ClCc1cnns1 Amb22011657 [2,0,0,0,0,0|2,0,0]=4 2056 B7R1.1 ClCc1nncs1 Amb27452934 [2,0,0,0,0,0|2,0,0]=4 2057 B7R1.1 FCc1cccs1 Amb26568225 [2,0,0,0,0,0|2,0,0]=4 2058 B7R1.1 ICc1cnns1 Amb27457314 [2,0,0,0,0,0|2,0,0]=4 2059 B7R1.1 N#Cc1cncs1 Amb10602916 [2,0,0,0,0,0|1,0,1]=4 2060 B7R1.1 NCc1cccs1 Amb20622043 [2,0,0,0,0,0|2,0,0]=4 2061 B7R1.1 NCc1cccs1 Amb2720340 [2,0,0,0,0,0|2,0,0]=4 2062 B7R1.1 NCc1cnco1 Amb10604053 [2,0,0,0,0,0|1,1,0]=4 2063 B7R1.1 NCc1cnco1 Amb23400902 [2,0,0,0,0,0|1,1,0]=4 2064 B7R1.1 NCc1cnco1 Amb8009401 [2,0,0,0,0,0|1,1,0]=4 2065 B7R1.1 NCc1cncs1 Amb1087821 [2,0,0,0,0,0|1,0,0]=3 2066 B7R1.1 NCc1cncs1 Amb13883008 [2,0,0,0,0,0|1,0,0]=3 2067 B7R1.1 NCc1cncs1 Amb13891841 [2,0,0,0,0,0|1,0,0]=3 2068 B7R1.1 NCc1cnns1 Amb26556609 [2,0,0,0,0,0|2,0,0]=4 2069 B7R1.1 NCc1nncs1 Amb23439704 [2,0,0,0,0,0|2,0,0]=4 2070 B7R1.1 NCc1nncs1 Amb30584679 [2,0,0,0,0,0|2,0,0]=4 2071 B7R1.1 O=Cc1cncs1 Amb2455730 [2,0,0,0,0,0|0,0,2]=4 2072 B7R1.1 OCC1=CC=CC1 Amb27457780 [2,0,0,0,0,0|2,0,0]=4 2073 B7R1.1 OCC1=CNNS1 Amb28348522 [2,0,0,0,0,0|1,0,1]=4 2074 B7R1.1 OCc1ccco1 Amb837335 [2,0,0,0,0,0|1,1,0]=4 2075 B7R1.1 OCc1cccs1 Amb837506 [2,0,0,0,0,0|1,0,0]=3 2076 B7R1.1 OCc1ccno1 Amb33531764 [2,0,0,0,0,0|2,0,0]=4 2077 B7R1.1 OCc1ccns1 Amb16185717 [2,0,0,0,0,0|2,0,0]=4 2078 B7R1.1 OCc1ccoc1 Amb837377 [2,0,0,0,0,0|2,0,0]=4 2079 B7R1.1 OCc1ccsc1 Amb837384 [2,0,0,0,0,0|2,0,0]=4 2080 B7R1.1 OCc1cnco1 Amb10070754 [2,0,0,0,0,0|0,1,0]=3 2081 B7R1.1 OCc1cncs1 Amb2455733 [2,0,0,0,0,0|0,0,0]=2 2082 B7R1.1 OCc1cnns1 Amb20241951 [2,0,0,0,0,0|1,0,0]=3 2083 B7R1.1 OCc1cnoc1 Amb22011478 [2,0,0,0,0,0|2,0,0]=4 2084 B7R1.1 OCc1cnon1 Amb22490829 [2,0,0,0,0,0|2,0,0]=4 2085 B7R1.1 OCc1cnsc1 Amb22757389 [2,0,0,0,0,0|2,0,0]=4 2086 B7R1.1 OCc1cnsn1 Amb26654307 [2,0,0,0,0,0|2,0,0]=4 2087 B7R1.1 OCc1cocn1 Amb10071193 [2,0,0,0,0,0|2,0,0]=4 2088 B7R1.1 OCc1cscn1 Amb32652998 [2,0,0,0,0,0|2,0,0]=4 2089 B7R1.1 OCc1cscn1 Amb33531860 [2,0,0,0,0,0|2,0,0]=4 2090 B7R1.1 OCc1nccs1 Amb2723142 [2,0,0,0,0,0|2,0,0]=4 2091 B7R1.1 OCc1ncno1 Amb9421565 [2,0,0,0,0,0|2,0,0]=4 2092 B7R1.1 OCc1ncns1 Amb28071735 [2,0,0,0,0,0|2,0,0]=4 2093 B7R1.1 OCc1nnco1 Amb26393346 [2,0,0,0,0,0|1,1,0]=4 2094 B7R1.1 OCc1nncs1 Amb23437041 [2,0,0,0,0,0|1,0,0]=3 2095 B7R1.1 OCn1ccnc1 Amb5493972 [2,0,0,0,0,0|2,0,0]=4 2096 B7R1.1 OCn1cncn1 Amb1085763 [2,0,0,0,0,0|2,0,0]=4 2097 B7R1.1 SCc1cccs1 Amb3428574 [2,0,0,0,0,0|1,1,0]=4 2098 B7R1.1 SCc1cnco1 Amb32788503 [2,0,0,0,0,0|0,2,0]=4 2099 B7R1.1 SCc1cncs1 Amb18255772 [2,0,0,0,0,0|0,1,0]=3 2100 B7R1.1 [C-]#[N+]c1cncs1 Amb33269805 [2,0,0,0,0,0|1,0,1]=4 2101 B7R1.4 Brc1ncsc1Br Amb20616707 [2,0,0,0,0,0|2,0,0]=4 2102 B7R1.4 CC1=CCN=C1C Amb27463558 [2,0,0,0,0,0|1,0,1]=4 2103 B7R1.4 Cc1ccnn1C Amb1945868 [2,0,0,0,0,0|2,0,0]=4 2104 B7R1.4 Cc1ccoc1C Amb8515826 [2,0,0,0,0,0|1,1,0]=4 2105 B7R1.4 Cc1ccoc1O Amb33343228 [2,0,0,0,0,0|1,1,0]=4 2106 B7R1.4 Cc1ccsc1Br Amb2236394 [2,0,0,0,0,0|2,0,0]=4 2107 B7R1.4 Cc1ccsc1C Amb2447413 [2,0,0,0,0,0|1,0,0]=3 2108 B7R1.4 Cc1ccsc1Cl Amb8396573 [2,0,0,0,0,0|2,0,0]=4 2109 B7R1.4 Cc1ccsc1F Amb27459925 [2,0,0,0,0,0|2,0,0]=4 2110 B7R1.4 Cc1ccsc1I Amb22898804 [2,0,0,0,0,0|2,0,0]=4 2111 B7R1.4 Cc1ccsc1N Amb18679496 [2,0,0,0,0,0|2,0,0]=4 2112 B7R1.4 Cc1ccsc1O Amb24639732 [2,0,0,0,0,0|1,0,0]=3 2113 B7R1.4 Cc1ccsc1S Amb25747282 [2,0,0,0,0,0|1,1,0]=4 2114 B7R1.4 Cc1conc1C Amb27468671 [2,0,0,0,0,0|2,0,0]=4 2115 B7R1.4 Cc1nccn1C Amb2455761 [2,0,0,0,0,0|2,0,0]=4 2116 B7R1.4 Cc1nccn1O Amb27210147 [2,0,0,0,0,0|2,0,0]=4 2117 B7R1.4 Cc1ncoc1Br Amb26896749 [2,0,0,0,0,0|1,1,0]=4 2118 B7R1.4 Cc1ncoc1Br Amb33546754 [2,0,0,0,0,0|1,1,0]=4 2119 B7R1.4 Cc1ncoc1C Amb22396059 [2,0,0,0,0,0|0,1,0]=3 2120 B7R1.4 Cc1ncoc1N Amb22234804 [2,0,0,0,0,0|1,1,0]=4 2121 B7R1.4 Cc1ncsc1Br Amb10067879 [2,0,0,0,0,0|1,0,0]=3 2122 B7R1.4 Cc1ncsc1C Amb2687623 [2,0,0,0,0,0|0,0,0]=2 2123 B7R1.4 Cc1ncsc1I Amb32685565 [2,0,0,0,0,0|1,0,0]=3 2124 B7R1.4 Cc1ncsc1N Amb18943427 [2,0,0,0,0,0|1,0,0]=3 2125 B7R1.4 Cc1ncsc1N Amb28555342 [2,0,0,0,0,0|1,0,0]=3 2126 B7R1.4 Cc1ncsc1O Amb25268351 [2,0,0,0,0,0|0,0,0]=2 2127 B7R1.4 Cc1ncsc1S Amb27184569 [2,0,0,0,0,0|0,1,0]=3 2128 B7R1.4 Cc1nnsc1Br Amb18194447 [2,0,0,0,0,0|2,0,0]=4 2129 B7R1.4 Cc1nnsc1Cl Amb2427257 [2,0,0,0,0,0|2,0,0]=4 2130 B7R1.4 Cc1nnsc1N Amb28383146 [2,0,0,0,0,0|2,0,0]=4 2131 B7R1.4 Cc1nnsc1[S-] Amb22370508 [2,0,0,0,0,0|1,1,0]=4 2132 B7R1.4 Cc1nonc1C Amb1694837 [2,0,0,0,0,0|2,0,0]=4 2133 B7R1.4 Cc1nonc1O Amb1102107 [2,0,0,0,0,0|2,0,0]=4 2134 B7R1.4 Cc1nsnc1C Amb23569556 [2,0,0,0,0,0|2,0,0]=4 2135 B7R1.4 Cc1occc1O Amb25178728 [2,0,0,0,0,0|2,0,0]=4 2136 B7R1.4 Cc1ocnc1Br Amb24357642 [2,0,0,0,0,0|1,1,0]=4 2137 B7R1.4 Cc1ocnc1Br Amb35748154 [2,0,0,0,0,0|1,1,0]=4 2138 B7R1.4 Cc1sccc1Br Amb8393327 [2,0,0,0,0,0|2,0,0]=4 2139 B7R1.4 Cc1sccc1Cl Amb27412961 [2,0,0,0,0,0|2,0,0]=4 2140 B7R1.4 Cc1sccc1F Amb27607081 [2,0,0,0,0,0|2,0,0]=4 2141 B7R1.4 Cc1sccc1I Amb27661837 [2,0,0,0,0,0|2,0,0]=4 2142 B7R1.4 Cc1sccc1N Amb18833056 [2,0,0,0,0,0|2,0,0]=4 2143 B7R1.4 Cc1sccc1N Amb22276099 [2,0,0,0,0,0|2,0,0]=4 2144 B7R1.4 Cc1sccc1O Amb26621113 [2,0,0,0,0,0|2,0,0]=4 2145 B7R1.4 Cc1scnc1Br Amb18824935 [2,0,0,0,0,0|1,0,0]=3 2146 B7R1.4 Cc1scnc1N Amb23504020 [2,0,0,0,0,0|1,0,0]=3 2147 B7R1.4 Cc1scnc1N Amb32668593 [2,0,0,0,0,0|1,0,0]=3 2148 B7R1.4 Cc1snnc1Br Amb18824773 [2,0,0,0,0,0|2,0,0]=4 2149 B7R1.4 Clc1ncsc1Br Amb22751163 [2,0,0,0,0,0|2,0,0]=4 2150 B7R1.4 Cn1nccc1O Amb13883681 [2,0,0,0,0,0|2,0,0]=4 2151 B7R1.4 Cn1nccc1O Amb22233838 [2,0,0,0,0,0|2,0,0]=4 2152 B7R1.4 Cn1ncnc1O Amb24756842 [2,0,0,0,0,0|2,0,0]=4 2153 B7R1.4 Nc1ncsc1Br Amb21857839 [2,0,0,0,0,0|2,0,0]=4 2154 B7R1.4 Nc1scnc1Br Amb18193609 [2,0,0,0,0,0|2,0,0]=4 2155 B7R1.4 Oc1sccc1Br Amb22492529 [2,0,0,0,0,0|2,0,0]=4 2156 B7R1.4 Oc1sccc1Cl Amb25296805 [2,0,0,0,0,0|2,0,0]=4 2157 B9R0.48 C=CC\C(C)=C/CC(C)O Amb27829947 [0,1,1,0,0,0|2,0,0]=4 2158 B9R0.2 CC(=O)\N=C\CCCCO Amb27169910 [0,1,1,0,0,0|1,0,1]=4 2159 B9R0.45 OC\C=C\C=C=CCCO Amb27260215 [0,1,1,0,0,0|2,0,0]=4 2160 B9R0.14 C=CC\C(=C\C)CC(C)O Amb28126854 [0,1,1,0,0,0|2,0,0]=4 2161 B9R0.17 C=CC\C(=C/CC)CCO Amb27979639 [0,1,1,0,0,0|2,0,0]=4 2162 B9R1.7 BrCCc1cc(Br)cs1 Amb18231829 [1,1,0,0,0,0|2,0,0]=4 2163 B9R1.7 BrCCc1ccc(Br)s1 Amb18232370 [1,1,0,0,0,0|2,0,0]=4 2164 B9R1.7 BrCCc1cnc(Br)s1 Amb27260245 [1,1,0,0,0,0|1,0,0]=3 2165 B9R1.7 C#CCc1cnc(C)s1 Amb33148864 [1,1,0,0,0,0|1,0,1]=4 2166 B9R1.7 C#CCc1cnc(Cl)s1 Amb33221034 [1,1,0,0,0,0|1,0,1]=4 2167 B9R1.7 C=CCc1cnc(C)s1 Amb35613159 [1,1,0,0,0,0|1,0,1]=4 2168 B9R1.7 CCCc1cc(F)cs1 Amb27962434 [1,1,0,0,0,0|2,0,0]=4 2169 B9R1.7 CCCc1ccc(Br)s1 Amb20617246 [1,1,0,0,0,0|2,0,0]=4 2170 B9R1.7 CCCc1ccc(C)s1 Amb28198684 [1,1,0,0,0,0|2,0,0]=4 2171 B9R1.7 CCCc1ccc(Cl)s1 Amb27816673 [1,1,0,0,0,0|2,0,0]=4 2172 B9R1.7 CCCc1ccc(F)s1 Amb28248535 [1,1,0,0,0,0|2,0,0]=4 2173 B9R1.7 CCCc1ccc(N)s1 Amb20617247 [1,1,0,0,0,0|2,0,0]=4 2174 B9R1.7 CCCc1ccc(O)s1 Amb33267047 [1,1,0,0,0,0|2,0,0]=4 2175 B9R1.7 CCCc1ccc(S)s1 Amb27847156 [1,1,0,0,0,0|2,0,0]=4 2176 B9R1.7 CCCc1cnc(Br)s1 Amb13884318 [1,1,0,0,0,0|1,0,0]=3 2177 B9R1.7 CCCc1cnc(Cl)o1 Amb33039838 [1,1,0,0,0,0|1,1,0]=4 2178 B9R1.7 CCCc1cnc(Cl)s1 Amb24321377 [1,1,0,0,0,0|1,0,0]=3 2179 B9R1.7 CCCc1cnc(N)o1 Amb26413267 [1,1,0,0,0,0|1,1,0]=4 2180 B9R1.7 CCCc1cnc(N)s1 Amb3948152 [1,1,0,0,0,0|1,0,0]=3 2181 B9R1.7 CCCc1cnc(O)s1 Amb13884317 [1,1,0,0,0,0|1,0,0]=3 2182 B9R1.7 CCCc1nnc(Br)s1 Amb20669361 [1,1,0,0,0,0|2,0,0]=4 2183 B9R1.7 CCCc1nnc(Cl)s1 Amb19516958 [1,1,0,0,0,0|2,0,0]=4 2184 B9R1.7 CCCc1nnc(N)s1 Amb1145821 [1,1,0,0,0,0|2,0,0]=4 2185 B9R1.7 CCCc1nnc(S)s1 Amb404783 [1,1,0,0,0,0|2,0,0]=4 2186 B9R1.7 CCOc1cnc(N)s1 Amb18644161 [1,1,0,0,0,0|2,0,0]=4 2187 B9R1.7 CNCc1cnc(C)s1 Amb10609200 [1,1,0,0,0,0|2,0,0]=4 2188 B9R1.7 CNCc1cnc(C)s1 Amb10610371 [1,1,0,0,0,0|2,0,0]=4 2189 B9R1.7 CNCc1cnc(Cl)s1 Amb21861284 [1,1,0,0,0,0|2,0,0]=4 2190 B9R1.7 CNCc1cnc(N)s1 Amb18951456 [1,1,0,0,0,0|2,0,0]=4 2191 B9R1.7 COCc1cnc(N)s1 Amb25189073 [1,1,0,0,0,0|2,0,0]=4 2192 B9R1.7 CSCc1cnc(Cl)s1 Amb2429942 [1,1,0,0,0,0|2,0,0]=4 2193 B9R1.7 Cc1cc(CCO)co1 Amb25058458 [1,1,0,0,0,0|2,0,0]=4 2194 B9R1.7 Cc1cc(CCO)cs1 Amb24672867 [1,1,0,0,0,0|2,0,0]=4 2195 B9R1.7 Cc1cc(CCO)on1 Amb21936274 [1,1,0,0,0,0|2,0,0]=4 2196 B9R1.7 Cc1cc(CCO)sn1 Amb27619076 [1,1,0,0,0,0|2,0,0]=4 2197 B9R1.7 Cc1ccc(CCBr)s1 Amb25741696 [1,1,0,0,0,0|2,0,0]=4 2198 B9R1.7 Cc1ccc(CCN)s1 Amb22749482 [1,1,0,0,0,0|2,0,0]=4 2199 B9R1.7 Cc1ccc(CCN)s1 Amb2592466 [1,1,0,0,0,0|2,0,0]=4 2200 B9R1.7 Cc1ccc(CCO)o1 Amb24496246 [1,1,0,0,0,0|1,1,0]=4 2201 B9R1.7 Cc1ccc(CCO)s1 Amb27981032 [1,1,0,0,0,0|1,0,0]=3 2202 B9R1.7 Cc1ccc(CCS)s1 Amb28121258 [1,1,0,0,0,0|1,1,0]=4 2203 B9R1.7 Cc1ccc(CNO)s1 Amb26623846 [1,1,0,0,0,0|2,0,0]=4 2204 B9R1.7 Cc1coc(CCO)c1 Amb26849213 [1,1,0,0,0,0|1,1,0]=4 2205 B9R1.7 Cc1csc(CCBr)c1 Amb33333709 [1,1,0,0,0,0|2,0,0]=4 2206 B9R1.7 Cc1csc(CCN)c1 Amb18831670 [1,1,0,0,0,0|2,0,0]=4 2207 B9R1.7 Cc1csc(CCO)c1 Amb17593605 [1,1,0,0,0,0|1,0,0]=3 2208 B9R1.7 Cc1csc(CCO)n1 Amb24417243 [1,1,0,0,0,0|2,0,0]=4 2209 B9R1.7 Cc1csc(CCS)c1 Amb33373441 [1,1,0,0,0,0|1,1,0]=4 2210 B9R1.7 Cc1csc(CNO)c1 Amb33427991 [1,1,0,0,0,0|2,0,0]=4 2211 B9R1.7 Cc1nc(CCO)co1 Amb27481327 [1,1,0,0,0,0|2,0,0]=4 2212 B9R1.7 Cc1nc(CCO)cs1 Amb33544498 [1,1,0,0,0,0|2,0,0]=4 2213 B9R1.7 Cc1ncc(CC#N)s1 Amb18917872 [1,1,0,0,0,0|1,0,1]=4 2214 B9R1.7 Cc1ncc(CC=O)s1 Amb26493165 [1,1,0,0,0,0|0,0,2]=4 2215 B9R1.7 Cc1ncc(CCBr)s1 Amb27956520 [1,1,0,0,0,0|1,0,0]=3 2216 B9R1.7 Cc1ncc(CCN)o1 Amb17399806 [1,1,0,0,0,0|1,1,0]=4 2217 B9R1.7 Cc1ncc(CCN)o1 Amb33338846 [1,1,0,0,0,0|1,1,0]=4 2218 B9R1.7 Cc1ncc(CCN)s1 Amb18966998 [1,1,0,0,0,0|1,0,0]=3 2219 B9R1.7 Cc1ncc(CCO)s1 Amb23536232 [1,1,0,0,0,0|0,0,0]=2 2220 B9R1.7 Cc1ncc(CCS)s1 Amb33226661 [1,1,0,0,0,0|0,1,0]=3 2221 B9R1.7 Cc1ncc(CNN)s1 Amb19664668 [1,1,0,0,0,0|2,0,0]=4 2222 B9R1.7 Cc1ncc(CNN)s1 Amb32653389 [1,1,0,0,0,0|2,0,0]=4 2223 B9R1.7 Cc1ncc(CNO)s1 Amb27424633 [1,1,0,0,0,0|1,0,0]=3 2224 B9R1.7 Cc1ncc(CON)s1 Amb25092356 [1,1,0,0,0,0|2,0,0]=4 2225 B9R1.7 Cc1nnc(CCN)s1 Amb15701236 [1,1,0,0,0,0|2,0,0]=4 2226 B9R1.7 Cc1nnc(CCN)s1 Amb22586960 [1,1,0,0,0,0|2,0,0]=4 2227 B9R1.7 Cc1nnc(CCO)o1 Amb25889767 [1,1,0,0,0,0|1,1,0]=4 2228 B9R1.7 Cc1nnc(CCO)s1 Amb25322338 [1,1,0,0,0,0|1,0,0]=3 2229 B9R1.7 Cc1noc(CCO)n1 Amb27242586 [1,1,0,0,0,0|2,0,0]=4 2230 B9R1.7 Cc1nsc(CCO)n1 Amb27838530 [1,1,0,0,0,0|2,0,0]=4 2231 B9R1.7 ClCCc1cc(Br)cs1 Amb18861068 [1,1,0,0,0,0|2,0,0]=4 2232 B9R1.7 ClCCc1ccc(Br)s1 Amb18225218 [1,1,0,0,0,0|2,0,0]=4 2233 B9R1.7 ClCCc1ccc(Cl)s1 Amb18862991 [1,1,0,0,0,0|2,0,0]=4 2234 B9R1.7 ClCCc1cnc(Br)s1 Amb24528589 [1,1,0,0,0,0|1,0,0]=3 2235 B9R1.7 Clc1ccc(CCBr)s1 Amb18225213 [1,1,0,0,0,0|2,0,0]=4 2236 B9R1.7 Clc1csc(CCBr)c1 Amb25888872 [1,1,0,0,0,0|2,0,0]=4 2237 B9R1.7 Clc1ncc(CCBr)s1 Amb33335135 [1,1,0,0,0,0|1,0,0]=3 2238 B9R1.7 Cn1cc(CCO)cn1 Amb1971496 [1,1,0,0,0,0|2,0,0]=4 2239 B9R1.7 Cn1ccc(CCO)c1 Amb18860516 [1,1,0,0,0,0|1,0,1]=4 2240 B9R1.7 Cn1cnc(CCO)c1 Amb26918558 [1,1,0,0,0,0|1,0,1]=4 2241 B9R1.7 Cn1ncc(CCO)n1 Amb23541056 [1,1,0,0,0,0|2,0,0]=4 2242 B9R1.7 N#CCc1cnc(Br)s1 Amb22495407 [1,1,0,0,0,0|1,0,1]=4 2243 B9R1.7 N#CCc1cnc(Cl)s1 Amb2423580 [1,1,0,0,0,0|1,0,1]=4 2244 B9R1.7 N#CCc1cnc(N)s1 Amb27621586 [1,1,0,0,0,0|1,0,1]=4 2245 B9R1.7 NCCc1cc(Br)cs1 Amb10067274 [1,1,0,0,0,0|2,0,0]=4 2246 B9R1.7 NCCc1cc(Br)cs1 Amb7783539 [1,1,0,0,0,0|2,0,0]=4 2247 B9R1.7 NCCc1cc(Cl)cs1 Amb23441690 [1,1,0,0,0,0|2,0,0]=4 2248 B9R1.7 NCCc1cc(Cl)cs1 Amb29218357 [1,1,0,0,0,0|2,0,0]=4 2249 B9R1.7 NCCc1ccc(Br)s1 Amb1107706 [1,1,0,0,0,0|2,0,0]=4 2250 B9R1.7 NCCc1ccc(Br)s1 Amb143881 [1,1,0,0,0,0|2,0,0]=4 2251 B9R1.7 NCCc1ccc(Cl)s1 Amb10205375 [1,1,0,0,0,0|2,0,0]=4 2252 B9R1.7 NCCc1ccc(Cl)s1 Amb6254272 [1,1,0,0,0,0|2,0,0]=4 2253 B9R1.7 NCCc1ccc(F)s1 Amb24054158 [1,1,0,0,0,0|2,0,0]=4 2254 B9R1.7 NCCc1ccc(F)s1 Amb27862987 [1,1,0,0,0,0|2,0,0]=4 2255 B9R1.7 NCCc1ccc(I)s1 Amb1109579 [1,1,0,0,0,0|2,0,0]=4 2256 B9R1.7 NCCc1ccc(I)s1 Amb33548798 [1,1,0,0,0,0|2,0,0]=4 2257 B9R1.7 NCCc1cnc(Br)s1 Amb18176434 [1,1,0,0,0,0|1,0,0]=3 2258 B9R1.7 NCCc1cnc(Cl)o1 Amb28129913 [1,1,0,0,0,0|1,1,0]=4 2259 B9R1.7 NCCc1cnc(Cl)s1 Amb27251955 [1,1,0,0,0,0|1,0,0]=3 2260 B9R1.7 NCCc1cnc(Cl)s1 Amb33292460 [1,1,0,0,0,0|1,0,0]=3 2261 B9R1.7 NCCc1cnc(N)s1 Amb18908376 [1,1,0,0,0,0|1,0,0]=3 2262 B9R1.7 NCCc1cnc(N)s1 Amb22497850 [1,1,0,0,0,0|1,0,0]=3 2263 B9R1.7 NCCc1cnc(O)s1 Amb26370647 [1,1,0,0,0,0|1,0,0]=3 2264 B9R1.7 NCCc1nnc(N)s1 Amb10067528 [1,1,0,0,0,0|2,0,0]=4 2265 B9R1.7 NCCc1nnc(N)s1 Amb21959590 [1,1,0,0,0,0|2,0,0]=4 2266 B9R1.7 NCCc1nnc(S)s1 Amb28054180 [1,1,0,0,0,0|2,0,0]=4 2267 B9R1.7 NNCc1cnc(Cl)s1 Amb19664572 [1,1,0,0,0,0|2,0,0]=4 2268 B9R1.7 NOCc1cnc(Cl)s1 Amb27963098 [1,1,0,0,0,0|2,0,0]=4 2269 B9R1.7 NOCc1cnc(N)s1 Amb27463488 [1,1,0,0,0,0|2,0,0]=4 2270 B9R1.7 Nc1cn(CCO)cn1 Amb27250855 [1,1,0,0,0,0|2,0,0]=4 2271 B9R1.7 Nc1nc(CCO)cs1 Amb10607935 [1,1,0,0,0,0|2,0,0]=4 2272 B9R1.7 Nc1nc(CCO)cs1 Amb22587080 [1,1,0,0,0,0|2,0,0]=4 2273 B9R1.7 Nc1ncc(CC=O)s1 Amb28066059 [1,1,0,0,0,0|0,0,2]=4 2274 B9R1.7 Nc1ncc(CCCl)o1 Amb27881668 [1,1,0,0,0,0|1,1,0]=4 2275 B9R1.7 Nc1ncc(CCCl)s1 Amb18126357 [1,1,0,0,0,0|1,0,0]=3 2276 B9R1.7 Nc1ncc(CCCl)s1 Amb32665397 [1,1,0,0,0,0|1,0,0]=3 2277 B9R1.7 Nc1ncc(CCF)o1 Amb33195721 [1,1,0,0,0,0|1,1,0]=4 2278 B9R1.7 Nc1ncc(CCF)s1 Amb35691795 [1,1,0,0,0,0|1,0,0]=3 2279 B9R1.7 Nc1ncc(CCO)s1 Amb18644160 [1,1,0,0,0,0|0,0,0]=2 2280 B9R1.7 Nc1ncc(CCS)s1 Amb35639662 [1,1,0,0,0,0|0,1,0]=3 2281 B9R1.7 Nc1ncc(\C=N\O)s1 Amb19373418 [1,1,0,0,0,0|1,0,1]=4 2282 B9R1.7 Nc1ncn(CCO)n1 Amb10607461 [1,1,0,0,0,0|2,0,0]=4 2283 B9R1.7 Nc1ncn(CCO)n1 Amb22492340 [1,1,0,0,0,0|2,0,0]=4 2284 B9R1.7 Nc1nnc(CCBr)s1 Amb17069379 [1,1,0,0,0,0|2,0,0]=4 2285 B9R1.7 Nc1nnc(CCBr)s1 Amb17601287 [1,1,0,0,0,0|2,0,0]=4 2286 B9R1.7 Nc1nnc(CCCl)s1 Amb24271110 [1,1,0,0,0,0|2,0,0]=4 2287 B9R1.7 Nc1nnc(CCO)s1 Amb24476640 [1,1,0,0,0,0|1,0,0]=3 2288 B9R1.7 O=C1C=CC(CCO)S1 Amb28143598 [1,1,0,0,0,0|1,0,1]=4 2289 B9R1.7 O=CCc1cnc(Cl)s1 Amb22043734 [1,1,0,0,0,0|0,0,2]=4 2290 B9R1.7 OCCC1=CNC(=S)S1 Amb28196658 [1,1,0,0,0,0|0,0,1]=3 2291 B9R1.7 OCCc1cc(Br)co1 Amb33431360 [1,1,0,0,0,0|1,1,0]=4 2292 B9R1.7 OCCc1cc(Br)cs1 Amb18224933 [1,1,0,0,0,0|1,0,0]=3 2293 B9R1.7 OCCc1cc(Br)no1 Amb2455856 [1,1,0,0,0,0|2,0,0]=4 2294 B9R1.7 OCCc1cc(Cl)cs1 Amb25682063 [1,1,0,0,0,0|1,0,0]=3 2295 B9R1.7 OCCc1ccc(Br)o1 Amb26562124 [1,1,0,0,0,0|1,1,0]=4 2296 B9R1.7 OCCc1ccc(Br)s1 Amb17239160 [1,1,0,0,0,0|1,0,0]=3 2297 B9R1.7 OCCc1ccc(Cl)o1 Amb32747715 [1,1,0,0,0,0|1,1,0]=4 2298 B9R1.7 OCCc1ccc(Cl)s1 Amb17232423 [1,1,0,0,0,0|1,0,0]=3 2299 B9R1.7 OCCc1cnc(Br)s1 Amb22495409 [1,1,0,0,0,0|0,0,0]=2 2300 B9R1.7 OCCc1cnc(Cl)s1 Amb22495215 [1,1,0,0,0,0|0,0,0]=2 2301 B9R1.7 OCCc1coc(Cl)n1 Amb27185979 [1,1,0,0,0,0|2,0,0]=4 2302 B9R1.7 OCCc1csc(Br)c1 Amb26549826 [1,1,0,0,0,0|2,0,0]=4 2303 B9R1.7 OCCc1csc(Br)n1 Amb22495406 [1,1,0,0,0,0|2,0,0]=4 2304 B9R1.7 OCCc1csc(Cl)c1 Amb26925413 [1,1,0,0,0,0|2,0,0]=4 2305 B9R1.7 OCCc1csc(Cl)n1 Amb26919870 [1,1,0,0,0,0|2,0,0]=4 2306 B9R1.7 OCCc1nc(Br)cs1 Amb24719543 [1,1,0,0,0,0|2,0,0]=4 2307 B9R1.7 OCCc1ncc(Br)s1 Amb33434841 [1,1,0,0,0,0|2,0,0]=4 2308 B9R1.7 OCCc1ncc(Cl)s1 Amb27768827 [1,1,0,0,0,0|2,0,0]=4 2309 B9R1.7 OCCc1ncc(I)s1 Amb27248191 [1,1,0,0,0,0|2,0,0]=4 2310 B9R1.7 OCCc1nnc(Cl)s1 Amb27777494 [1,1,0,0,0,0|1,0,0]=3 2311 B9R1.7 OCCn1cnc(Br)n1 Amb22741360 [1,1,0,0,0,0|2,0,0]=4 2312 B9R1.7 OCCn1cnc(Br)n1 Amb32653630 [1,1,0,0,0,0|2,0,0]=4 2313 B9R1.7 OCCn1cnc(Cl)n1 Amb4132443 [1,1,0,0,0,0|2,0,0]=4 2314 B9R1.7 ONCc1cc(Br)cs1 Amb26622417 [1,1,0,0,0,0|2,0,0]=4 2315 B9R1.7 ONCc1cc(Cl)cs1 Amb25786956 [1,1,0,0,0,0|2,0,0]=4 2316 B9R1.7 ONCc1ccc(Br)s1 Amb28324921 [1,1,0,0,0,0|2,0,0]=4 2317 B9R1.7 ONCc1ccc(Cl)s1 Amb26529025 [1,1,0,0,0,0|2,0,0]=4 2318 B9R1.7 ONCc1cnc(Cl)s1 Amb33059198 [1,1,0,0,0,0|1,0,0]=3 2319 B9R1.7 O\N=C\c1cnc(Cl)s1 Amb2410374 [1,1,0,0,0,0|1,0,1]=4 2320 B9R1.7 Oc1nnc(CCCl)s1 Amb27267803 [1,1,0,0,0,0|2,0,0]=4 2321 B9R1.7 SCCc1cc(Br)cs1 Amb18570897 [1,1,0,0,0,0|1,1,0]=4 2322 B9R1.7 SCCc1cc(Cl)cs1 Amb33058596 [1,1,0,0,0,0|1,1,0]=4 2323 B9R1.7 SCCc1ccc(Br)s1 Amb17471938 [1,1,0,0,0,0|1,1,0]=4 2324 B9R1.7 SCCc1ccc(Cl)s1 Amb17470585 [1,1,0,0,0,0|1,1,0]=4 2325 B9R1.7 SCCc1cnc(Cl)s1 Amb33221845 [1,1,0,0,0,0|0,1,0]=3 2326 B9R1.7 [C-]#[N+]Cc1cnc(C)s1 Amb33148914 [1,1,0,0,0,0|2,0,0]=4 2327 B9R1.7 [C-]#[N+]Cc1cnc(Cl)s1 Amb33221011 [1,1,0,0,0,0|2,0,0]=4 2328 B9R1.11 C#CC(C)c1cncs1 Amb33269139 [1,1,0,0,0,0|1,0,1]=4 2329 B9R1.11 C#CC(O)c1cncs1 Amb27797532 [1,1,0,0,0,0|1,0,1]=4 2330 B9R1.11 C=C(CBr)c1cncs1 Amb33006596 [1,1,0,0,0,0|1,0,1]=4 2331 B9R1.11 C=C(CCl)c1cncs1 Amb33057311 [1,1,0,0,0,0|1,0,1]=4 2332 B9R1.11 C=C(CN)c1cncs1 Amb33269111 [1,1,0,0,0,0|1,0,1]=4 2333 B9R1.11 C=C(CO)c1cccs1 Amb27395559 [1,1,0,0,0,0|1,0,1]=4 2334 B9R1.11 C=CC(O)c1cncs1 Amb26529292 [1,1,0,0,0,0|1,0,1]=4 2335 B9R1.11 CC(C#N)c1cncs1 Amb33269830 [1,1,0,0,0,0|1,0,1]=4 2336 B9R1.11 CC(C=O)c1cncs1 Amb33269136 [1,1,0,0,0,0|0,0,2]=4 2337 B9R1.11 CC(CBr)c1cccs1 Amb17238292 [1,1,0,0,0,0|2,0,0]=4 2338 B9R1.11 CC(CBr)c1cnco1 Amb33335803 [1,1,0,0,0,0|1,1,0]=4 2339 B9R1.11 CC(CBr)c1cncs1 Amb33007167 [1,1,0,0,0,0|1,0,0]=3 2340 B9R1.11 CC(CCl)c1cccs1 Amb17232346 [1,1,0,0,0,0|2,0,0]=4 2341 B9R1.11 CC(CN)c1cccs1 Amb4056911 [1,1,0,0,0,0|2,0,0]=4 2342 B9R1.11 CC(CN)c1cnco1 Amb26456529 [1,1,0,0,0,0|1,1,0]=4 2343 B9R1.11 CC(CN)c1cncs1 Amb33269816 [1,1,0,0,0,0|1,0,0]=3 2344 B9R1.11 CC(CO)C1=CCC=C1 Amb27981767 [1,1,0,0,0,0|2,0,0]=4 2345 B9R1.11 CC(CO)c1cccs1 Amb17231948 [1,1,0,0,0,0|1,0,0]=3 2346 B9R1.11 CC(CO)c1ccoc1 Amb28397230 [1,1,0,0,0,0|2,0,0]=4 2347 B9R1.11 CC(CO)c1cnco1 Amb33295059 [1,1,0,0,0,0|0,1,0]=3 2348 B9R1.11 CC(CO)n1ccnc1 Amb10608278 [1,1,0,0,0,0|2,0,0]=4 2349 B9R1.11 CC(CO)n1cncn1 Amb10608289 [1,1,0,0,0,0|2,0,0]=4 2350 B9R1.11 CC(NN)c1cncs1 Amb27245785 [1,1,0,0,0,0|2,0,0]=4 2351 B9R1.11 CC(NO)c1cccs1 Amb10606933 [1,1,0,0,0,0|2,0,0]=4 2352 B9R1.11 CC(ON)c1cncs1 Amb33269150 [1,1,0,0,0,0|2,0,0]=4 2353 B9R1.11 CCC(C)c1cnco1 Amb35647922 [1,1,0,0,0,0|1,1,0]=4 2354 B9R1.11 CCC(Cl)c1cccs1 Amb17138515 [1,1,0,0,0,0|2,0,0]=4 2355 B9R1.11 CCC(Cl)c1cncs1 Amb35636266 [1,1,0,0,0,0|1,0,0]=3 2356 B9R1.11 CCC(N)c1cccs1 Amb10609665 [1,1,0,0,0,0|2,0,0]=4 2357 B9R1.11 CCC(N)c1cccs1 Amb9703567 [1,1,0,0,0,0|2,0,0]=4 2358 B9R1.11 CCC(N)c1cnco1 Amb27768692 [1,1,0,0,0,0|1,1,0]=4 2359 B9R1.11 CCC(N)c1cncs1 Amb18202566 [1,1,0,0,0,0|1,0,0]=3 2360 B9R1.11 CCC(O)c1cccs1 Amb9358389 [1,1,0,0,0,0|2,0,0]=4 2361 B9R1.11 CCC(O)c1cnco1 Amb33328541 [1,1,0,0,0,0|1,1,0]=4 2362 B9R1.11 CCC(S)c1cccs1 Amb18787791 [1,1,0,0,0,0|2,0,0]=4 2363 B9R1.11 CC[C@@H](N)c1cccs1 Amb24666373 [1,1,0,0,0,0|2,0,0]=4 2364 B9R1.11 CC[C@@H](N)c1cccs1 Amb33204429 [1,1,0,0,0,0|2,0,0]=4 2365 B9R1.11 CC[C@@H](N)c1cncs1 Amb25303028 [1,1,0,0,0,0|1,0,0]=3 2366 B9R1.11 CC[C@H](N)c1cccs1 Amb26407222 [1,1,0,0,0,0|2,0,0]=4 2367 B9R1.11 CC[C@H](N)c1cccs1 Amb33313563 [1,1,0,0,0,0|2,0,0]=4 2368 B9R1.11 CC[C@H](N)c1cncs1 Amb27955803 [1,1,0,0,0,0|1,0,0]=3 2369 B9R1.11 CC[C@H](O)c1cccs1 Amb27837491 [1,1,0,0,0,0|2,0,0]=4 2370 B9R1.11 CC[C@H](O)c1cncs1 Amb28198759 [1,1,0,0,0,0|1,0,0]=3 2371 B9R1.11 C[C@@H](CO)C1=CCC=C1 Amb27959624 [1,1,0,0,0,0|2,0,0]=4 2372 B9R1.11 C[C@@H](CO)c1ccoc1 Amb27470896 [1,1,0,0,0,0|2,0,0]=4 2373 B9R1.11 C[C@H](CO)c1ccsc1 Amb28315476 [1,1,0,0,0,0|2,0,0]=4 2374 B9R1.11 N#CC(Br)c1cncs1 Amb27394310 [1,1,0,0,0,0|1,0,1]=4 2375 B9R1.11 NC(CF)c1cccs1 Amb27832587 [1,1,0,0,0,0|2,0,0]=4 2376 B9R1.11 NC(CF)c1cncs1 Amb28436471 [1,1,0,0,0,0|1,0,0]=3 2377 B9R1.11 NC(CO)c1ccco1 Amb17231846 [1,1,0,0,0,0|1,1,0]=4 2378 B9R1.11 NC(CO)c1cccs1 Amb17231970 [1,1,0,0,0,0|1,0,0]=3 2379 B9R1.11 NC(CO)c1cccs1 Amb31028985 [1,1,0,0,0,0|1,0,0]=3 2380 B9R1.11 NC(CO)c1ccns1 Amb35681051 [1,1,0,0,0,0|2,0,0]=4 2381 B9R1.11 NC(CO)c1ccoc1 Amb25779755 [1,1,0,0,0,0|2,0,0]=4 2382 B9R1.11 NC(CO)c1ccsc1 Amb18281700 [1,1,0,0,0,0|2,0,0]=4 2383 B9R1.11 NC(CO)c1cnco1 Amb22713444 [1,1,0,0,0,0|0,1,0]=3 2384 B9R1.11 NC(CO)c1cncs1 Amb18831492 [1,1,0,0,0,0|0,0,0]=2 2385 B9R1.11 NC(CO)c1cscn1 Amb18831491 [1,1,0,0,0,0|2,0,0]=4 2386 B9R1.11 NC(CO)c1nccs1 Amb25188940 [1,1,0,0,0,0|2,0,0]=4 2387 B9R1.11 NCC(=O)c1cncs1 Amb18831640 [1,1,0,0,0,0|1,0,1]=4 2388 B9R1.11 NCC(=O)c1cncs1 Amb30585216 [1,1,0,0,0,0|1,0,1]=4 2389 B9R1.11 NCC(=O)c1cncs1 Amb32683464 [1,1,0,0,0,0|1,0,1]=4 2390 B9R1.11 NCC(F)c1cccs1 Amb25842892 [1,1,0,0,0,0|2,0,0]=4 2391 B9R1.11 NCC(F)c1cnco1 Amb33414850 [1,1,0,0,0,0|1,1,0]=4 2392 B9R1.11 NCC(F)c1cncs1 Amb33269508 [1,1,0,0,0,0|1,0,0]=3 2393 B9R1.11 NCC(O)c1cccs1 Amb9703659 [1,1,0,0,0,0|2,0,0]=4 2394 B9R1.11 NCC(O)c1cnco1 Amb18832635 [1,1,0,0,0,0|1,1,0]=4 2395 B9R1.11 NCC(O)c1cncs1 Amb2592497 [1,1,0,0,0,0|1,0,0]=3 2396 B9R1.11 NCC(O)c1cncs1 Amb30231626 [1,1,0,0,0,0|1,0,0]=3 2397 B9R1.11 NC[C@@H](O)c1cccs1 Amb25804883 [1,1,0,0,0,0|2,0,0]=4 2398 B9R1.11 NC[C@@H](O)c1cnco1 Amb33414848 [1,1,0,0,0,0|1,1,0]=4 2399 B9R1.11 NC[C@@H](O)c1cncs1 Amb33269159 [1,1,0,0,0,0|1,0,0]=3 2400 B9R1.11 NC[C@H](N)c1cccs1 Amb27800048 [1,1,0,0,0,0|2,0,0]=4 2401 B9R1.11 NC[C@H](O)c1cccs1 Amb26419255 [1,1,0,0,0,0|2,0,0]=4 2402 B9R1.11 NC[C@H](O)c1cnco1 Amb33414849 [1,1,0,0,0,0|1,1,0]=4 2403 B9R1.11 NC[C@H](O)c1cncs1 Amb33269160 [1,1,0,0,0,0|1,0,0]=3 2404 B9R1.11 N[C@@H](CO)c1ccco1 Amb28073962 [1,1,0,0,0,0|1,1,0]=4 2405 B9R1.11 N[C@@H](CO)c1cccs1 Amb26057259 [1,1,0,0,0,0|1,0,0]=3 2406 B9R1.11 N[C@@H](CO)c1ccoc1 Amb24680984 [1,1,0,0,0,0|2,0,0]=4 2407 B9R1.11 N[C@@H](CO)c1ccsc1 Amb25254855 [1,1,0,0,0,0|2,0,0]=4 2408 B9R1.11 N[C@@H](CO)c1cnco1 Amb33415548 [1,1,0,0,0,0|0,1,0]=3 2409 B9R1.11 N[C@@H](CO)c1cncs1 Amb33269152 [1,1,0,0,0,0|0,0,0]=2 2410 B9R1.11 N[C@@H](CO)c1cscn1 Amb27838529 [1,1,0,0,0,0|2,0,0]=4 2411 B9R1.11 N[C@@H](CO)c1nccs1 Amb25224968 [1,1,0,0,0,0|2,0,0]=4 2412 B9R1.11 N[C@H](CO)c1ccco1 Amb26901992 [1,1,0,0,0,0|1,1,0]=4 2413 B9R1.11 N[C@H](CO)c1cccs1 Amb25959092 [1,1,0,0,0,0|1,0,0]=3 2414 B9R1.11 N[C@H](CO)c1ccoc1 Amb26505857 [1,1,0,0,0,0|2,0,0]=4 2415 B9R1.11 N[C@H](CO)c1ccsc1 Amb27654236 [1,1,0,0,0,0|2,0,0]=4 2416 B9R1.11 N[C@H](CO)c1cnco1 Amb33414847 [1,1,0,0,0,0|0,1,0]=3 2417 B9R1.11 N[C@H](CO)c1cncs1 Amb33269158 [1,1,0,0,0,0|0,0,0]=2 2418 B9R1.11 N[C@H](CO)c1cscn1 Amb27838556 [1,1,0,0,0,0|2,0,0]=4 2419 B9R1.11 N[C@H](CO)c1nccs1 Amb24727007 [1,1,0,0,0,0|2,0,0]=4 2420 B9R1.11 N\C(=N/O)c1cncs1 Amb25063806 [1,1,0,0,0,0|1,0,1]=4 2421 B9R1.11 O=C(CBr)c1cncs1 Amb33870854 [1,1,0,0,0,0|1,0,1]=4 2422 B9R1.11 O=C(CCl)c1cncs1 Amb24104081 [1,1,0,0,0,0|1,0,1]=4 2423 B9R1.11 O=C(CO)c1cccs1 Amb25742219 [1,1,0,0,0,0|1,0,1]=4 2424 B9R1.11 O=C(NO)c1cncs1 Amb27494447 [1,1,0,0,0,0|1,0,1]=4 2425 B9R1.11 O=CC(O)c1cncs1 Amb30026644 [1,1,0,0,0,0|0,0,2]=4 2426 B9R1.11 OC(CBr)c1cccs1 Amb17206127 [1,1,0,0,0,0|2,0,0]=4 2427 B9R1.11 OC(CBr)c1cnco1 Amb33335677 [1,1,0,0,0,0|1,1,0]=4 2428 B9R1.11 OC(CBr)c1cncs1 Amb27409536 [1,1,0,0,0,0|1,0,0]=3 2429 B9R1.11 OC(CCl)c1cccs1 Amb17194470 [1,1,0,0,0,0|2,0,0]=4 2430 B9R1.11 OC(CCl)c1cncs1 Amb33056652 [1,1,0,0,0,0|1,0,0]=3 2431 B9R1.11 OC(CF)c1cccs1 Amb33360698 [1,1,0,0,0,0|2,0,0]=4 2432 B9R1.11 OC(CF)c1cnco1 Amb33414807 [1,1,0,0,0,0|1,1,0]=4 2433 B9R1.11 OC(CF)c1cncs1 Amb33269135 [1,1,0,0,0,0|1,0,0]=3 2434 B9R1.11 OCC(F)c1cccs1 Amb27441548 [1,1,0,0,0,0|1,0,0]=3 2435 B9R1.11 OCC(O)c1ccco1 Amb27160718 [1,1,0,0,0,0|1,1,0]=4 2436 B9R1.11 OCC(O)c1cccs1 Amb18063817 [1,1,0,0,0,0|1,0,0]=3 2437 B9R1.11 OCC(O)c1ccns1 Amb30017509 [1,1,0,0,0,0|2,0,0]=4 2438 B9R1.11 OCC(O)c1ccsc1 Amb28385067 [1,1,0,0,0,0|2,0,0]=4 2439 B9R1.11 OCC(O)c1cnco1 Amb24354332 [1,1,0,0,0,0|0,1,0]=3 2440 B9R1.11 OCC(O)c1cncs1 Amb28285195 [1,1,0,0,0,0|0,0,0]=2 2441 B9R1.11 OCC(O)c1cscn1 Amb25983591 [1,1,0,0,0,0|2,0,0]=4 2442 B9R1.11 OCC(O)c1cscn1 Amb32757536 [1,1,0,0,0,0|2,0,0]=4 2443 B9R1.11 OCC(O)c1nccs1 Amb27412511 [1,1,0,0,0,0|2,0,0]=4 2444 B9R1.11 OCC(S)c1ccco1 Amb28199661 [1,1,0,0,0,0|1,1,0]=4 2445 B9R1.11 OC[C@@H](O)c1ccco1 Amb24183799 [1,1,0,0,0,0|1,1,0]=4 2446 B9R1.11 OC[C@@H](O)c1ccoc1 Amb27460888 [1,1,0,0,0,0|2,0,0]=4 2447 B9R1.11 OC[C@H](O)c1cccs1 Amb27396199 [1,1,0,0,0,0|1,0,0]=3 2448 B9R1.11 OC[C@H](O)c1ccoc1 Amb24665741 [1,1,0,0,0,0|2,0,0]=4 2449 B9R1.11 O[C@@H](CBr)c1cccs1 Amb27392821 [1,1,0,0,0,0|2,0,0]=4 2450 B9R1.11 O[C@H](CBr)c1cccs1 Amb27875659 [1,1,0,0,0,0|2,0,0]=4 2451 B9R1.11 O[C@H](CCl)c1cccs1 Amb27811547 [1,1,0,0,0,0|2,0,0]=4 2452 B9R1.11 [C-]#[N+]C(C)c1cncs1 Amb33269804 [1,1,0,0,0,0|2,0,0]=4 2453 B9R1.12 BrCCCc1cccs1 Amb17104551 [1,1,0,0,0,0|2,0,0]=4 2454 B9R1.12 BrCCCc1cnco1 Amb33335808 [1,1,0,0,0,0|1,1,0]=4 2455 B9R1.12 BrCCCc1cncs1 Amb26631480 [1,1,0,0,0,0|1,0,0]=3 2456 B9R1.12 BrCCCc1cnns1 Amb28123744 [1,1,0,0,0,0|2,0,0]=4 2457 B9R1.12 BrCCSc1cccs1 Amb6717251 [1,1,0,0,0,0|2,0,0]=4 2458 B9R1.12 C#CCCc1cccs1 Amb33361313 [1,1,0,0,0,0|2,0,0]=4 2459 B9R1.12 C#CCCc1cnco1 Amb33319934 [1,1,0,0,0,0|1,1,0]=4 2460 B9R1.12 C#CCCc1cncs1 Amb33268759 [1,1,0,0,0,0|1,0,0]=3 2461 B9R1.12 C=CCCc1cccs1 Amb27476978 [1,1,0,0,0,0|2,0,0]=4 2462 B9R1.12 C=NCCc1cccs1 Amb27442437 [1,1,0,0,0,0|2,0,0]=4 2463 B9R1.12 CCCCc1cccs1 Amb4477470 [1,1,0,0,0,0|2,0,0]=4 2464 B9R1.12 CCCCc1cnco1 Amb35647888 [1,1,0,0,0,0|1,1,0]=4 2465 B9R1.12 CCCOc1cccs1 Amb27167856 [1,1,0,0,0,0|2,0,0]=4 2466 B9R1.12 CCCSc1nncs1 Amb27827029 [1,1,0,0,0,0|2,0,0]=4 2467 B9R1.12 CCNCc1cccs1 Amb1088620 [1,1,0,0,0,0|2,0,0]=4 2468 B9R1.12 CCNCc1cccs1 Amb22283900 [1,1,0,0,0,0|2,0,0]=4 2469 B9R1.12 CCNCc1cnco1 Amb18291304 [1,1,0,0,0,0|1,1,0]=4 2470 B9R1.12 CCNCc1cncs1 Amb2592078 [1,1,0,0,0,0|1,0,0]=3 2471 B9R1.12 CCNCc1cnns1 Amb25233955 [1,1,0,0,0,0|2,0,0]=4 2472 B9R1.12 CCOCc1cnco1 Amb30035677 [1,1,0,0,0,0|1,1,0]=4 2473 B9R1.12 CNCCc1cccs1 Amb6712648 [1,1,0,0,0,0|2,0,0]=4 2474 B9R1.12 CNCCc1cnco1 Amb33415561 [1,1,0,0,0,0|1,1,0]=4 2475 B9R1.12 CNCCc1cncs1 Amb26877308 [1,1,0,0,0,0|1,0,0]=3 2476 B9R1.12 COCCC1=CC=CC1 Amb27806849 [1,1,0,0,0,0|2,0,0]=4 2477 B9R1.12 COCCc1ccsc1 Amb27843682 [1,1,0,0,0,0|2,0,0]=4 2478 B9R1.12 COCCc1cnco1 Amb35647935 [1,1,0,0,0,0|0,1,0]=3 2479 B9R1.12 COCCc1cscn1 Amb27809391 [1,1,0,0,0,0|2,0,0]=4 2480 B9R1.12 COCCc1nccs1 Amb27485614 [1,1,0,0,0,0|2,0,0]=4 2481 B9R1.12 COCCn1ccnc1 Amb20668437 [1,1,0,0,0,0|2,0,0]=4 2482 B9R1.12 COCCn1cncn1 Amb26968272 [1,1,0,0,0,0|2,0,0]=4 2483 B9R1.12 CO\C=C\c1cncs1 Amb32663125 [1,1,0,0,0,0|0,0,2]=4 2484 B9R1.12 CSCCc1cccs1 Amb27443874 [1,1,0,0,0,0|1,1,0]=4 2485 B9R1.12 ClCC#Cc1cncs1 Amb33483528 [1,1,0,0,0,0|1,0,1]=4 2486 B9R1.12 ClCCCc1cccs1 Amb17104524 [1,1,0,0,0,0|2,0,0]=4 2487 B9R1.12 ClCCCc1cncs1 Amb24447750 [1,1,0,0,0,0|1,0,0]=3 2488 B9R1.12 ClCCCc1cnns1 Amb26010423 [1,1,0,0,0,0|2,0,0]=4 2489 B9R1.12 ClC\C=C\c1cncs1 Amb28285194 [1,1,0,0,0,0|1,0,1]=4 2490 B9R1.12 FCCSc1cccs1 Amb27218429 [1,1,0,0,0,0|2,0,0]=4 2491 B9R1.12 FCCSc1nncs1 Amb27603415 [1,1,0,0,0,0|2,0,0]=4 2492 B9R1.12 ICCCc1cccs1 Amb27207015 [1,1,0,0,0,0|2,0,0]=4 2493 B9R1.12 N#CCCc1cccs1 Amb17226709 [1,1,0,0,0,0|2,0,0]=4 2494 B9R1.12 N#CCCc1cnco1 Amb33415273 [1,1,0,0,0,0|1,1,0]=4 2495 B9R1.12 N#CCCc1cncs1 Amb25072826 [1,1,0,0,0,0|1,0,0]=3 2496 B9R1.12 NCC#Cc1cncs1 Amb35632420 [1,1,0,0,0,0|1,0,1]=4 2497 B9R1.12 NCCCc1cccs1 Amb33529119 [1,1,0,0,0,0|2,0,0]=4 2498 B9R1.12 NCCCc1cnco1 Amb33415562 [1,1,0,0,0,0|1,1,0]=4 2499 B9R1.12 NCCCc1cncs1 Amb18831614 [1,1,0,0,0,0|1,0,0]=3 2500 B9R1.12 NCCCc1cnns1 Amb27768694 [1,1,0,0,0,0|2,0,0]=4 2501 B9R1.12 NCCCc1nncs1 Amb27653769 [1,1,0,0,0,0|2,0,0]=4 2502 B9R1.12 NCCNc1cncs1 Amb27859908 [1,1,0,0,0,0|1,0,0]=3 2503 B9R1.12 NCCNc1nncs1 Amb25744245 [1,1,0,0,0,0|2,0,0]=4 2504 B9R1.12 NCCOc1cccs1 Amb26516140 [1,1,0,0,0,0|2,0,0]=4 2505 B9R1.12 NCCOc1cnco1 Amb33319567 [1,1,0,0,0,0|1,1,0]=4 2506 B9R1.12 NCCOc1cncs1 Amb33268053 [1,1,0,0,0,0|1,0,0]=3 2507 B9R1.12 NCCSc1cccs1 Amb6717253 [1,1,0,0,0,0|2,0,0]=4 2508 B9R1.12 NCCSc1nncs1 Amb21984399 [1,1,0,0,0,0|2,0,0]=4 2509 B9R1.12 NC\C=C\c1cncs1 Amb33080085 [1,1,0,0,0,0|1,0,1]=4 2510 B9R1.12 NNCCc1cccs1 Amb6242818 [1,1,0,0,0,0|2,0,0]=4 2511 B9R1.12 NOCCc1ccco1 Amb25208726 [1,1,0,0,0,0|1,1,0]=4 2512 B9R1.12 NOCCc1cccs1 Amb25130652 [1,1,0,0,0,0|1,0,0]=3 2513 B9R1.12 NOCCc1ccoc1 Amb33360619 [1,1,0,0,0,0|2,0,0]=4 2514 B9R1.12 NOCCc1ccsc1 Amb25799465 [1,1,0,0,0,0|2,0,0]=4 2515 B9R1.12 NOCCc1cnco1 Amb33414839 [1,1,0,0,0,0|0,1,0]=3 2516 B9R1.12 NOCCc1cncs1 Amb33269493 [1,1,0,0,0,0|0,0,0]=2 2517 B9R1.12 NOCCc1cscn1 Amb33418191 [1,1,0,0,0,0|2,0,0]=4 2518 B9R1.12 NOCCc1nccs1 Amb33311522 [1,1,0,0,0,0|2,0,0]=4 2519 B9R1.12 NOCCn1cncn1 Amb27461567 [1,1,0,0,0,0|2,0,0]=4 2520 B9R1.12 O=C=NCc1cncs1 Amb33269306 [1,1,0,0,0,0|0,0,2]=4 2521 B9R1.12 O=CCCc1cccs1 Amb17081673 [1,1,0,0,0,0|1,0,1]=4 2522 B9R1.12 O=CCCc1cnco1 Amb26986955 [1,1,0,0,0,0|0,1,1]=4 2523 B9R1.12 O=CCCc1cncs1 Amb25705083 [1,1,0,0,0,0|0,0,1]=3 2524 B9R1.12 O=CNCc1cncs1 Amb27628845 [1,1,0,0,0,0|0,0,2]=4 2525 B9R1.12 OCC#Cc1cncs1 Amb35616589 [1,1,0,0,0,0|0,0,1]=3 2526 B9R1.12 OCCCc1ccco1 Amb8860560 [1,1,0,0,0,0|1,1,0]=4 2527 B9R1.12 OCCCc1cccs1 Amb17089493 [1,1,0,0,0,0|1,0,0]=3 2528 B9R1.12 OCCCc1ccns1 Amb27787342 [1,1,0,0,0,0|2,0,0]=4 2529 B9R1.12 OCCCc1ccoc1 Amb26505336 [1,1,0,0,0,0|2,0,0]=4 2530 B9R1.12 OCCCc1ccsc1 Amb17605794 [1,1,0,0,0,0|2,0,0]=4 2531 B9R1.12 OCCCc1cnco1 Amb27833401 [1,1,0,0,0,0|0,1,0]=3 2532 B9R1.12 OCCCc1cncs1 Amb26017292 [1,1,0,0,0,0|0,0,0]=2 2533 B9R1.12 OCCCc1cnoc1 Amb3941163 [1,1,0,0,0,0|2,0,0]=4 2534 B9R1.12 OCCCc1cnsc1 Amb30017333 [1,1,0,0,0,0|2,0,0]=4 2535 B9R1.12 OCCCc1cnsn1 Amb27785943 [1,1,0,0,0,0|2,0,0]=4 2536 B9R1.12 OCCCc1cocn1 Amb27762837 [1,1,0,0,0,0|2,0,0]=4 2537 B9R1.12 OCCCc1cscn1 Amb24099813 [1,1,0,0,0,0|2,0,0]=4 2538 B9R1.12 OCCCc1nccs1 Amb25887194 [1,1,0,0,0,0|2,0,0]=4 2539 B9R1.12 OCCCn1ccnc1 Amb11012596 [1,1,0,0,0,0|2,0,0]=4 2540 B9R1.12 OCCCn1ccnc1 Amb33531544 [1,1,0,0,0,0|2,0,0]=4 2541 B9R1.12 OCCCn1cncn1 Amb33531610 [1,1,0,0,0,0|2,0,0]=4 2542 B9R1.12 OCCNc1ccco1 Amb27246618 [1,1,0,0,0,0|1,1,0]=4 2543 B9R1.12 OCCNc1cccs1 Amb27174142 [1,1,0,0,0,0|1,0,0]=3 2544 B9R1.12 OCCNc1cnsn1 Amb24116470 [1,1,0,0,0,0|2,0,0]=4 2545 B9R1.12 OCCNc1nccs1 Amb6649646 [1,1,0,0,0,0|2,0,0]=4 2546 B9R1.12 OCCNc1ncns1 Amb27865781 [1,1,0,0,0,0|2,0,0]=4 2547 B9R1.12 OCCNc1nncs1 Amb26027249 [1,1,0,0,0,0|1,0,0]=3 2548 B9R1.12 OCCSc1ccco1 Amb27200113 [1,1,0,0,0,0|1,1,0]=4 2549 B9R1.12 OCCSc1ccsc1 Amb27958951 [1,1,0,0,0,0|2,0,0]=4 2550 B9R1.12 OCCSc1ncns1 Amb27951343 [1,1,0,0,0,0|2,0,0]=4 2551 B9R1.12 OCCSc1nncs1 Amb9245012 [1,1,0,0,0,0|1,0,0]=3 2552 B9R1.12 OC\C=C\c1cccs1 Amb23555588 [1,1,0,0,0,0|1,0,1]=4 2553 B9R1.12 OC\C=C\c1cnco1 Amb33414800 [1,1,0,0,0,0|0,1,1]=4 2554 B9R1.12 OC\C=C\c1cncs1 Amb25733141 [1,1,0,0,0,0|0,0,1]=3 2555 B9R1.12 SCCCc1cccs1 Amb17400036 [1,1,0,0,0,0|1,1,0]=4 2556 B9R1.12 SCCCc1cnco1 Amb33319544 [1,1,0,0,0,0|0,2,0]=4 2557 B9R1.12 SCCCc1cncs1 Amb33268042 [1,1,0,0,0,0|0,1,0]=3 2558 B9R1.12 [C-]#[N+]CCc1cccs1 Amb3973223 [1,1,0,0,0,0|2,0,0]=4 2559 B9R1.12 [C-]#[N+]CCc1cnco1 Amb33414854 [1,1,0,0,0,0|1,1,0]=4 2560 B9R1.12 [C-]#[N+]CCc1cncs1 Amb33269803 [1,1,0,0,0,0|1,0,0]=3 2561 B9R1.12 [N-]=[N+]=NCc1cncs1 Amb26571195 [1,1,0,0,0,0|2,0,0]=4 2562 B9R1.13 CC(=O)Cc1cncs1 Amb25887376 [1,1,0,0,0,0|0,0,2]=4 2563 B9R1.13 CC(Br)Cc1cccs1 Amb26653704 [1,1,0,0,0,0|2,0,0]=4 2564 B9R1.13 CC(Br)Cc1cnco1 Amb33335734 [1,1,0,0,0,0|1,1,0]=4 2565 B9R1.13 CC(Br)Cc1cncs1 Amb33485658 [1,1,0,0,0,0|1,0,0]=3 2566 B9R1.13 CC(C)Cc1cccs1 Amb24061264 [1,1,0,0,0,0|2,0,0]=4 2567 B9R1.13 CC(C)Cc1cnco1 Amb30019089 [1,1,0,0,0,0|1,1,0]=4 2568 B9R1.13 CC(Cl)Cc1cccs1 Amb17477833 [1,1,0,0,0,0|2,0,0]=4 2569 B9R1.13 CC(N)Cc1cccs1 Amb19514742 [1,1,0,0,0,0|2,0,0]=4 2570 B9R1.13 CC(N)Cc1cccs1 Amb9714775 [1,1,0,0,0,0|2,0,0]=4 2571 B9R1.13 CC(N)Cc1cnns1 Amb27188036 [1,1,0,0,0,0|2,0,0]=4 2572 B9R1.13 CC(O)Cc1ccco1 Amb22748663 [1,1,0,0,0,0|1,1,0]=4 2573 B9R1.13 CC(O)Cc1cccs1 Amb4016400 [1,1,0,0,0,0|1,0,0]=3 2574 B9R1.13 CC(O)Cc1ccno1 Amb24747618 [1,1,0,0,0,0|2,0,0]=4 2575 B9R1.13 CC(O)Cc1ccns1 Amb35649838 [1,1,0,0,0,0|2,0,0]=4 2576 B9R1.13 CC(O)Cc1ccoc1 Amb28061649 [1,1,0,0,0,0|2,0,0]=4 2577 B9R1.13 CC(O)Cc1ccsc1 Amb33531017 [1,1,0,0,0,0|2,0,0]=4 2578 B9R1.13 CC(O)Cc1cnco1 Amb33415202 [1,1,0,0,0,0|0,1,0]=3 2579 B9R1.13 CC(O)Cc1cncs1 Amb24659738 [1,1,0,0,0,0|0,0,0]=2 2580 B9R1.13 CC(O)Cc1cscn1 Amb26631803 [1,1,0,0,0,0|2,0,0]=4 2581 B9R1.13 CC(O)Cc1nccs1 Amb27817410 [1,1,0,0,0,0|2,0,0]=4 2582 B9R1.13 CC(O)Cn1ccnc1 Amb2720663 [1,1,0,0,0,0|2,0,0]=4 2583 B9R1.13 CC(O)Cn1ccnc1 Amb29844586 [1,1,0,0,0,0|2,0,0]=4 2584 B9R1.13 CC(S)Cc1cccs1 Amb29859712 [1,1,0,0,0,0|1,1,0]=4 2585 B9R1.13 CN(C)Cc1cncs1 Amb26501762 [1,1,0,0,0,0|2,0,0]=4 2586 B9R1.13 CN(O)Cc1cccs1 Amb33360066 [1,1,0,0,0,0|2,0,0]=4 2587 B9R1.13 CN(O)Cc1cnco1 Amb33415281 [1,1,0,0,0,0|1,1,0]=4 2588 B9R1.13 CN(O)Cc1cncs1 Amb33269831 [1,1,0,0,0,0|1,0,0]=3 2589 B9R1.13 C[C@@H](N)Cc1cccs1 Amb24680998 [1,1,0,0,0,0|2,0,0]=4 2590 B9R1.13 C[C@@H](N)Cc1cnco1 Amb33414816 [1,1,0,0,0,0|1,1,0]=4 2591 B9R1.13 C[C@@H](N)Cc1cncs1 Amb33269143 [1,1,0,0,0,0|1,0,0]=3 2592 B9R1.13 C[C@@H](O)Cc1ccco1 Amb24433279 [1,1,0,0,0,0|1,1,0]=4 2593 B9R1.13 C[C@@H](O)Cc1cccs1 Amb22896924 [1,1,0,0,0,0|1,0,0]=3 2594 B9R1.13 C[C@@H](O)Cc1ccno1 Amb28205802 [1,1,0,0,0,0|2,0,0]=4 2595 B9R1.13 C[C@@H](O)Cc1ccoc1 Amb33360606 [1,1,0,0,0,0|2,0,0]=4 2596 B9R1.13 C[C@@H](O)Cc1ccsc1 Amb22896909 [1,1,0,0,0,0|2,0,0]=4 2597 B9R1.13 C[C@@H](O)Cc1cnco1 Amb33414812 [1,1,0,0,0,0|0,1,0]=3 2598 B9R1.13 C[C@@H](O)Cc1cncs1 Amb33225056 [1,1,0,0,0,0|0,0,0]=2 2599 B9R1.13 C[C@@H](O)Cc1cscn1 Amb33418095 [1,1,0,0,0,0|2,0,0]=4 2600 B9R1.13 C[C@@H](O)Cc1nccs1 Amb33311484 [1,1,0,0,0,0|2,0,0]=4 2601 B9R1.13 C[C@@H](O)Cn1cncn1 Amb27879786 [1,1,0,0,0,0|2,0,0]=4 2602 B9R1.13 C[C@H](N)Cc1cccs1 Amb27655600 [1,1,0,0,0,0|2,0,0]=4 2603 B9R1.13 C[C@H](N)Cc1cnco1 Amb33414815 [1,1,0,0,0,0|1,1,0]=4 2604 B9R1.13 C[C@H](N)Cc1cncs1 Amb33269142 [1,1,0,0,0,0|1,0,0]=3 2605 B9R1.13 C[C@H](O)CC1=CC=CC1 Amb27770335 [1,1,0,0,0,0|2,0,0]=4 2606 B9R1.13 C[C@H](O)CC1=CCC=C1 Amb28049106 [1,1,0,0,0,0|2,0,0]=4 2607 B9R1.13 C[C@H](O)Cc1ccco1 Amb28342905 [1,1,0,0,0,0|1,1,0]=4 2608 B9R1.13 C[C@H](O)Cc1cccs1 Amb25354706 [1,1,0,0,0,0|1,0,0]=3 2609 B9R1.13 C[C@H](O)Cc1ccoc1 Amb33360607 [1,1,0,0,0,0|2,0,0]=4 2610 B9R1.13 C[C@H](O)Cc1ccsc1 Amb24395208 [1,1,0,0,0,0|2,0,0]=4 2611 B9R1.13 C[C@H](O)Cc1cnco1 Amb33414814 [1,1,0,0,0,0|0,1,0]=3 2612 B9R1.13 C[C@H](O)Cc1cncs1 Amb33269141 [1,1,0,0,0,0|0,0,0]=2 2613 B9R1.13 C[C@H](O)Cc1cscn1 Amb33418100 [1,1,0,0,0,0|2,0,0]=4 2614 B9R1.13 C[C@H](O)Cc1nccs1 Amb33311491 [1,1,0,0,0,0|2,0,0]=4 2615 B9R1.13 C[C@H](O)Cn1ccnc1 Amb25188989 [1,1,0,0,0,0|2,0,0]=4 2616 B9R1.13 C[C@H](O)Cn1ccnc1 Amb32670780 [1,1,0,0,0,0|2,0,0]=4 2617 B9R1.13 C[C@H](O)Cn1cncn1 Amb24481763 [1,1,0,0,0,0|2,0,0]=4 2618 B9R1.13 N=C(N)Cc1cncs1 Amb27641341 [1,1,0,0,0,0|1,0,1]=4 2619 B9R1.13 NC(=O)Cc1cncs1 Amb22372056 [1,1,0,0,0,0|0,0,2]=4 2620 B9R1.13 NC(=S)Cc1cncs1 Amb26864643 [1,1,0,0,0,0|0,1,1]=4 2621 B9R1.13 O=C(O)Cc1cccs1 Amb6335251 [1,1,0,0,0,0|1,0,1]=4 2622 B9R1.13 O=C(O)Cc1cnco1 Amb8009409 [1,1,0,0,0,0|0,1,1]=4 2623 B9R1.13 O=C(O)Cc1cncs1 Amb3319218 [1,1,0,0,0,0|0,0,1]=3 2624 B9R1.13 O=C(O)Cc1cnns1 Amb26029960 [1,1,0,0,0,0|1,0,1]=4 2625 B9R1.13 O=C(O)Cc1nncs1 Amb27162471 [1,1,0,0,0,0|1,0,1]=4 2626 B9R1.13 O=[N+]([O-])Cc1cncs1 Amb33269099 [1,1,0,0,0,0|1,0,1]=4 2627 B9R1.13 OB(O)Cc1cccs1 Amb27771775 [1,1,0,0,0,0|2,0,0]=4 2628 B9R1.13 OC(=S)Cc1cccs1 Amb2611516 [1,1,0,0,0,0|1,0,1]=4 2629 B9R1.14 BrCc1ccsc1CBr Amb25735651 [1,1,0,0,0,0|2,0,0]=4 2630 B9R1.14 BrCc1ncsc1CBr Amb28410793 [1,1,0,0,0,0|1,0,0]=3 2631 B9R1.14 C#Cc1scnc1CO Amb28315473 [1,1,0,0,0,0|0,0,2]=4 2632 B9R1.14 CCc1ccnn1CC Amb6890654 [1,1,0,0,0,0|2,0,0]=4 2633 B9R1.14 CCc1ccoc1CN Amb29860301 [1,1,0,0,0,0|2,0,0]=4 2634 B9R1.14 CCc1ccoc1CS Amb28292958 [1,1,0,0,0,0|2,0,0]=4 2635 B9R1.14 CCc1ccsc1CBr Amb27595243 [1,1,0,0,0,0|2,0,0]=4 2636 B9R1.14 CCc1ccsc1CCl Amb25686979 [1,1,0,0,0,0|2,0,0]=4 2637 B9R1.14 CCc1ccsc1CN Amb18954316 [1,1,0,0,0,0|2,0,0]=4 2638 B9R1.14 CCc1ccsc1CO Amb24352853 [1,1,0,0,0,0|1,0,0]=3 2639 B9R1.14 CCc1ccsc1CS Amb27186319 [1,1,0,0,0,0|1,1,0]=4 2640 B9R1.14 CCc1ncoc1CN Amb18832747 [1,1,0,0,0,0|1,1,0]=4 2641 B9R1.14 CCc1ncsc1C=O Amb27472095 [1,1,0,0,0,0|0,0,2]=4 2642 B9R1.14 CCc1nnsc1CBr Amb27974494 [1,1,0,0,0,0|2,0,0]=4 2643 B9R1.14 CCc1nnsc1CN Amb18908377 [1,1,0,0,0,0|2,0,0]=4 2644 B9R1.14 CCc1nocc1CO Amb25172647 [1,1,0,0,0,0|2,0,0]=4 2645 B9R1.14 CCc1nonc1CO Amb26351227 [1,1,0,0,0,0|2,0,0]=4 2646 B9R1.14 CCc1nscc1CO Amb27184527 [1,1,0,0,0,0|2,0,0]=4 2647 B9R1.14 CCc1nsnc1NC Amb29864841 [1,1,0,0,0,0|2,0,0]=4 2648 B9R1.14 CCc1occc1CO Amb27444076 [1,1,0,0,0,0|1,1,0]=4 2649 B9R1.14 CCc1occc1CS Amb27862619 [1,1,0,0,0,0|1,1,0]=4 2650 B9R1.14 CCc1occc1SC Amb27795113 [1,1,0,0,0,0|1,1,0]=4 2651 B9R1.14 CCc1ocnc1CO Amb28366815 [1,1,0,0,0,0|0,1,0]=3 2652 B9R1.14 CCc1sccc1C=O Amb25868889 [1,1,0,0,0,0|1,0,1]=4 2653 B9R1.14 CCc1sccc1CO Amb27752318 [1,1,0,0,0,0|1,0,0]=3 2654 B9R1.14 CCn1ccnc1CBr Amb22271011 [1,1,0,0,0,0|2,0,0]=4 2655 B9R1.14 CCn1ccnc1CBr Amb32645743 [1,1,0,0,0,0|2,0,0]=4 2656 B9R1.14 CCn1ccnc1CCl Amb13952564 [1,1,0,0,0,0|2,0,0]=4 2657 B9R1.14 CCn1ccnc1CCl Amb2797430 [1,1,0,0,0,0|2,0,0]=4 2658 B9R1.14 CCn1ccnc1CI Amb22271012 [1,1,0,0,0,0|2,0,0]=4 2659 B9R1.14 CCn1ccnc1CN Amb21959843 [1,1,0,0,0,0|2,0,0]=4 2660 B9R1.14 CCn1ccnc1CN Amb2797428 [1,1,0,0,0,0|2,0,0]=4 2661 B9R1.14 CCn1ccnc1CO Amb7093337 [1,1,0,0,0,0|2,0,0]=4 2662 B9R1.14 CCn1ccnc1CS Amb22271015 [1,1,0,0,0,0|2,0,0]=4 2663 B9R1.14 CCn1ccnc1NC Amb18284804 [1,1,0,0,0,0|2,0,0]=4 2664 B9R1.14 CCn1nccc1CO Amb6890431 [1,1,0,0,0,0|2,0,0]=4 2665 B9R1.14 CCn1ncnc1CBr Amb24523072 [1,1,0,0,0,0|2,0,0]=4 2666 B9R1.14 CCn1ncnc1CCl Amb24269279 [1,1,0,0,0,0|2,0,0]=4 2667 B9R1.14 CCn1ncnc1CCl Amb33421941 [1,1,0,0,0,0|2,0,0]=4 2668 B9R1.14 CCn1ncnc1CI Amb27223062 [1,1,0,0,0,0|2,0,0]=4 2669 B9R1.14 CCn1ncnc1CN Amb18287033 [1,1,0,0,0,0|2,0,0]=4 2670 B9R1.14 CCn1ncnc1CO Amb7990130 [1,1,0,0,0,0|2,0,0]=4 2671 B9R1.14 CCn1ncnc1CS Amb24478679 [1,1,0,0,0,0|2,0,0]=4 2672 B9R1.14 COc1ccsc1CN Amb9677583 [1,1,0,0,0,0|2,0,0]=4 2673 B9R1.14 COc1ccsc1CO Amb16231069 [1,1,0,0,0,0|1,0,0]=3 2674 B9R1.14 COc1ccsc1SC Amb27219076 [1,1,0,0,0,0|2,0,0]=4 2675 B9R1.14 COc1ncsc1C#N Amb24528426 [1,1,0,0,0,0|1,0,1]=4 2676 B9R1.14 COc1sccc1CO Amb27422738 [1,1,0,0,0,0|2,0,0]=4 2677 B9R1.14 COc1sccc1SC Amb28053322 [1,1,0,0,0,0|2,0,0]=4 2678 B9R1.14 COc1scnc1C#N Amb28384864 [1,1,0,0,0,0|1,0,1]=4 2679 B9R1.14 CSc1nccn1CO Amb28315520 [1,1,0,0,0,0|2,0,0]=4 2680 B9R1.14 ClCc1ncsc1CCl Amb24117900 [1,1,0,0,0,0|1,0,0]=3 2681 B9R1.14 ClCc1ncsc1CCl Amb28186764 [1,1,0,0,0,0|1,0,0]=3 2682 B9R1.14 ClCc1ncsc1CCl Amb33624657 [1,1,0,0,0,0|1,0,0]=3 2683 B9R1.14 N#Cc1ccsc1CO Amb24685120 [1,1,0,0,0,0|1,0,1]=4 2684 B9R1.14 N#Cc1ncsc1CBr Amb28364422 [1,1,0,0,0,0|1,0,1]=4 2685 B9R1.14 NCc1ccsc1CO Amb32759351 [1,1,0,0,0,0|1,0,0]=3 2686 B9R1.14 O=Cc1ccsc1CO Amb24665662 [1,1,0,0,0,0|1,0,1]=4 2687 B9R1.14 O=Cc1ncsc1CBr Amb27838604 [1,1,0,0,0,0|1,0,1]=4 2688 B9R1.14 OCc1ccoc1CO Amb25226420 [1,1,0,0,0,0|1,1,0]=4 2689 B9R1.14 OCc1ccsc1CO Amb2236395 [1,1,0,0,0,0|1,0,0]=3 2690 B9R1.14 OCc1nccn1CO Amb27167644 [1,1,0,0,0,0|2,0,0]=4 2691 B9R1.14 OCc1ncsc1CO Amb22749254 [1,1,0,0,0,0|0,0,0]=2 2692 B9R1.14 OCc1nonc1CO Amb6565397 [1,1,0,0,0,0|2,0,0]=4 2693 B9R1.22 BrCc1sc(Br)nc1Br Amb28401536 [1,1,0,0,0,0|2,0,0]=4 2694 B9R1.22 CC1=C(CO)OC(=O)O1 Amb21962117 [1,1,0,0,0,0|1,1,0]=4 2695 B9R1.22 CC1=C(CO)OC(=S)O1 Amb27221244 [1,1,0,0,0,0|1,1,0]=4 2696 B9R1.22 CCC1=C(C)NC(=O)N1 Amb19766314 [1,1,0,0,0,0|1,0,1]=4 2697 B9R1.22 CCC1=C(C)NC(=S)N1 Amb19769644 [1,1,0,0,0,0|1,0,1]=4 2698 B9R1.22 CCC1SC(C)=NC1C Amb24716975 [1,1,0,0,0,0|0,0,2]=4 2699 B9R1.22 CCC1SC(N)=NC1=O Amb2497854 [1,1,0,0,0,0|1,0,1]=4 2700 B9R1.22 CCc1cc(Cl)nn1C Amb27636459 [1,1,0,0,0,0|2,0,0]=4 2701 B9R1.22 CCc1cc(N)nn1C Amb32663863 [1,1,0,0,0,0|2,0,0]=4 2702 B9R1.22 CCc1cc(N)nn1C Amb33531325 [1,1,0,0,0,0|2,0,0]=4 2703 B9R1.22 CCc1cc(N)oc1C Amb18832816 [1,1,0,0,0,0|2,0,0]=4 2704 B9R1.22 CCc1cc(N)sc1C Amb18831669 [1,1,0,0,0,0|2,0,0]=4 2705 B9R1.22 CCc1nc(Br)nn1C Amb22411530 [1,1,0,0,0,0|2,0,0]=4 2706 B9R1.22 CCc1nc(C)oc1C Amb25912940 [1,1,0,0,0,0|2,0,0]=4 2707 B9R1.22 CCc1nc(C)sc1C Amb27468943 [1,1,0,0,0,0|2,0,0]=4 2708 B9R1.22 CCc1nc(Cl)nn1C Amb24523025 [1,1,0,0,0,0|2,0,0]=4 2709 B9R1.22 CCc1nc(Cl)sc1C Amb18177753 [1,1,0,0,0,0|2,0,0]=4 2710 B9R1.22 CCc1nc(I)nn1C Amb32757539 [1,1,0,0,0,0|2,0,0]=4 2711 B9R1.22 CCc1nc(N)nn1C Amb10607642 [1,1,0,0,0,0|2,0,0]=4 2712 B9R1.22 CCc1nc(N)oc1C Amb18946532 [1,1,0,0,0,0|2,0,0]=4 2713 B9R1.22 CCc1nc(N)sc1C Amb10201586 [1,1,0,0,0,0|2,0,0]=4 2714 B9R1.22 CCc1nc(N)sc1C Amb1133891 [1,1,0,0,0,0|2,0,0]=4 2715 B9R1.22 CCc1nc(S)sc1C Amb18636626 [1,1,0,0,0,0|2,0,0]=4 2716 B9R1.22 CCc1oc(Br)nc1C Amb27812219 [1,1,0,0,0,0|0,1,0]=3 2717 B9R1.22 CCc1oc(C)nc1C Amb27593942 [1,1,0,0,0,0|0,1,0]=3 2718 B9R1.22 CCc1oc(N)cc1C Amb18832815 [1,1,0,0,0,0|1,1,0]=4 2719 B9R1.22 CCc1oc(S)nc1C Amb28285200 [1,1,0,0,0,0|0,1,0]=3 2720 B9R1.22 CCc1sc(Br)nc1C Amb27411354 [1,1,0,0,0,0|0,0,0]=2 2721 B9R1.22 CCc1sc(C)nc1C Amb26866464 [1,1,0,0,0,0|0,0,0]=2 2722 B9R1.22 CCc1sc(Cl)nc1C Amb27838566 [1,1,0,0,0,0|0,0,0]=2 2723 B9R1.22 CCc1sc(N)cc1Br Amb18140453 [1,1,0,0,0,0|2,0,0]=4 2724 B9R1.22 CCc1sc(N)cc1C Amb18143528 [1,1,0,0,0,0|1,0,0]=3 2725 B9R1.22 CCc1sc(N)nc1C Amb18111981 [1,1,0,0,0,0|0,0,0]=2 2726 B9R1.22 CCc1sc(N)nc1O Amb28318918 [1,1,0,0,0,0|1,0,0]=3 2727 B9R1.22 CCn1cc(Br)nc1C Amb7093832 [1,1,0,0,0,0|2,0,0]=4 2728 B9R1.22 CCn1cc(C)nc1C Amb27837712 [1,1,0,0,0,0|2,0,0]=4 2729 B9R1.22 CCn1cc(N)nc1C Amb18832800 [1,1,0,0,0,0|2,0,0]=4 2730 B9R1.22 CCn1nc(Br)nc1C Amb26341313 [1,1,0,0,0,0|2,0,0]=4 2731 B9R1.22 COc1sc(C)nc1Br Amb26594054 [1,1,0,0,0,0|2,0,0]=4 2732 B9R1.22 CSc1sc(Cl)nc1Cl Amb27601450 [1,1,0,0,0,0|2,0,0]=4 2733 B9R1.22 CSc1sc(N)nc1C Amb6268288 [1,1,0,0,0,0|1,0,0]=3 2734 B9R1.22 Cc1cc(Br)oc1CO Amb27180451 [1,1,0,0,0,0|1,1,0]=4 2735 B9R1.22 Cc1cc(C)c(CBr)s1 Amb27173039 [1,1,0,0,0,0|2,0,0]=4 2736 B9R1.22 Cc1cc(C)c(CCl)s1 Amb27838479 [1,1,0,0,0,0|2,0,0]=4 2737 B9R1.22 Cc1cc(C)c(CN)s1 Amb27838480 [1,1,0,0,0,0|2,0,0]=4 2738 B9R1.22 Cc1cc(C)c(CS)s1 Amb32788247 [1,1,0,0,0,0|1,1,0]=4 2739 B9R1.22 Cc1cc(CO)c(C)o1 Amb9004306 [1,1,0,0,0,0|2,0,0]=4 2740 B9R1.22 Cc1cc(CO)c(C)s1 Amb8846380 [1,1,0,0,0,0|2,0,0]=4 2741 B9R1.22 Cc1cc(CO)n(C)n1 Amb2723188 [1,1,0,0,0,0|2,0,0]=4 2742 B9R1.22 Cc1nc(Br)c(CBr)s1 Amb22900022 [1,1,0,0,0,0|2,0,0]=4 2743 B9R1.22 Cc1nc(Br)oc1CF Amb27421881 [1,1,0,0,0,0|1,1,0]=4 2744 B9R1.22 Cc1nc(Br)sc1C=O Amb18176304 [1,1,0,0,0,0|0,0,2]=4 2745 B9R1.22 Cc1nc(Br)sc1CO Amb27838600 [1,1,0,0,0,0|0,0,0]=2 2746 B9R1.22 Cc1nc(C)c(C#N)s1 Amb23504074 [1,1,0,0,0,0|1,0,1]=4 2747 B9R1.22 Cc1nc(C)c(C=O)s1 Amb2723087 [1,1,0,0,0,0|0,0,2]=4 2748 B9R1.22 Cc1nc(C)c(CBr)s1 Amb18206058 [1,1,0,0,0,0|1,0,0]=3 2749 B9R1.22 Cc1nc(C)c(CCl)o1 Amb22235325 [1,1,0,0,0,0|1,1,0]=4 2750 B9R1.22 Cc1nc(C)c(CCl)s1 Amb16234113 [1,1,0,0,0,0|1,0,0]=3 2751 B9R1.22 Cc1nc(C)c(CCl)s1 Amb22587034 [1,1,0,0,0,0|1,0,0]=3 2752 B9R1.22 Cc1nc(C)c(CN)o1 Amb18251097 [1,1,0,0,0,0|1,1,0]=4 2753 B9R1.22 Cc1nc(C)c(CN)o1 Amb30867991 [1,1,0,0,0,0|1,1,0]=4 2754 B9R1.22 Cc1nc(C)c(CN)o1 Amb32664200 [1,1,0,0,0,0|1,1,0]=4 2755 B9R1.22 Cc1nc(C)c(CN)s1 Amb21955659 [1,1,0,0,0,0|1,0,0]=3 2756 B9R1.22 Cc1nc(C)c(CN)s1 Amb9173370 [1,1,0,0,0,0|1,0,0]=3 2757 B9R1.22 Cc1nc(C)c(CO)o1 Amb10608521 [1,1,0,0,0,0|0,1,0]=3 2758 B9R1.22 Cc1nc(C)c(CO)s1 Amb2723088 [1,1,0,0,0,0|0,0,0]=2 2759 B9R1.22 Cc1nc(C)c(CS)s1 Amb18206092 [1,1,0,0,0,0|0,1,0]=3 2760 B9R1.22 Cc1nc(CO)c(C)o1 Amb2723403 [1,1,0,0,0,0|2,0,0]=4 2761 B9R1.22 Cc1nc(CO)c(C)s1 Amb23438059 [1,1,0,0,0,0|2,0,0]=4 2762 B9R1.22 Cc1nc(Cl)sc1C=O Amb19648751 [1,1,0,0,0,0|0,0,2]=4 2763 B9R1.22 Cc1nc(Cl)sc1CBr Amb33231027 [1,1,0,0,0,0|1,0,0]=3 2764 B9R1.22 Cc1nc(Cl)sc1CO Amb19649017 [1,1,0,0,0,0|0,0,0]=2 2765 B9R1.22 Cc1nc(N)c(CN)s1 Amb24687981 [1,1,0,0,0,0|2,0,0]=4 2766 B9R1.22 Cc1nc(N)sc1C#N Amb27961343 [1,1,0,0,0,0|1,0,1]=4 2767 B9R1.22 Cc1nc(N)sc1C#N Amb28935023 [1,1,0,0,0,0|1,0,1]=4 2768 B9R1.22 Cc1nc(N)sc1C=O Amb24053082 [1,1,0,0,0,0|0,0,2]=4 2769 B9R1.22 Cc1nc(O)c(CN)s1 Amb27478736 [1,1,0,0,0,0|2,0,0]=4 2770 B9R1.22 Cc1nc(O)oc1CF Amb27848265 [1,1,0,0,0,0|1,1,0]=4 2771 B9R1.22 Cc1nn(C)cc1CO Amb1933751 [1,1,0,0,0,0|2,0,0]=4 2772 B9R1.22 Cc1oc(=O)oc1CO Amb22270084 [1,1,0,0,0,0|1,1,0]=4 2773 B9R1.22 Cc1oc(Br)cc1CO Amb27805528 [1,1,0,0,0,0|2,0,0]=4 2774 B9R1.22 Cc1oc(N)nc1CO Amb27421556 [1,1,0,0,0,0|2,0,0]=4 2775 B9R1.22 Cc1sc(Br)cc1CO Amb28255674 [1,1,0,0,0,0|2,0,0]=4 2776 B9R1.22 Cc1sc(Br)nc1CO Amb22500774 [1,1,0,0,0,0|2,0,0]=4 2777 B9R1.22 Cc1sc(Cl)nc1CO Amb22500779 [1,1,0,0,0,0|2,0,0]=4 2778 B9R1.22 Cc1sc(N)nc1CO Amb22500860 [1,1,0,0,0,0|2,0,0]=4 2779 B9R1.22 ClCc1sc(Br)nc1Br Amb28429733 [1,1,0,0,0,0|2,0,0]=4 2780 B9R1.22 ClCc1sc(Cl)nc1Cl Amb25995180 [1,1,0,0,0,0|2,0,0]=4 2781 B9R1.22 Clc1nc(Cl)c(CBr)s1 Amb27838581 [1,1,0,0,0,0|2,0,0]=4 2782 B9R1.22 Cn1nc(Br)cc1CO Amb25267921 [1,1,0,0,0,0|2,0,0]=4 2783 B9R1.22 Cn1nc(I)cc1CO Amb33621384 [1,1,0,0,0,0|2,0,0]=4 2784 B9R1.22 Cn1nc(N)cc1CO Amb20619775 [1,1,0,0,0,0|2,0,0]=4 2785 B9R1.22 NC1=NC(=O)\C(=N\O)S1 Amb27877861 [1,1,0,0,0,0|2,0,0]=4 2786 B9R1.22 NCc1sc(Br)nc1Br Amb27946059 [1,1,0,0,0,0|2,0,0]=4 2787 B9R1.22 NCc1sc(Cl)nc1Cl Amb28204120 [1,1,0,0,0,0|2,0,0]=4 2788 B9R1.22 OCc1sc(Br)cc1Br Amb33006819 [1,1,0,0,0,0|2,0,0]=4 2789 B9R1.22 OCc1sc(Br)nc1Br Amb10602532 [1,1,0,0,0,0|1,0,0]=3 2790 B9R1.22 OCc1sc(Cl)nc1Cl Amb10602534 [1,1,0,0,0,0|1,0,0]=3 2791 B9R1.22 SCc1sc(Cl)nc1Cl Amb32788461 [1,1,0,0,0,0|1,1,0]=4 2792 B9R1.27 CC1=CN=C(C)\C1=C\O Amb27635038 [1,1,0,0,0,0|1,0,1]=4 2793 B9R1.27 CCC1=C(C)C=NC1=O Amb27750220 [1,1,0,0,0,0|2,0,0]=4 2794 B9R1.27 CCc1c(Br)cnn1C Amb19517089 [1,1,0,0,0,0|2,0,0]=4 2795 B9R1.27 CCc1c(C)ccn1C Amb28145539 [1,1,0,0,0,0|2,0,0]=4 2796 B9R1.27 CCc1c(C)noc1N Amb8503398 [1,1,0,0,0,0|2,0,0]=4 2797 B9R1.27 CCc1c(C)noc1O Amb6537618 [1,1,0,0,0,0|2,0,0]=4 2798 B9R1.27 CCc1c(Cl)cnn1C Amb33188875 [1,1,0,0,0,0|2,0,0]=4 2799 B9R1.27 CCc1c(I)cnn1C Amb20619316 [1,1,0,0,0,0|2,0,0]=4 2800 B9R1.27 CCc1c(N)cnn1C Amb22059819 [1,1,0,0,0,0|2,0,0]=4 2801 B9R1.27 CCc1c(N)cnn1C Amb33527628 [1,1,0,0,0,0|2,0,0]=4 2802 B9R1.27 CCn1c(Cl)cnc1C Amb19514688 [1,1,0,0,0,0|2,0,0]=4 2803 B9R1.27 Cc1ccn(C)c1CO Amb23441151 [1,1,0,0,0,0|2,0,0]=4 2804 B9R1.27 Cc1cnn(C)c1CO Amb24269234 [1,1,0,0,0,0|2,0,0]=4 2805 B9R1.27 Cc1csc(C)c1CO Amb25296332 [1,1,0,0,0,0|2,0,0]=4 2806 B9R1.27 Cc1ncn(C)c1CBr Amb24452209 [1,1,0,0,0,0|2,0,0]=4 2807 B9R1.27 Cc1ncn(C)c1CN Amb8011511 [1,1,0,0,0,0|2,0,0]=4 2808 B9R1.27 Cc1ncn(C)c1CO Amb27950167 [1,1,0,0,0,0|1,0,0]=3 2809 B9R1.27 Cc1nnn(C)c1CO Amb24397235 [1,1,0,0,0,0|2,0,0]=4 2810 B9R1.27 Cc1noc(C)c1CO Amb2411534 [1,1,0,0,0,0|2,0,0]=4 2811 B9R1.27 Cc1nsc(C)c1CO Amb25281986 [1,1,0,0,0,0|2,0,0]=4 2812 B9R1.27 Cn1cnc(Br)c1CO Amb23441159 [1,1,0,0,0,0|2,0,0]=4 2813 B9R1.27 Cn1ncc(Br)c1CO Amb20619739 [1,1,0,0,0,0|2,0,0]=4 2814 B9R1.27 Cn1ncc(Cl)c1CO Amb20619725 [1,1,0,0,0,0|2,0,0]=4 2815 B9R1.27 Cn1ncc(I)c1CO Amb25091672 [1,1,0,0,0,0|2,0,0]=4 2816 B9R1.41 C=C(C)c1sccc1C Amb27235420 [1,1,0,0,0,0|1,0,1]=4 2817 B9R1.41 CC(=O)c1sccc1C Amb3940405 [1,1,0,0,0,0|1,0,1]=4 2818 B9R1.41 CC(=O)c1scnc1Br Amb18176253 [1,1,0,0,0,0|1,0,1]=4 2819 B9R1.41 CC(=O)c1scnc1C Amb7969579 [1,1,0,0,0,0|0,0,1]=3 2820 B9R1.41 CC(=O)c1scnc1N Amb18831647 [1,1,0,0,0,0|1,0,1]=4 2821 B9R1.41 CC(=O)c1snnc1C Amb18202588 [1,1,0,0,0,0|1,0,1]=4 2822 B9R1.41 CC(C)c1ncnn1C Amb28062979 [1,1,0,0,0,0|2,0,0]=4 2823 B9R1.41 CC(C)c1scnc1Br Amb18176237 [1,1,0,0,0,0|1,0,0]=3 2824 B9R1.41 CC(C)c1scnc1N Amb24317507 [1,1,0,0,0,0|1,0,0]=3 2825 B9R1.41 CC(C)c1scnc1N Amb28895947 [1,1,0,0,0,0|1,0,0]=3 2826 B9R1.41 CC(C)c1snnc1Br Amb18176438 [1,1,0,0,0,0|2,0,0]=4 2827 B9R1.41 CC(Cl)c1ncnn1C Amb27588910 [1,1,0,0,0,0|2,0,0]=4 2828 B9R1.41 CC(N)c1ccnn1C Amb33542118 [1,1,0,0,0,0|2,0,0]=4 2829 B9R1.41 CC(N)c1ncnn1C Amb10607854 [1,1,0,0,0,0|2,0,0]=4 2830 B9R1.41 CC(N)c1ncnn1C Amb28934968 [1,1,0,0,0,0|2,0,0]=4 2831 B9R1.41 CC(N)c1sccc1Br Amb9620855 [1,1,0,0,0,0|2,0,0]=4 2832 B9R1.41 CC(N)c1sccc1Cl Amb26907233 [1,1,0,0,0,0|2,0,0]=4 2833 B9R1.41 CC(N)c1sccc1N Amb27828072 [1,1,0,0,0,0|2,0,0]=4 2834 B9R1.41 CC(O)c1ccnn1C Amb26961603 [1,1,0,0,0,0|2,0,0]=4 2835 B9R1.41 CC(O)c1ncnn1C Amb25084897 [1,1,0,0,0,0|2,0,0]=4 2836 B9R1.41 CC(O)c1sccc1Cl Amb27838427 [1,1,0,0,0,0|2,0,0]=4 2837 B9R1.41 CC(S)c1ccnn1C Amb27457486 [1,1,0,0,0,0|2,0,0]=4 2838 B9R1.41 CC(S)c1sccc1Br Amb32788826 [1,1,0,0,0,0|2,0,0]=4 2839 B9R1.41 CC1=C(C(C)C)CC=C1 Amb27449799 [1,1,0,0,0,0|2,0,0]=4 2840 B9R1.41 C[C@@H](N)c1ccnn1C Amb26885469 [1,1,0,0,0,0|2,0,0]=4 2841 B9R1.41 C[C@@H](N)c1ccnn1C Amb35750376 [1,1,0,0,0,0|2,0,0]=4 2842 B9R1.41 C[C@@H](N)c1sccc1Br Amb24429631 [1,1,0,0,0,0|2,0,0]=4 2843 B9R1.41 C[C@@H](N)c1sccc1Cl Amb27975481 [1,1,0,0,0,0|2,0,0]=4 2844 B9R1.41 C[C@@H](N)c1sccc1N Amb27620285 [1,1,0,0,0,0|2,0,0]=4 2845 B9R1.41 C[C@@H](N)c1sccc1O Amb27779882 [1,1,0,0,0,0|2,0,0]=4 2846 B9R1.41 C[C@@H](O)c1ccnn1C Amb26885470 [1,1,0,0,0,0|2,0,0]=4 2847 B9R1.41 C[C@@H](O)c1sccc1Br Amb27834430 [1,1,0,0,0,0|2,0,0]=4 2848 B9R1.41 C[C@@H](O)c1sccc1Cl Amb27978899 [1,1,0,0,0,0|2,0,0]=4 2849 B9R1.41 C[C@H](N)c1ccnn1C Amb25889535 [1,1,0,0,0,0|2,0,0]=4 2850 B9R1.41 C[C@H](N)c1ccnn1C Amb35752337 [1,1,0,0,0,0|2,0,0]=4 2851 B9R1.41 C[C@H](N)c1sccc1Br Amb26557953 [1,1,0,0,0,0|2,0,0]=4 2852 B9R1.41 C[C@H](N)c1sccc1Cl Amb26354987 [1,1,0,0,0,0|2,0,0]=4 2853 B9R1.41 C[C@H](N)c1sccc1I Amb27962883 [1,1,0,0,0,0|2,0,0]=4 2854 B9R1.41 C[C@H](O)c1ccnn1C Amb27835648 [1,1,0,0,0,0|2,0,0]=4 2855 B9R1.41 C[C@H](O)c1sccc1Br Amb26038653 [1,1,0,0,0,0|2,0,0]=4 2856 B9R1.41 C[C@H](O)c1sccc1Cl Amb24363179 [1,1,0,0,0,0|2,0,0]=4 2857 B9R1.41 Cc1ccoc1C(C)C Amb28195198 [1,1,0,0,0,0|1,1,0]=4 2858 B9R1.41 Cc1ccoc1C(C)N Amb18203315 [1,1,0,0,0,0|1,1,0]=4 2859 B9R1.41 Cc1ccoc1[C@@H](C)N Amb25707081 [1,1,0,0,0,0|1,1,0]=4 2860 B9R1.41 Cc1ccoc1[C@@H](C)O Amb26578606 [1,1,0,0,0,0|1,1,0]=4 2861 B9R1.41 Cc1ccoc1[C@H](C)N Amb26318395 [1,1,0,0,0,0|1,1,0]=4 2862 B9R1.41 Cc1ccoc1[C@H](C)O Amb27653321 [1,1,0,0,0,0|1,1,0]=4 2863 B9R1.41 Cc1ccsc1B(O)O Amb6487342 [1,1,0,0,0,0|2,0,0]=4 2864 B9R1.41 Cc1ccsc1C(=O)O Amb2695360 [1,1,0,0,0,0|1,0,1]=4 2865 B9R1.41 Cc1ccsc1C(C)Cl Amb28049255 [1,1,0,0,0,0|1,0,0]=3 2866 B9R1.41 Cc1ccsc1C(C)N Amb18279251 [1,1,0,0,0,0|1,0,0]=3 2867 B9R1.41 Cc1ccsc1C(C)O Amb24556518 [1,1,0,0,0,0|1,0,0]=3 2868 B9R1.41 Cc1ccsc1C(C)S Amb24505030 [1,1,0,0,0,0|1,0,0]=3 2869 B9R1.41 Cc1ccsc1C(Cl)Cl Amb28121097 [1,1,0,0,0,0|2,0,0]=4 2870 B9R1.41 Cc1ccsc1N(C)C Amb27441901 [1,1,0,0,0,0|2,0,0]=4 2871 B9R1.41 Cc1ccsc1[C@@H](C)N Amb27235595 [1,1,0,0,0,0|1,0,0]=3 2872 B9R1.41 Cc1ccsc1[C@@H](C)O Amb25842069 [1,1,0,0,0,0|1,0,0]=3 2873 B9R1.41 Cc1ccsc1[C@H](C)N Amb25710219 [1,1,0,0,0,0|1,0,0]=3 2874 B9R1.41 Cc1ccsc1[C@H](C)O Amb25088944 [1,1,0,0,0,0|1,0,0]=3 2875 B9R1.41 Cc1nccn1C(C)C Amb25267403 [1,1,0,0,0,0|2,0,0]=4 2876 B9R1.41 Cc1ncoc1C(=O)O Amb2723146 [1,1,0,0,0,0|0,1,1]=4 2877 B9R1.41 Cc1ncoc1C(C)C Amb27186120 [1,1,0,0,0,0|0,1,0]=3 2878 B9R1.41 Cc1ncoc1C(C)Cl Amb27980512 [1,1,0,0,0,0|0,1,0]=3 2879 B9R1.41 Cc1ncoc1C(C)N Amb18832735 [1,1,0,0,0,0|0,1,0]=3 2880 B9R1.41 Cc1ncoc1C(C)O Amb27208034 [1,1,0,0,0,0|0,1,0]=3 2881 B9R1.41 Cc1ncsc1B(O)O Amb29849571 [1,1,0,0,0,0|1,0,0]=3 2882 B9R1.41 Cc1ncsc1C(=N)N Amb18206363 [1,1,0,0,0,0|1,0,1]=4 2883 B9R1.41 Cc1ncsc1C(=O)Cl Amb6743387 [1,1,0,0,0,0|0,0,2]=4 2884 B9R1.41 Cc1ncsc1C(=O)O Amb6336150 [1,1,0,0,0,0|0,0,1]=3 2885 B9R1.41 Cc1ncsc1C(C)C Amb27469092 [1,1,0,0,0,0|0,0,0]=2 2886 B9R1.41 Cc1ncsc1C(C)Cl Amb27658920 [1,1,0,0,0,0|0,0,0]=2 2887 B9R1.41 Cc1ncsc1C(C)N Amb32666352 [1,1,0,0,0,0|0,0,0]=2 2888 B9R1.41 Cc1ncsc1C(C)N Amb7970157 [1,1,0,0,0,0|0,0,0]=2 2889 B9R1.41 Cc1ncsc1C(C)S Amb32788150 [1,1,0,0,0,0|0,0,0]=2 2890 B9R1.41 Cc1ncsc1C(N)=S Amb18206370 [1,1,0,0,0,0|0,1,1]=4 2891 B9R1.41 Cc1ncsc1[C@@H](C)N Amb27442279 [1,1,0,0,0,0|0,0,0]=2 2892 B9R1.41 Cc1ncsc1[C@@H](C)N Amb32662862 [1,1,0,0,0,0|0,0,0]=2 2893 B9R1.41 Cc1ncsc1[C@@H](C)O Amb27479119 [1,1,0,0,0,0|0,0,0]=2 2894 B9R1.41 Cc1ncsc1[C@H](C)N Amb26912199 [1,1,0,0,0,0|0,0,0]=2 2895 B9R1.41 Cc1ncsc1[C@H](C)O Amb24457287 [1,1,0,0,0,0|0,0,0]=2 2896 B9R1.41 Cc1ncsc1[N+](=O)[O-] Amb27472617 [1,1,0,0,0,0|1,0,1]=4 2897 B9R1.41 Cc1nnsc1C(=O)O Amb1063483 [1,1,0,0,0,0|1,0,1]=4 2898 B9R1.41 Cc1nnsc1C(C)Br Amb28285139 [1,1,0,0,0,0|1,0,0]=3 2899 B9R1.41 Cc1nnsc1C(C)N Amb24737019 [1,1,0,0,0,0|1,0,0]=3 2900 B9R1.41 Cc1nnsc1C(C)O Amb26472641 [1,1,0,0,0,0|1,0,0]=3 2901 B9R1.41 Cc1nnsc1[C@@H](C)N Amb33041160 [1,1,0,0,0,0|1,0,0]=3 2902 B9R1.41 Cc1nnsc1[C@H](C)N Amb33041162 [1,1,0,0,0,0|1,0,0]=3 2903 B9R1.41 Cc1nocc1C(C)O Amb32664955 [1,1,0,0,0,0|2,0,0]=4 2904 B9R1.41 Cc1occc1C(C)N Amb26595838 [1,1,0,0,0,0|2,0,0]=4 2905 B9R1.41 Cc1occc1[C@@H](C)N Amb27405739 [1,1,0,0,0,0|2,0,0]=4 2906 B9R1.41 Cc1occc1[C@@H](C)O Amb27768676 [1,1,0,0,0,0|2,0,0]=4 2907 B9R1.41 Cc1occc1[C@H](C)N Amb27869456 [1,1,0,0,0,0|2,0,0]=4 2908 B9R1.41 Cc1occc1[C@H](C)O Amb24403069 [1,1,0,0,0,0|2,0,0]=4 2909 B9R1.41 Cc1ocnc1C(C)N Amb18832731 [1,1,0,0,0,0|2,0,0]=4 2910 B9R1.41 Cc1sccc1C(C)C Amb28436489 [1,1,0,0,0,0|2,0,0]=4 2911 B9R1.41 Cc1sccc1C(C)N Amb18202673 [1,1,0,0,0,0|2,0,0]=4 2912 B9R1.41 Cc1sccc1[C@@H](C)N Amb27172769 [1,1,0,0,0,0|2,0,0]=4 2913 B9R1.41 Cc1scnc1C(C)N Amb17318124 [1,1,0,0,0,0|2,0,0]=4 2914 B9R1.41 Cc1scnc1C(C)N Amb24178933 [1,1,0,0,0,0|2,0,0]=4 2915 B9R1.41 Cc1scnc1C(C)O Amb28292519 [1,1,0,0,0,0|2,0,0]=4 2916 B9R1.41 FC(F)c1scnc1Br Amb31377598 [1,1,0,0,0,0|2,0,0]=4 2917 B9R1.41 FC(F)c1scnc1Cl Amb31377591 [1,1,0,0,0,0|2,0,0]=4 2918 B9R1.41 Nc1ncsc1C(=O)O Amb24481890 [1,1,0,0,0,0|1,0,1]=4 2919 B9R1.41 O=C(O)c1scnc1Br Amb18778174 [1,1,0,0,0,0|1,0,1]=4 2920 B9R1.41 O=C(O)c1scnc1Cl Amb6479171 [1,1,0,0,0,0|1,0,1]=4 2921 B9R1.41 O=C(O)c1scnc1S Amb27490987 [1,1,0,0,0,0|1,0,1]=4 2922 B9R1.132 Cc1c(Br)csc1CO Amb26961495 [1,1,0,0,0,0|1,0,0]=3 2923 B9R1.132 Cc1c(CO)ncn1C Amb25187373 [1,1,0,0,0,0|1,0,1]=4 2924 B9R1.132 Cc1csc(CO)c1Br Amb33433836 [1,1,0,0,0,0|2,0,0]=4 2925 B9R1.132 Cc1csc(CO)c1Cl Amb26588019 [1,1,0,0,0,0|2,0,0]=4 2926 B11R1.13 CC1=C(CCO)C=CNC1=O Amb27795184 [0,1,0,0,0,1|1,0,1]=4 2927 B11R1.13 Cc1c(Br)cccc1CCO Amb27823517 [0,1,0,0,0,1|2,0,0]=4 2928 B11R1.13 Cc1c(CCN)ccnc1F Amb27460784 [0,1,0,0,0,1|2,0,0]=4 2929 B11R1.13 Cc1c(Cl)cccc1CCO Amb27593870 [0,1,0,0,0,1|2,0,0]=4 2930 B11R1.13 Cc1c(F)cccc1CCO Amb25256405 [0,1,0,0,0,1|2,0,0]=4 2931 B11R1.13 Cc1cccc(CCO)c1C Amb18181673 [0,1,0,0,0,1|2,0,0]=4 2932 B11R1.13 Cc1nccc(CCN)c1C Amb27823452 [0,1,0,0,0,1|2,0,0]=4 2933 B11R1.13 Cc1ncnc(CCN)c1C Amb18201447 [0,1,0,0,0,1|2,0,0]=4 2934 B11R1.17 C#CCCc1cccnc1C Amb32878342 [0,1,0,0,0,1|2,0,0]=4 2935 B11R1.17 C#CCCc1ccncc1C Amb33426430 [0,1,0,0,0,1|2,0,0]=4 2936 B11R1.17 C#CCCc1cncnc1C Amb33149100 [0,1,0,0,0,1|2,0,0]=4 2937 B11R1.17 C#CCCc1nccnc1C Amb33141637 [0,1,0,0,0,1|2,0,0]=4 2938 B11R1.17 CCCCc1nccnc1C Amb22234797 [0,1,0,0,0,1|2,0,0]=4 2939 B11R1.17 CCCNc1ccncc1C Amb28437320 [0,1,0,0,0,1|2,0,0]=4 2940 B11R1.17 CCCNc1cncnc1C Amb27665250 [0,1,0,0,0,1|2,0,0]=4 2941 B11R1.17 CCCNc1nccnc1C Amb35678390 [0,1,0,0,0,1|2,0,0]=4 2942 B11R1.17 CCCOc1cccnc1C Amb27668969 [0,1,0,0,0,1|2,0,0]=4 2943 B11R1.17 CCCOc1nccnc1C Amb27242253 [0,1,0,0,0,1|2,0,0]=4 2944 B11R1.17 CCNCc1nccnc1C Amb35601048 [0,1,0,0,0,1|2,0,0]=4 2945 B11R1.17 CNCCc1cccnc1C Amb24635443 [0,1,0,0,0,1|2,0,0]=4 2946 B11R1.17 CNCCc1ccncc1C Amb25977379 [0,1,0,0,0,1|2,0,0]=4 2947 B11R1.17 CNCCc1cncnc1C Amb33472506 [0,1,0,0,0,1|2,0,0]=4 2948 B11R1.17 CNCCc1nccnc1C Amb33142591 [0,1,0,0,0,1|2,0,0]=4 2949 B11R1.17 COCCc1cccnc1N Amb27459527 [0,1,0,0,0,1|2,0,0]=4 2950 B11R1.17 COCCc1cncnc1Cl Amb23538201 [0,1,0,0,0,1|2,0,0]=4 2951 B11R1.17 COCCc1cncnc1O Amb23538347 [0,1,0,0,0,1|2,0,0]=4 2952 B11R1.17 CONCc1cccnc1C Amb27176647 [0,1,0,0,0,1|2,0,0]=4 2953 B11R1.17 CONCc1cncnc1C Amb27649155 [0,1,0,0,0,1|2,0,0]=4 2954 B11R1.17 CONCc1nccnc1C Amb35601049 [0,1,0,0,0,1|2,0,0]=4 2955 B11R1.17 Cc1ccccc1CCCO Amb17089494 [0,1,0,0,0,1|2,0,0]=4 2956 B11R1.17 Cc1ccccc1CCON Amb26991554 [0,1,0,0,0,1|2,0,0]=4 2957 B11R1.17 Cc1ccccc1NCCO Amb2720820 [0,1,0,0,0,1|2,0,0]=4 2958 B11R1.17 Cc1ccccc1OCCO Amb2209345 [0,1,0,0,0,1|2,0,0]=4 2959 B11R1.17 Cc1ccccc1SCCO Amb18180155 [0,1,0,0,0,1|2,0,0]=4 2960 B11R1.17 Cc1cccnc1CCCO Amb24685021 [0,1,0,0,0,1|2,0,0]=4 2961 B11R1.17 Cc1cccnc1CCON Amb33429250 [0,1,0,0,0,1|2,0,0]=4 2962 B11R1.17 Cc1cccnc1SCCO Amb18185610 [0,1,0,0,0,1|2,0,0]=4 2963 B11R1.17 Cc1ccncc1CCCO Amb25717118 [0,1,0,0,0,1|2,0,0]=4 2964 B11R1.17 Cc1ccncc1CCON Amb33376748 [0,1,0,0,0,1|2,0,0]=4 2965 B11R1.17 Cc1cnccc1C#CCO Amb28125077 [0,1,0,0,0,1|1,0,1]=4 2966 B11R1.17 Cc1cnccc1CCC#N Amb27788732 [0,1,0,0,0,1|2,0,0]=4 2967 B11R1.17 Cc1cnccc1CCC=O Amb33426427 [0,1,0,0,0,1|1,0,1]=4 2968 B11R1.17 Cc1cnccc1CCCBr Amb24611779 [0,1,0,0,0,1|2,0,0]=4 2969 B11R1.17 Cc1cnccc1CCCN Amb25916323 [0,1,0,0,0,1|2,0,0]=4 2970 B11R1.17 Cc1cnccc1CCCO Amb10573523 [0,1,0,0,0,1|1,0,0]=3 2971 B11R1.17 Cc1cnccc1CCCS Amb33426104 [0,1,0,0,0,1|1,1,0]=4 2972 B11R1.17 Cc1cnccc1CCON Amb33414181 [0,1,0,0,0,1|1,0,0]=3 2973 B11R1.17 Cc1cnccc1NCCN Amb8503377 [0,1,0,0,0,1|2,0,0]=4 2974 B11R1.17 Cc1cnccc1OCCN Amb27401371 [0,1,0,0,0,1|2,0,0]=4 2975 B11R1.17 Cc1cnccc1SCCO Amb27950192 [0,1,0,0,0,1|1,0,0]=3 2976 B11R1.17 Cc1cnccc1\C=C\CO Amb33414325 [0,1,0,0,0,1|1,0,1]=4 2977 B11R1.17 Cc1cncnc1CCCN Amb18201574 [0,1,0,0,0,1|2,0,0]=4 2978 B11R1.17 Cc1ncccc1CCC#N Amb32954009 [0,1,0,0,0,1|2,0,0]=4 2979 B11R1.17 Cc1ncccc1CCC=O Amb32879664 [0,1,0,0,0,1|1,0,1]=4 2980 B11R1.17 Cc1ncccc1CCCBr Amb33432593 [0,1,0,0,0,1|2,0,0]=4 2981 B11R1.17 Cc1ncccc1CCCN Amb26975097 [0,1,0,0,0,1|2,0,0]=4 2982 B11R1.17 Cc1ncccc1CCCO Amb24360630 [0,1,0,0,0,1|1,0,0]=3 2983 B11R1.17 Cc1ncccc1CCCS Amb32878313 [0,1,0,0,0,1|1,1,0]=4 2984 B11R1.17 Cc1ncccc1CCON Amb32879317 [0,1,0,0,0,1|1,0,0]=3 2985 B11R1.17 Cc1ncccc1NCCN Amb28365662 [0,1,0,0,0,1|2,0,0]=4 2986 B11R1.17 Cc1ncccc1OCCBr Amb25046512 [0,1,0,0,0,1|2,0,0]=4 2987 B11R1.17 Cc1ncccc1OCCN Amb26447701 [0,1,0,0,0,1|2,0,0]=4 2988 B11R1.17 Cc1ncccc1OCCO Amb24101976 [0,1,0,0,0,1|1,0,0]=3 2989 B11R1.17 Cc1ncccc1\C=C\CO Amb32878967 [0,1,0,0,0,1|1,0,1]=4 2990 B11R1.17 Cc1nccnc1CCC#N Amb33142585 [0,1,0,0,0,1|2,0,0]=4 2991 B11R1.17 Cc1nccnc1CCC=O Amb33141632 [0,1,0,0,0,1|1,0,1]=4 2992 B11R1.17 Cc1nccnc1CCCBr Amb33431494 [0,1,0,0,0,1|2,0,0]=4 2993 B11R1.17 Cc1nccnc1CCCN Amb18201572 [0,1,0,0,0,1|2,0,0]=4 2994 B11R1.17 Cc1nccnc1CCCO Amb33141633 [0,1,0,0,0,1|1,0,0]=3 2995 B11R1.17 Cc1nccnc1CCCS Amb33141696 [0,1,0,0,0,1|1,1,0]=4 2996 B11R1.17 Cc1nccnc1CCON Amb33142208 [0,1,0,0,0,1|1,0,0]=3 2997 B11R1.17 Cc1nccnc1NCCN Amb17515111 [0,1,0,0,0,1|2,0,0]=4 2998 B11R1.17 Cc1nccnc1OCCN Amb26348201 [0,1,0,0,0,1|2,0,0]=4 2999 B11R1.17 Cc1nccnc1\C=C\CO Amb35600851 [0,1,0,0,0,1|1,0,1]=4 3000 B11R1.17 Cc1ncncc1CCC#N Amb33472498 [0,1,0,0,0,1|2,0,0]=4 3001 B11R1.17 Cc1ncncc1CCC=O Amb33149097 [0,1,0,0,0,1|1,0,1]=4 3002 B11R1.17 Cc1ncncc1CCCBr Amb33006841 [0,1,0,0,0,1|2,0,0]=4 3003 B11R1.17 Cc1ncncc1CCCN Amb33472510 [0,1,0,0,0,1|2,0,0]=4 3004 B11R1.17 Cc1ncncc1CCCO Amb33149098 [0,1,0,0,0,1|1,0,0]=3 3005 B11R1.17 Cc1ncncc1CCCS Amb32876669 [0,1,0,0,0,1|1,1,0]=4 3006 B11R1.17 Cc1ncncc1CCON Amb33268137 [0,1,0,0,0,1|1,0,0]=3 3007 B11R1.17 Cc1ncncc1OCCN Amb32876685 [0,1,0,0,0,1|2,0,0]=4 3008 B11R1.17 Cc1ncncc1\C=C\CO Amb33149126 [0,1,0,0,0,1|1,0,1]=4 3009 B11R1.17 NOCCc1cccnc1Br Amb33387766 [0,1,0,0,0,1|2,0,0]=4 3010 B11R1.17 NOCCc1cccnc1Cl Amb33257319 [0,1,0,0,0,1|2,0,0]=4 3011 B11R1.17 NOCCc1cccnc1F Amb33377681 [0,1,0,0,0,1|2,0,0]=4 3012 B11R1.17 NOCCc1ccncc1Br Amb33388633 [0,1,0,0,0,1|2,0,0]=4 3013 B11R1.17 NOCCc1ccncc1Cl Amb33413759 [0,1,0,0,0,1|2,0,0]=4 3014 B11R1.17 NOCCc1ccncc1F Amb33317195 [0,1,0,0,0,1|2,0,0]=4 3015 B11R1.17 Nc1cnccc1NCCO Amb33529127 [0,1,0,0,0,1|2,0,0]=4 3016 B11R1.17 Nc1cnccc1OCCO Amb7765179 [0,1,0,0,0,1|2,0,0]=4 3017 B11R1.17 Nc1cncnc1OCCO Amb26654876 [0,1,0,0,0,1|2,0,0]=4 3018 B11R1.17 Nc1ncccc1CCCO Amb13890002 [0,1,0,0,0,1|2,0,0]=4 3019 B11R1.17 Nc1ncccc1OCCO Amb7787230 [0,1,0,0,0,1|2,0,0]=4 3020 B11R1.17 Nc1nccnc1OCCO Amb27239352 [0,1,0,0,0,1|2,0,0]=4 3021 B11R1.17 Nc1nccnc1SCCO Amb27229777 [0,1,0,0,0,1|2,0,0]=4 3022 B11R1.17 Nc1ncncc1NCCO Amb27966226 [0,1,0,0,0,1|2,0,0]=4 3023 B11R1.17 OCCCc1cccnc1Br Amb33388120 [0,1,0,0,0,1|2,0,0]=4 3024 B11R1.17 OCCCc1cccnc1Cl Amb32668114 [0,1,0,0,0,1|2,0,0]=4 3025 B11R1.17 OCCCc1cccnc1F Amb33377128 [0,1,0,0,0,1|2,0,0]=4 3026 B11R1.17 OCCCc1ccncc1Br Amb26577096 [0,1,0,0,0,1|2,0,0]=4 3027 B11R1.17 OCCCc1ccncc1Cl Amb23596495 [0,1,0,0,0,1|2,0,0]=4 3028 B11R1.17 OCCCc1ccncc1F Amb25825625 [0,1,0,0,0,1|2,0,0]=4 3029 B11R1.17 OCCCc1ccncc1O Amb27803932 [0,1,0,0,0,1|2,0,0]=4 3030 B11R1.17 OCCNc1ccncc1Br Amb27766939 [0,1,0,0,0,1|2,0,0]=4 3031 B11R1.17 OCCNc1ccncc1F Amb35737123 [0,1,0,0,0,1|2,0,0]=4 3032 B11R1.17 OCCNc1nccnc1Cl Amb2725329 [0,1,0,0,0,1|2,0,0]=4 3033 B11R1.17 OCCNc1nccnc1F Amb30018782 [0,1,0,0,0,1|2,0,0]=4 3034 B11R1.17 OCCOc1cccnc1Cl Amb24486639 [0,1,0,0,0,1|2,0,0]=4 3035 B11R1.17 OCCOc1cccnc1O Amb25106031 [0,1,0,0,0,1|2,0,0]=4 3036 B11R1.17 OCCOc1nccnc1Cl Amb18183884 [0,1,0,0,0,1|2,0,0]=4 3037 B11R1.17 OCCOc1nccnc1F Amb35729093 [0,1,0,0,0,1|2,0,0]=4 3038 B11R1.17 OCCSc1ccncc1F Amb30020309 [0,1,0,0,0,1|2,0,0]=4 3039 B11R1.17 OCCSc1nccnc1F Amb35729432 [0,1,0,0,0,1|2,0,0]=4 3040 B11R1.17 [C-]#[N+]CCc1cccnc1C Amb32879578 [0,1,0,0,0,1|2,0,0]=4 3041 B11R1.17 [C-]#[N+]CCc1ccncc1C Amb33414474 [0,1,0,0,0,1|2,0,0]=4 3042 B11R1.17 [C-]#[N+]CCc1cncnc1C Amb33465809 [0,1,0,0,0,1|2,0,0]=4 3043 B11R1.17 [C-]#[N+]CCc1nccnc1C Amb33142573 [0,1,0,0,0,1|2,0,0]=4 3044 B11R1.41 C=Cc1cnccc1CCO Amb28185468 [0,1,0,0,0,1|1,0,1]=4 3045 B11R1.41 CCCc1cncnc1NC Amb26508290 [0,1,0,0,0,1|2,0,0]=4 3046 B11R1.41 CCCc1nccnc1CN Amb26042320 [0,1,0,0,0,1|2,0,0]=4 3047 B11R1.41 CCCc1nccnc1NC Amb27395137 [0,1,0,0,0,1|2,0,0]=4 3048 B11R1.41 CCCc1nccnc1SC Amb27209627 [0,1,0,0,0,1|2,0,0]=4 3049 B11R1.41 CCCc1ncncc1CO Amb27880743 [0,1,0,0,0,1|2,0,0]=4 3050 B11R1.41 CCc1ccccc1CCO Amb22365060 [0,1,0,0,0,1|2,0,0]=4 3051 B11R1.41 CCc1nccnc1CCN Amb26481787 [0,1,0,0,0,1|2,0,0]=4 3052 B11R1.41 CCc1nncnc1CCN Amb28057141 [0,1,0,0,0,1|2,0,0]=4 3053 B11R1.41 CNc1ccccc1CCO Amb20246815 [0,1,0,0,0,1|2,0,0]=4 3054 B11R1.41 CNc1ccncc1CCO Amb27668968 [0,1,0,0,0,1|2,0,0]=4 3055 B11R1.41 COc1ccccc1CCO Amb3939092 [0,1,0,0,0,1|2,0,0]=4 3056 B11R1.41 COc1cccnc1CCO Amb25266496 [0,1,0,0,0,1|2,0,0]=4 3057 B11R1.41 COc1ccncc1CCO Amb25348919 [0,1,0,0,0,1|2,0,0]=4 3058 B11R1.41 COc1ccnnc1CCO Amb35788758 [0,1,0,0,0,1|2,0,0]=4 3059 B11R1.41 COc1cnccc1CCN Amb22494560 [0,1,0,0,0,1|2,0,0]=4 3060 B11R1.41 COc1cnccc1CCN Amb33718647 [0,1,0,0,0,1|2,0,0]=4 3061 B11R1.41 COc1ncccc1CCBr Amb26330084 [0,1,0,0,0,1|2,0,0]=4 3062 B11R1.41 COc1ncccc1CCN Amb8011374 [0,1,0,0,0,1|2,0,0]=4 3063 B11R1.41 COc1ncccc1CCO Amb27176315 [0,1,0,0,0,1|1,0,0]=3 3064 B11R1.41 COc1ncccc1CCS Amb33224071 [0,1,0,0,0,1|1,1,0]=4 3065 B11R1.41 COc1ncccc1CNO Amb33379863 [0,1,0,0,0,1|2,0,0]=4 3066 B11R1.41 COc1nccnc1CCBr Amb28369026 [0,1,0,0,0,1|2,0,0]=4 3067 B11R1.41 COc1nccnc1CCN Amb18831142 [0,1,0,0,0,1|2,0,0]=4 3068 B11R1.41 COc1nccnc1CCO Amb25376862 [0,1,0,0,0,1|1,0,0]=3 3069 B11R1.41 CSc1ccccc1CCO Amb25305735 [0,1,0,0,0,1|2,0,0]=4 3070 B11R1.41 CSc1ncccc1CCO Amb27781380 [0,1,0,0,0,1|1,0,0]=3 3071 B11R1.41 N#Cc1ncccc1CCO Amb28122733 [0,1,0,0,0,1|1,0,1]=4 3072 B11R1.41 NCCc1cccnc1CN Amb25824951 [0,1,0,0,0,1|2,0,0]=4 3073 B11R1.41 NCc1cccnc1CCO Amb26933120 [0,1,0,0,0,1|2,0,0]=4 3074 B11R1.41 OCCc1ccccc1CO Amb17593783 [0,1,0,0,0,1|2,0,0]=4 3075 B11R1.81 CC1=CC(=S)NC=C1CCO Amb23446911 [0,1,0,0,0,1|2,0,0]=4 3076 B11R1.81 CCCC1=CNC(=O)N=C1C Amb27613346 [0,1,0,0,0,1|2,0,0]=4 3077 B11R1.81 CCCc1cnc(Cl)nc1C Amb27613345 [0,1,0,0,0,1|2,0,0]=4 3078 B11R1.81 Cc1cc(Br)ccc1CCO Amb27763641 [0,1,0,0,0,1|2,0,0]=4 3079 B11R1.81 Cc1cc(Cl)ccc1CCO Amb19928756 [0,1,0,0,0,1|2,0,0]=4 3080 B11R1.81 Cc1cc(Cl)ncc1CCO Amb23446955 [0,1,0,0,0,1|2,0,0]=4 3081 B11R1.81 Cc1cc(F)ccc1CCO Amb18791565 [0,1,0,0,0,1|2,0,0]=4 3082 B11R1.81 Cc1cc(I)ncc1CCO Amb23447031 [0,1,0,0,0,1|2,0,0]=4 3083 B11R1.81 Cc1ccc(CCN)c(C)n1 Amb18201863 [0,1,0,0,0,1|2,0,0]=4 3084 B11R1.81 Cc1ccc(CCO)c(C)c1 Amb17232073 [0,1,0,0,0,1|2,0,0]=4 3085 B11R1.81 Cc1ccc(CCO)c(C)n1 Amb25809395 [0,1,0,0,0,1|1,0,0]=3 3086 B11R1.81 Cc1ccc(CCO)c(Cl)n1 Amb33259864 [0,1,0,0,0,1|2,0,0]=4 3087 B11R1.81 Cc1ccc(CCO)c(F)n1 Amb24655828 [0,1,0,0,0,1|2,0,0]=4 3088 B11R1.81 Cc1cnc(CCO)c(C)c1 Amb25857982 [0,1,0,0,0,1|2,0,0]=4 3089 B11R1.81 Cc1nc(F)ccc1CCN Amb25327536 [0,1,0,0,0,1|2,0,0]=4 3090 B11R1.81 Cc1nc(F)ccc1CCO Amb24655827 [0,1,0,0,0,1|1,0,0]=3 3091 B11R1.81 Cc1nc(F)ncc1CCN Amb18830906 [0,1,0,0,0,1|2,0,0]=4 3092 B11R1.81 Cc1nc(I)ccc1CCO Amb23537340 [0,1,0,0,0,1|1,0,0]=3 3093 B11R1.81 Cc1nc(N)ncc1CCBr Amb28128389 [0,1,0,0,0,1|2,0,0]=4 3094 B11R1.81 Cc1nc(N)ncc1CCO Amb27444185 [0,1,0,0,0,1|1,0,0]=3 3095 B11R1.81 Cc1nc(O)ccc1CCO Amb23446086 [0,1,0,0,0,1|1,0,0]=3 3096 B11R1.81 Cc1ncc(CCN)c(C)n1 Amb18201560 [0,1,0,0,0,1|2,0,0]=4 3097 B11R1.81 Cc1ncc(CCO)c(N)n1 Amb27815855 [0,1,0,0,0,1|2,0,0]=4 3098 B11R1.81 Cc1nnc(CCN)c(C)n1 Amb18201259 [0,1,0,0,0,1|2,0,0]=4 3099 B11R1.81 Nc1nc(O)ncc1CCO Amb26493290 [0,1,0,0,0,1|2,0,0]=4 3100 B11R1.81 Nc1ncc(CCO)c(O)n1 Amb9901859 [0,1,0,0,0,1|2,0,0]=4 3101 B11R1.81 OCCc1ccc(Br)nc1Br Amb27215555 [0,1,0,0,0,1|2,0,0]=4 3102 B11R1.81 OCCc1ccc(Cl)nc1Cl Amb25740601 [0,1,0,0,0,1|2,0,0]=4 3103 B11R1.81 OCCc1cnc(Cl)nc1Cl Amb28435071 [0,1,0,0,0,1|2,0,0]=4 3104 B11R1.81 OCCc1cnc(F)nc1F Amb27175249 [0,1,0,0,0,1|2,0,0]=4 3105 B11R1.81 OCCc1cnc(O)nc1O Amb20573687 [0,1,0,0,0,1|2,0,0]=4 3106 B11R1.81 OCCc1cnc(S)nc1O Amb21972225 [0,1,0,0,0,1|2,0,0]=4 3107 B11R1.86 CC(O)Cc1cccnc1Br Amb33387768 [0,1,0,0,0,1|2,0,0]=4 3108 B11R1.86 CC(O)Cc1cccnc1Cl Amb32747336 [0,1,0,0,0,1|2,0,0]=4 3109 B11R1.86 CC(O)Cc1cccnc1F Amb33378291 [0,1,0,0,0,1|2,0,0]=4 3110 B11R1.86 CC(O)Cc1ccncc1Br Amb33451027 [0,1,0,0,0,1|2,0,0]=4 3111 B11R1.86 CC(O)Cc1ccncc1Cl Amb25885768 [0,1,0,0,0,1|2,0,0]=4 3112 B11R1.86 CC(O)Cc1ccncc1F Amb33374460 [0,1,0,0,0,1|2,0,0]=4 3113 B11R1.86 C[C@@H](O)Cc1cccnc1Br Amb33387803 [0,1,0,0,0,1|2,0,0]=4 3114 B11R1.86 C[C@@H](O)Cc1cccnc1Cl Amb33257308 [0,1,0,0,0,1|2,0,0]=4 3115 B11R1.86 C[C@@H](O)Cc1cccnc1F Amb33377612 [0,1,0,0,0,1|2,0,0]=4 3116 B11R1.86 C[C@@H](O)Cc1ccncc1Br Amb33388610 [0,1,0,0,0,1|2,0,0]=4 3117 B11R1.86 C[C@@H](O)Cc1ccncc1Cl Amb33413801 [0,1,0,0,0,1|2,0,0]=4 3118 B11R1.86 C[C@@H](O)Cc1ccncc1F Amb33317432 [0,1,0,0,0,1|2,0,0]=4 3119 B11R1.86 C[C@H](O)Cc1cccnc1Br Amb33387801 [0,1,0,0,0,1|2,0,0]=4 3120 B11R1.86 C[C@H](O)Cc1cccnc1Cl Amb33257306 [0,1,0,0,0,1|2,0,0]=4 3121 B11R1.86 C[C@H](O)Cc1cccnc1F Amb33224049 [0,1,0,0,0,1|2,0,0]=4 3122 B11R1.86 C[C@H](O)Cc1ccncc1Br Amb33388609 [0,1,0,0,0,1|2,0,0]=4 3123 B11R1.86 C[C@H](O)Cc1ccncc1Cl Amb33256248 [0,1,0,0,0,1|2,0,0]=4 3124 B11R1.86 C[C@H](O)Cc1ccncc1F Amb33317433 [0,1,0,0,0,1|2,0,0]=4 3125 B11R1.86 Cc1ccccc1CC(C)O Amb17138429 [0,1,0,0,0,1|2,0,0]=4 3126 B11R1.86 Cc1ccccc1C[C@@H](C)O Amb24432685 [0,1,0,0,0,1|2,0,0]=4 3127 B11R1.86 Cc1ccccc1C[C@H](C)O Amb33360564 [0,1,0,0,0,1|2,0,0]=4 3128 B11R1.86 Cc1cccnc1CC(C)O Amb1995155 [0,1,0,0,0,1|2,0,0]=4 3129 B11R1.86 Cc1cccnc1C[C@@H](C)O Amb33428749 [0,1,0,0,0,1|2,0,0]=4 3130 B11R1.86 Cc1cccnc1C[C@H](C)O Amb33428750 [0,1,0,0,0,1|2,0,0]=4 3131 B11R1.86 Cc1ccncc1CC(C)O Amb33377019 [0,1,0,0,0,1|2,0,0]=4 3132 B11R1.86 Cc1ccncc1C[C@@H](C)O Amb33376694 [0,1,0,0,0,1|2,0,0]=4 3133 B11R1.86 Cc1ccncc1C[C@H](C)O Amb33376695 [0,1,0,0,0,1|2,0,0]=4 3134 B11R1.86 Cc1cnccc1CC(=O)O Amb33249640 [0,1,0,0,0,1|1,0,1]=4 3135 B11R1.86 Cc1cnccc1CC(C)Br Amb33451683 [0,1,0,0,0,1|2,0,0]=4 3136 B11R1.86 Cc1cnccc1CC(C)O Amb33080073 [0,1,0,0,0,1|1,0,0]=3 3137 B11R1.86 Cc1cnccc1CN(C)O Amb33415543 [0,1,0,0,0,1|2,0,0]=4 3138 B11R1.86 Cc1cnccc1C[C@@H](C)N Amb33424644 [0,1,0,0,0,1|2,0,0]=4 3139 B11R1.86 Cc1cnccc1C[C@@H](C)O Amb33424641 [0,1,0,0,0,1|1,0,0]=3 3140 B11R1.86 Cc1cnccc1C[C@H](C)N Amb33424643 [0,1,0,0,0,1|2,0,0]=4 3141 B11R1.86 Cc1cnccc1C[C@H](C)O Amb33424642 [0,1,0,0,0,1|1,0,0]=3 3142 B11R1.86 Cc1ncccc1CC(=O)O Amb18215698 [0,1,0,0,0,1|1,0,1]=4 3143 B11R1.86 Cc1ncccc1CC(=O)O Amb28652864 [0,1,0,0,0,1|1,0,1]=4 3144 B11R1.86 Cc1ncccc1CC(C)Br Amb33432584 [0,1,0,0,0,1|2,0,0]=4 3145 B11R1.86 Cc1ncccc1CC(C)N Amb35653999 [0,1,0,0,0,1|2,0,0]=4 3146 B11R1.86 Cc1ncccc1CC(C)O Amb32879587 [0,1,0,0,0,1|1,0,0]=3 3147 B11R1.86 Cc1ncccc1CN(C)O Amb33224601 [0,1,0,0,0,1|2,0,0]=4 3148 B11R1.86 Cc1ncccc1C[C@@H](C)N Amb33171950 [0,1,0,0,0,1|2,0,0]=4 3149 B11R1.86 Cc1ncccc1C[C@@H](C)O Amb32878983 [0,1,0,0,0,1|1,0,0]=3 3150 B11R1.86 Cc1ncccc1C[C@H](C)N Amb33225599 [0,1,0,0,0,1|2,0,0]=4 3151 B11R1.86 Cc1ncccc1C[C@H](C)O Amb32878984 [0,1,0,0,0,1|1,0,0]=3 3152 B11R1.86 Cc1nccnc1CC(=O)O Amb18201468 [0,1,0,0,0,1|1,0,1]=4 3153 B11R1.86 Cc1nccnc1CC(C)Br Amb33242450 [0,1,0,0,0,1|2,0,0]=4 3154 B11R1.86 Cc1nccnc1CC(C)C Amb20620643 [0,1,0,0,0,1|2,0,0]=4 3155 B11R1.86 Cc1nccnc1CC(C)N Amb35678241 [0,1,0,0,0,1|2,0,0]=4 3156 B11R1.86 Cc1nccnc1CC(C)O Amb33449832 [0,1,0,0,0,1|1,0,0]=3 3157 B11R1.86 Cc1nccnc1CN(C)O Amb33142592 [0,1,0,0,0,1|2,0,0]=4 3158 B11R1.86 Cc1nccnc1C[C@@H](C)N Amb33142193 [0,1,0,0,0,1|2,0,0]=4 3159 B11R1.86 Cc1nccnc1C[C@@H](C)O Amb33142169 [0,1,0,0,0,1|1,0,0]=3 3160 B11R1.86 Cc1nccnc1C[C@H](C)N Amb33142192 [0,1,0,0,0,1|2,0,0]=4 3161 B11R1.86 Cc1nccnc1C[C@H](C)O Amb33142191 [0,1,0,0,0,1|1,0,0]=3 3162 B11R1.86 Cc1ncncc1CC(=O)O Amb8009478 [0,1,0,0,0,1|1,0,1]=4 3163 B11R1.86 Cc1ncncc1CC(C)Br Amb33006847 [0,1,0,0,0,1|2,0,0]=4 3164 B11R1.86 Cc1ncncc1CC(C)O Amb33472211 [0,1,0,0,0,1|1,0,0]=3 3165 B11R1.86 Cc1ncncc1CN(C)O Amb33472508 [0,1,0,0,0,1|2,0,0]=4 3166 B11R1.86 Cc1ncncc1C[C@@H](C)N Amb33225020 [0,1,0,0,0,1|2,0,0]=4 3167 B11R1.86 Cc1ncncc1C[C@@H](C)O Amb33268115 [0,1,0,0,0,1|1,0,0]=3 3168 B11R1.86 Cc1ncncc1C[C@H](C)N Amb33268117 [0,1,0,0,0,1|2,0,0]=4 3169 B11R1.86 Cc1ncncc1C[C@H](C)O Amb33268116 [0,1,0,0,0,1|1,0,0]=3 3170 B11R1.86 Cc1ncnnc1CC(=O)O Amb27963083 [0,1,0,0,0,1|1,0,1]=4 3171 B11R1.182 CCCC1=C(C)N=CC(=O)N1 Amb28249980 [0,1,0,0,0,1|2,0,0]=4 3172 B11R1.182 CCCC1=CC(=O)NN=C1C Amb24693108 [0,1,0,0,0,1|2,0,0]=4 3173 B11R1.182 CCCc1cc(Br)nnc1C Amb25776800 [0,1,0,0,0,1|2,0,0]=4 3174 B11R1.182 CCCc1cc(N)nnc1C Amb27172006 [0,1,0,0,0,1|2,0,0]=4 3175 B11R1.182 CCCc1cc(O)cnc1C Amb32759504 [0,1,0,0,0,1|2,0,0]=4 3176 B11R1.182 CCCc1nc(C)cnc1C Amb26979886 [0,1,0,0,0,1|2,0,0]=4 3177 B11R1.182 Cc1cc(CCO)c(C)nn1 Amb23560287 [0,1,0,0,0,1|1,0,0]=3 3178 B11R1.182 Cc1ccc(Br)cc1CCO Amb24659878 [0,1,0,0,0,1|2,0,0]=4 3179 B11R1.182 Cc1ccc(C)c(CCO)c1 Amb2720463 [0,1,0,0,0,1|2,0,0]=4 3180 B11R1.182 Cc1ccc(Cl)cc1CCO Amb24513879 [0,1,0,0,0,1|2,0,0]=4 3181 B11R1.182 Cc1ccc(F)cc1CCO Amb18791564 [0,1,0,0,0,1|2,0,0]=4 3182 B11R1.182 Cc1ccc(N)cc1CCO Amb27786984 [0,1,0,0,0,1|2,0,0]=4 3183 B11R1.182 Cc1cnc(Cl)cc1CCN Amb27223092 [0,1,0,0,0,1|2,0,0]=4 3184 B11R1.182 Cc1cnc(Cl)nc1CCN Amb24701240 [0,1,0,0,0,1|2,0,0]=4 3185 B11R1.182 Cc1cnc(F)c(CCO)c1 Amb27170664 [0,1,0,0,0,1|2,0,0]=4 3186 B11R1.182 Cc1cnc(N)c(CCO)c1 Amb32944419 [0,1,0,0,0,1|2,0,0]=4 3187 B11R1.182 Cc1cnc(O)nc1CCN Amb27223381 [0,1,0,0,0,1|2,0,0]=4 3188 B11R1.182 Cc1ncc(Cl)cc1CCN Amb28145836 [0,1,0,0,0,1|2,0,0]=4 3189 B11R1.182 Cc1nnc(C)c(CCN)n1 Amb27788309 [0,1,0,0,0,1|2,0,0]=4 3190 B11R1.182 Nc1ncc(Cl)cc1CCO Amb33213983 [0,1,0,0,0,1|2,0,0]=4 3191 B11R1.182 OCCc1cc(Br)cnc1Br Amb33008857 [0,1,0,0,0,1|2,0,0]=4 3192 B11R1.182 OCCc1cc(Br)cnc1Cl Amb26609978 [0,1,0,0,0,1|2,0,0]=4 3193 B11R1.182 OCCc1cc(Br)cnc1F Amb25706046 [0,1,0,0,0,1|2,0,0]=4 3194 B11R1.182 OCCc1cc(Cl)cnc1F Amb33257191 [0,1,0,0,0,1|2,0,0]=4 3195 B11R1.182 OCCc1cc(Cl)ncc1Br Amb33477830 [0,1,0,0,0,1|2,0,0]=4 3196 B11R1.182 OCCc1cc(Cl)nnc1Cl Amb33258937 [0,1,0,0,0,1|2,0,0]=4 3197 B11R1.182 OCCc1cc(I)cnc1F Amb28052925 [0,1,0,0,0,1|2,0,0]=4 3198 B11R1.222 CC(CO)c1ccncc1Br Amb33620376 [0,1,0,0,0,1|2,0,0]=4 3199 B11R1.222 CCC(Br)c1cccnc1C Amb27662293 [0,1,0,0,0,1|2,0,0]=4 3200 B11R1.222 CCC(C)c1cccnc1C Amb27159369 [0,1,0,0,0,1|2,0,0]=4 3201 B11R1.222 CCC(C)c1ccncc1C Amb28146835 [0,1,0,0,0,1|2,0,0]=4 3202 B11R1.222 CCC(C)c1nccnc1C Amb28203266 [0,1,0,0,0,1|2,0,0]=4 3203 B11R1.222 CCC(O)c1nccnc1C Amb35600801 [0,1,0,0,0,1|2,0,0]=4 3204 B11R1.222 CC[C@H](N)c1cccnc1C Amb27952038 [0,1,0,0,0,1|2,0,0]=4 3205 B11R1.222 CC[C@H](N)c1cncnc1C Amb27795792 [0,1,0,0,0,1|2,0,0]=4 3206 B11R1.222 CC[C@H](O)c1ccncc1C Amb27855841 [0,1,0,0,0,1|2,0,0]=4 3207 B11R1.222 Cc1ccccc1C(C)CO Amb25129854 [0,1,0,0,0,1|2,0,0]=4 3208 B11R1.222 Cc1ccccc1C(N)CO Amb8855227 [0,1,0,0,0,1|2,0,0]=4 3209 B11R1.222 Cc1ccccc1C(O)CO Amb27146455 [0,1,0,0,0,1|2,0,0]=4 3210 B11R1.222 Cc1ccccc1[C@@H](C)CO Amb27431457 [0,1,0,0,0,1|2,0,0]=4 3211 B11R1.222 Cc1ccccc1[C@@H](N)CO Amb25887070 [0,1,0,0,0,1|2,0,0]=4 3212 B11R1.222 Cc1ccccc1[C@H](C)CO Amb33749842 [0,1,0,0,0,1|2,0,0]=4 3213 B11R1.222 Cc1ccccc1[C@H](N)CO Amb27398610 [0,1,0,0,0,1|2,0,0]=4 3214 B11R1.222 Cc1ccccc1[C@H](O)CO Amb27776437 [0,1,0,0,0,1|2,0,0]=4 3215 B11R1.222 Cc1cccnc1C(N)CO Amb25324194 [0,1,0,0,0,1|2,0,0]=4 3216 B11R1.222 Cc1cccnc1C(O)CO Amb33428743 [0,1,0,0,0,1|2,0,0]=4 3217 B11R1.222 Cc1cccnc1[C@@H](N)CO Amb26946731 [0,1,0,0,0,1|2,0,0]=4 3218 B11R1.222 Cc1cccnc1[C@H](N)CO Amb26509260 [0,1,0,0,0,1|2,0,0]=4 3219 B11R1.222 Cc1ccncc1C(N)CO Amb27596595 [0,1,0,0,0,1|2,0,0]=4 3220 B11R1.222 Cc1ccncc1C(O)CO Amb28047415 [0,1,0,0,0,1|2,0,0]=4 3221 B11R1.222 Cc1ccncc1[C@@H](N)CO Amb27480050 [0,1,0,0,0,1|2,0,0]=4 3222 B11R1.222 Cc1ccncc1[C@H](N)CO Amb24538108 [0,1,0,0,0,1|2,0,0]=4 3223 B11R1.222 Cc1cnccc1C(C)CBr Amb33334120 [0,1,0,0,0,1|2,0,0]=4 3224 B11R1.222 Cc1cnccc1C(C)CN Amb27853963 [0,1,0,0,0,1|2,0,0]=4 3225 B11R1.222 Cc1cnccc1C(F)CN Amb33414469 [0,1,0,0,0,1|2,0,0]=4 3226 B11R1.222 Cc1cnccc1C(N)CN Amb27475952 [0,1,0,0,0,1|2,0,0]=4 3227 B11R1.222 Cc1cnccc1C(N)CO Amb27241729 [0,1,0,0,0,1|1,0,0]=3 3228 B11R1.222 Cc1cnccc1C(O)CBr Amb33334122 [0,1,0,0,0,1|2,0,0]=4 3229 B11R1.222 Cc1cnccc1C(O)CF Amb33424634 [0,1,0,0,0,1|2,0,0]=4 3230 B11R1.222 Cc1cnccc1C(O)CN Amb28246816 [0,1,0,0,0,1|2,0,0]=4 3231 B11R1.222 Cc1cnccc1C(O)CO Amb33456772 [0,1,0,0,0,1|1,0,0]=3 3232 B11R1.222 Cc1cnccc1[C@@H](N)CO Amb27881615 [0,1,0,0,0,1|1,0,0]=3 3233 B11R1.222 Cc1cnccc1[C@@H](O)CN Amb33414187 [0,1,0,0,0,1|2,0,0]=4 3234 B11R1.222 Cc1cnccc1[C@H](N)CO Amb24546986 [0,1,0,0,0,1|1,0,0]=3 3235 B11R1.222 Cc1cnccc1[C@H](O)CN Amb33414191 [0,1,0,0,0,1|2,0,0]=4 3236 B11R1.222 Cc1ncccc1C(C)CBr Amb33432586 [0,1,0,0,0,1|2,0,0]=4 3237 B11R1.222 Cc1ncccc1C(C)CN Amb32880139 [0,1,0,0,0,1|2,0,0]=4 3238 B11R1.222 Cc1ncccc1C(F)CN Amb32880589 [0,1,0,0,0,1|2,0,0]=4 3239 B11R1.222 Cc1ncccc1C(N)CO Amb27882693 [0,1,0,0,0,1|1,0,0]=3 3240 B11R1.222 Cc1ncccc1C(O)CBr Amb33432589 [0,1,0,0,0,1|2,0,0]=4 3241 B11R1.222 Cc1ncccc1C(O)CCl Amb33222584 [0,1,0,0,0,1|2,0,0]=4 3242 B11R1.222 Cc1ncccc1C(O)CF Amb32878974 [0,1,0,0,0,1|2,0,0]=4 3243 B11R1.222 Cc1ncccc1C(O)CN Amb18831196 [0,1,0,0,0,1|2,0,0]=4 3244 B11R1.222 Cc1ncccc1C(O)CO Amb32878975 [0,1,0,0,0,1|1,0,0]=3 3245 B11R1.222 Cc1ncccc1[C@@H](N)CO Amb26049377 [0,1,0,0,0,1|1,0,0]=3 3246 B11R1.222 Cc1ncccc1[C@@H](O)CN Amb32879572 [0,1,0,0,0,1|2,0,0]=4 3247 B11R1.222 Cc1ncccc1[C@H](N)CO Amb25875465 [0,1,0,0,0,1|1,0,0]=3 3248 B11R1.222 Cc1ncccc1[C@H](O)CN Amb32879571 [0,1,0,0,0,1|2,0,0]=4 3249 B11R1.222 Cc1nccnc1C(C)CBr Amb33431426 [0,1,0,0,0,1|2,0,0]=4 3250 B11R1.222 Cc1nccnc1C(C)CN Amb26363047 [0,1,0,0,0,1|2,0,0]=4 3251 B11R1.222 Cc1nccnc1C(F)CN Amb33142218 [0,1,0,0,0,1|2,0,0]=4 3252 B11R1.222 Cc1nccnc1C(N)CO Amb33142870 [0,1,0,0,0,1|1,0,0]=3 3253 B11R1.222 Cc1nccnc1C(O)CBr Amb24448193 [0,1,0,0,0,1|2,0,0]=4 3254 B11R1.222 Cc1nccnc1C(O)CCl Amb26555137 [0,1,0,0,0,1|2,0,0]=4 3255 B11R1.222 Cc1nccnc1C(O)CF Amb33143072 [0,1,0,0,0,1|2,0,0]=4 3256 B11R1.222 Cc1nccnc1C(O)CN Amb27484997 [0,1,0,0,0,1|2,0,0]=4 3257 B11R1.222 Cc1nccnc1C(O)CO Amb33142183 [0,1,0,0,0,1|1,0,0]=3 3258 B11R1.222 Cc1nccnc1[C@@H](N)CO Amb33142210 [0,1,0,0,0,1|1,0,0]=3 3259 B11R1.222 Cc1nccnc1[C@@H](O)CBr Amb27484996 [0,1,0,0,0,1|2,0,0]=4 3260 B11R1.222 Cc1nccnc1[C@@H](O)CN Amb27801754 [0,1,0,0,0,1|2,0,0]=4 3261 B11R1.222 Cc1nccnc1[C@H](N)CO Amb33142217 [0,1,0,0,0,1|1,0,0]=3 3262 B11R1.222 Cc1nccnc1[C@H](O)CCl Amb27590935 [0,1,0,0,0,1|2,0,0]=4 3263 B11R1.222 Cc1nccnc1[C@H](O)CN Amb27656763 [0,1,0,0,0,1|2,0,0]=4 3264 B11R1.222 Cc1ncncc1C(C)CBr Amb33006848 [0,1,0,0,0,1|2,0,0]=4 3265 B11R1.222 Cc1ncncc1C(C)CN Amb33472511 [0,1,0,0,0,1|2,0,0]=4 3266 B11R1.222 Cc1ncncc1C(F)CN Amb33465803 [0,1,0,0,0,1|2,0,0]=4 3267 B11R1.222 Cc1ncncc1C(N)CO Amb18201008 [0,1,0,0,0,1|1,0,0]=3 3268 B11R1.222 Cc1ncncc1C(O)CBr Amb33006854 [0,1,0,0,0,1|2,0,0]=4 3269 B11R1.222 Cc1ncncc1C(O)CCl Amb33223323 [0,1,0,0,0,1|2,0,0]=4 3270 B11R1.222 Cc1ncncc1C(O)CF Amb33268104 [0,1,0,0,0,1|2,0,0]=4 3271 B11R1.222 Cc1ncncc1C(O)CN Amb33472858 [0,1,0,0,0,1|2,0,0]=4 3272 B11R1.222 Cc1ncncc1C(O)CO Amb33267882 [0,1,0,0,0,1|1,0,0]=3 3273 B11R1.222 Cc1ncncc1[C@@H](N)CO Amb33225025 [0,1,0,0,0,1|1,0,0]=3 3274 B11R1.222 Cc1ncncc1[C@@H](O)CN Amb33465801 [0,1,0,0,0,1|2,0,0]=4 3275 B11R1.222 Cc1ncncc1[C@H](N)CO Amb33268145 [0,1,0,0,0,1|1,0,0]=3 3276 B11R1.222 Cc1ncncc1[C@H](O)CN Amb33273501 [0,1,0,0,0,1|2,0,0]=4 3277 B11R1.222 NC(CO)c1cccnc1Br Amb25149024 [0,1,0,0,0,1|2,0,0]=4 3278 B11R1.222 NC(CO)c1cccnc1Cl Amb25117949 [0,1,0,0,0,1|2,0,0]=4 3279 B11R1.222 NC(CO)c1cccnc1F Amb24484454 [0,1,0,0,0,1|2,0,0]=4 3280 B11R1.222 NC(CO)c1cccnc1S Amb27597175 [0,1,0,0,0,1|2,0,0]=4 3281 B11R1.222 NC(CO)c1ccncc1Br Amb25147958 [0,1,0,0,0,1|2,0,0]=4 3282 B11R1.222 NC(CO)c1ccncc1Cl Amb18825308 [0,1,0,0,0,1|2,0,0]=4 3283 B11R1.222 NC(CO)c1ccncc1Cl Amb30634173 [0,1,0,0,0,1|2,0,0]=4 3284 B11R1.222 NC(CO)c1ccncc1F Amb25117677 [0,1,0,0,0,1|2,0,0]=4 3285 B11R1.222 N[C@@H](CO)c1cccnc1Br Amb25921363 [0,1,0,0,0,1|2,0,0]=4 3286 B11R1.222 N[C@@H](CO)c1cccnc1Cl Amb24550455 [0,1,0,0,0,1|2,0,0]=4 3287 B11R1.222 N[C@@H](CO)c1cccnc1F Amb24453256 [0,1,0,0,0,1|2,0,0]=4 3288 B11R1.222 N[C@@H](CO)c1ccncc1Br Amb27403188 [0,1,0,0,0,1|2,0,0]=4 3289 B11R1.222 N[C@@H](CO)c1ccncc1Cl Amb25129405 [0,1,0,0,0,1|2,0,0]=4 3290 B11R1.222 N[C@@H](CO)c1ccncc1F Amb24761379 [0,1,0,0,0,1|2,0,0]=4 3291 B11R1.222 N[C@@H](CO)c1ccncc1O Amb27173667 [0,1,0,0,0,1|2,0,0]=4 3292 B11R1.222 N[C@H](CO)c1cccnc1Br Amb25216116 [0,1,0,0,0,1|2,0,0]=4 3293 B11R1.222 N[C@H](CO)c1cccnc1Cl Amb26067165 [0,1,0,0,0,1|2,0,0]=4 3294 B11R1.222 N[C@H](CO)c1cccnc1F Amb25887072 [0,1,0,0,0,1|2,0,0]=4 3295 B11R1.222 N[C@H](CO)c1cccnc1S Amb27223308 [0,1,0,0,0,1|2,0,0]=4 3296 B11R1.222 N[C@H](CO)c1ccncc1Br Amb27750820 [0,1,0,0,0,1|2,0,0]=4 3297 B11R1.222 N[C@H](CO)c1ccncc1Cl Amb25328637 [0,1,0,0,0,1|2,0,0]=4 3298 B11R1.222 N[C@H](CO)c1ccncc1F Amb25118008 [0,1,0,0,0,1|2,0,0]=4 3299 B11R1.222 Nc1cnccc1[C@@H](N)CO Amb27597700 [0,1,0,0,0,1|2,0,0]=4 3300 B11R1.222 Nc1ncccc1[C@@H](N)CO Amb28364287 [0,1,0,0,0,1|2,0,0]=4 3301 B11R1.222 OCC(O)c1cccnc1Br Amb33387827 [0,1,0,0,0,1|2,0,0]=4 3302 B11R1.222 OCC(O)c1cccnc1Cl Amb33257034 [0,1,0,0,0,1|2,0,0]=4 3303 B11R1.222 OCC(O)c1cccnc1F Amb33377652 [0,1,0,0,0,1|2,0,0]=4 3304 B11R1.222 OCC(O)c1ccncc1Br Amb33450639 [0,1,0,0,0,1|2,0,0]=4 3305 B11R1.222 OCC(O)c1ccncc1Cl Amb33413579 [0,1,0,0,0,1|2,0,0]=4 3306 B11R1.222 OCC(O)c1ccncc1F Amb33317180 [0,1,0,0,0,1|2,0,0]=4 3307 B11R1.605 CC1=C(CCO)C(=O)NC=C1 Amb25180817 [0,1,0,0,0,1|2,0,0]=4 3308 B11R1.605 CC1=CN=CC(=O)N1CCO Amb27484436 [0,1,0,0,0,1|2,0,0]=4 3309 B11R1.605 CCCC1=C(C)N=CNC1=O Amb22337532 [0,1,0,0,0,1|2,0,0]=4 3310 B11R1.605 CCCc1c(C)cncc1Br Amb27462633 [0,1,0,0,0,1|2,0,0]=4 3311 B11R1.605 CCCc1c(C)cncc1C Amb27612873 [0,1,0,0,0,1|2,0,0]=4 3312 B11R1.605 Cc1cccc(C)c1CCO Amb22228066 [0,1,0,0,0,1|2,0,0]=4 3313 B11R1.605 Cc1cccc(Cl)c1CCO Amb33259717 [0,1,0,0,0,1|2,0,0]=4 3314 B11R1.605 Cc1cccc(F)c1CCO Amb33143469 [0,1,0,0,0,1|2,0,0]=4 3315 B11R1.605 Cc1ccnc(N)c1CCO Amb33213825 [0,1,0,0,0,1|2,0,0]=4 3316 B11R1.605 Cc1cncc(C)c1CCN Amb18201834 [0,1,0,0,0,1|2,0,0]=4 3317 B11R1.605 Cc1cncc(Cl)c1CCN Amb28293003 [0,1,0,0,0,1|2,0,0]=4 3318 B11R1.605 Cc1ncnc(C)c1CCN Amb8009750 [0,1,0,0,0,1|2,0,0]=4 3319 B11R1.605 Cc1ncnc(Cl)c1CCCl Amb25227404 [0,1,0,0,0,1|2,0,0]=4 3320 B11R1.605 Cc1ncnc(O)c1CCO Amb4005467 [0,1,0,0,0,1|1,0,0]=3 3321 B11R1.605 O=C1NN=CC(Cl)=C1CCO Amb28290006 [0,1,0,0,0,1|2,0,0]=4 3322 B11R1.605 OCCc1c(Br)cncc1Br Amb24738830 [0,1,0,0,0,1|2,0,0]=4 3323 B11R1.605 OCCc1c(Cl)cncc1Cl Amb33260923 [0,1,0,0,0,1|2,0,0]=4 3324 B11R1.605 OCCc1c(Cl)ncnc1Cl Amb20241993 [0,1,0,0,0,1|2,0,0]=4 3325 B11R1.605 OCCc1c(F)cncc1Br Amb32945795 [0,1,0,0,0,1|2,0,0]=4 3326 B11R1.605 OCCc1c(F)cncc1F Amb29876727 [0,1,0,0,0,1|2,0,0]=4 3327 B11R1.605 OCCc1c(F)ncnc1F Amb26019500 [0,1,0,0,0,1|2,0,0]=4 3328 B11R1.23 CC(CO)c1ccnc(F)c1 Amb33740148 [0,1,0,0,0,1|2,0,0]=4 3329 B11R1.23 CCC(Br)c1ccnc(C)c1 Amb27457736 [0,1,0,0,0,1|2,0,0]=4 3330 B11R1.23 CC[C@@H](N)c1ccnc(C)n1 Amb27167007 [0,1,0,0,0,1|2,0,0]=4 3331 B11R1.23 CC[C@H](N)c1ccnc(C)n1 Amb27867138 [0,1,0,0,0,1|2,0,0]=4 3332 B11R1.23 C[C@@H](CO)c1ccnc(F)c1 Amb33748025 [0,1,0,0,0,1|2,0,0]=4 3333 B11R1.23 C[C@H](CO)c1ccnc(F)c1 Amb33744968 [0,1,0,0,0,1|2,0,0]=4 3334 B11R1.23 Cc1cc(C(C)CBr)ccn1 Amb33004950 [0,1,0,0,0,1|2,0,0]=4 3335 B11R1.23 Cc1cc(C(C)CN)ccn1 Amb18201826 [0,1,0,0,0,1|2,0,0]=4 3336 B11R1.23 Cc1cc(C(F)CN)ccn1 Amb32732968 [0,1,0,0,0,1|2,0,0]=4 3337 B11R1.23 Cc1cc(C(N)CO)ccn1 Amb24410562 [0,1,0,0,0,1|1,0,0]=3 3338 B11R1.23 Cc1cc(C(N)CO)ncn1 Amb27812124 [0,1,0,0,0,1|1,0,0]=3 3339 B11R1.23 Cc1cc(C(O)CBr)ccn1 Amb33009385 [0,1,0,0,0,1|2,0,0]=4 3340 B11R1.23 Cc1cc(C(O)CCl)ccn1 Amb33057716 [0,1,0,0,0,1|2,0,0]=4 3341 B11R1.23 Cc1cc(C(O)CF)ccn1 Amb32732933 [0,1,0,0,0,1|2,0,0]=4 3342 B11R1.23 Cc1cc(C(O)CN)ccn1 Amb33268552 [0,1,0,0,0,1|2,0,0]=4 3343 B11R1.23 Cc1cc(C(O)CO)ccn1 Amb32732934 [0,1,0,0,0,1|1,0,0]=3 3344 B11R1.23 Cc1cc([C@@H](N)CO)ccn1 Amb26996074 [0,1,0,0,0,1|1,0,0]=3 3345 B11R1.23 Cc1cc([C@@H](O)CN)ccn1 Amb32732966 [0,1,0,0,0,1|2,0,0]=4 3346 B11R1.23 Cc1cc([C@H](N)CO)ccn1 Amb27248067 [0,1,0,0,0,1|1,0,0]=3 3347 B11R1.23 Cc1cc([C@H](O)CN)ccn1 Amb32732965 [0,1,0,0,0,1|2,0,0]=4 3348 B11R1.23 Cc1cccc(C(C)CO)c1 Amb24674558 [0,1,0,0,0,1|2,0,0]=4 3349 B11R1.23 Cc1cccc(C(N)CO)c1 Amb17232091 [0,1,0,0,0,1|2,0,0]=4 3350 B11R1.23 Cc1cccc(C(N)CO)n1 Amb24485756 [0,1,0,0,0,1|2,0,0]=4 3351 B11R1.23 Cc1cccc(C(O)CO)c1 Amb24116522 [0,1,0,0,0,1|2,0,0]=4 3352 B11R1.23 Cc1cccc(C(O)CO)n1 Amb25973269 [0,1,0,0,0,1|2,0,0]=4 3353 B11R1.23 Cc1cccc([C@@H](C)CO)c1 Amb27981914 [0,1,0,0,0,1|2,0,0]=4 3354 B11R1.23 Cc1cccc([C@@H](N)CO)c1 Amb22756883 [0,1,0,0,0,1|2,0,0]=4 3355 B11R1.23 Cc1cccc([C@@H](N)CO)n1 Amb27404550 [0,1,0,0,0,1|2,0,0]=4 3356 B11R1.23 Cc1cccc([C@@H](O)CO)c1 Amb27598612 [0,1,0,0,0,1|2,0,0]=4 3357 B11R1.23 Cc1cccc([C@H](C)CO)c1 Amb25220127 [0,1,0,0,0,1|2,0,0]=4 3358 B11R1.23 Cc1cccc([C@H](N)CO)c1 Amb27156538 [0,1,0,0,0,1|2,0,0]=4 3359 B11R1.23 Cc1cccc([C@H](N)CO)c1 Amb33872477 [0,1,0,0,0,1|2,0,0]=4 3360 B11R1.23 Cc1cccc([C@H](N)CO)n1 Amb25694308 [0,1,0,0,0,1|2,0,0]=4 3361 B11R1.23 Cc1cccc([C@H](O)CO)c1 Amb27448748 [0,1,0,0,0,1|2,0,0]=4 3362 B11R1.23 Cc1ccnc(C(N)CO)c1 Amb25117451 [0,1,0,0,0,1|2,0,0]=4 3363 B11R1.23 Cc1ccnc(C(O)CO)c1 Amb33318099 [0,1,0,0,0,1|2,0,0]=4 3364 B11R1.23 Cc1ccnc([C@@H](N)CO)c1 Amb25865381 [0,1,0,0,0,1|2,0,0]=4 3365 B11R1.23 Cc1ccnc([C@H](N)CO)c1 Amb27253149 [0,1,0,0,0,1|2,0,0]=4 3366 B11R1.23 Cc1nccc(C(O)CN)n1 Amb18201056 [0,1,0,0,0,1|2,0,0]=4 3367 B11R1.23 NC(CO)c1ccnc(Cl)c1 Amb25070827 [0,1,0,0,0,1|2,0,0]=4 3368 B11R1.23 NC(CO)c1ccnc(O)c1 Amb25064363 [0,1,0,0,0,1|2,0,0]=4 3369 B11R1.23 N[C@@H](CO)c1ccnc(Br)c1 Amb27945489 [0,1,0,0,0,1|2,0,0]=4 3370 B11R1.23 N[C@@H](CO)c1ccnc(Cl)c1 Amb27488729 [0,1,0,0,0,1|2,0,0]=4 3371 B11R1.23 N[C@H](CO)c1ccnc(Cl)c1 Amb25824192 [0,1,0,0,0,1|2,0,0]=4 3372 B11R1.23 Nc1cc([C@H](N)CO)ccn1 Amb28314139 [0,1,0,0,0,1|2,0,0]=4 3373 B11R1.23 O=C1N=CC=C(C(O)CO)O1 Amb27762881 [0,1,0,0,0,1|2,0,0]=4 3374 B11R1.23 OCC(O)C1=CC=NC(=S)O1 Amb27448452 [0,1,0,0,0,1|2,0,0]=4 3375 B11R1.24 C#CCCc1ccnc(C)c1 Amb32733009 [0,1,0,0,0,1|2,0,0]=4 3376 B11R1.24 CCCCc1ccnc(C)c1 Amb27176838 [0,1,0,0,0,1|2,0,0]=4 3377 B11R1.24 CCCNc1ccnc(C)c1 Amb27637577 [0,1,0,0,0,1|2,0,0]=4 3378 B11R1.24 CCCNc1ccnc(C)n1 Amb18997245 [0,1,0,0,0,1|2,0,0]=4 3379 B11R1.24 CCNCc1ccnc(C)n1 Amb16187151 [0,1,0,0,0,1|2,0,0]=4 3380 B11R1.24 CNCCc1cc(C)ncn1 Amb18224297 [0,1,0,0,0,1|2,0,0]=4 3381 B11R1.24 CNCCc1ccnc(C)c1 Amb33227097 [0,1,0,0,0,1|2,0,0]=4 3382 B11R1.24 COCCc1ccnc(C)c1 Amb27606969 [0,1,0,0,0,1|1,0,0]=3 3383 B11R1.24 COCCc1ccnc(N)c1 Amb27665601 [0,1,0,0,0,1|2,0,0]=4 3384 B11R1.24 CONCc1cc(C)ncn1 Amb27172267 [0,1,0,0,0,1|2,0,0]=4 3385 B11R1.24 Cc1cc(CCC#N)ccn1 Amb33268167 [0,1,0,0,0,1|2,0,0]=4 3386 B11R1.24 Cc1cc(CCC=O)ccn1 Amb27208272 [0,1,0,0,0,1|1,0,1]=4 3387 B11R1.24 Cc1cc(CCCBr)ccn1 Amb26334266 [0,1,0,0,0,1|2,0,0]=4 3388 B11R1.24 Cc1cc(CCCN)ccn1 Amb18201861 [0,1,0,0,0,1|2,0,0]=4 3389 B11R1.24 Cc1cc(CCCN)ncn1 Amb18201567 [0,1,0,0,0,1|2,0,0]=4 3390 B11R1.24 Cc1cc(CCCO)ccn1 Amb2694528 [0,1,0,0,0,1|1,0,0]=3 3391 B11R1.24 Cc1cc(CCCS)ccn1 Amb32732789 [0,1,0,0,0,1|1,1,0]=4 3392 B11R1.24 Cc1cc(CCON)ccn1 Amb32732958 [0,1,0,0,0,1|1,0,0]=3 3393 B11R1.24 Cc1cc(NCCCl)ccn1 Amb28050822 [0,1,0,0,0,1|2,0,0]=4 3394 B11R1.24 Cc1cc(NCCN)ncn1 Amb17515116 [0,1,0,0,0,1|2,0,0]=4 3395 B11R1.24 Cc1cc(NCCO)ccn1 Amb27453034 [0,1,0,0,0,1|1,0,0]=3 3396 B11R1.24 Cc1cc(OCCN)ccn1 Amb25961559 [0,1,0,0,0,1|2,0,0]=4 3397 B11R1.24 Cc1cc(OCCN)ncn1 Amb18988884 [0,1,0,0,0,1|2,0,0]=4 3398 B11R1.24 Cc1cc(SCCCl)ncn1 Amb19047326 [0,1,0,0,0,1|2,0,0]=4 3399 B11R1.24 Cc1cc(SCCO)ncn1 Amb18177938 [0,1,0,0,0,1|1,0,0]=3 3400 B11R1.24 Cc1cc(\C=C\CO)ccn1 Amb32733165 [0,1,0,0,0,1|1,0,1]=4 3401 B11R1.24 Cc1cccc(CCCO)c1 Amb17089495 [0,1,0,0,0,1|2,0,0]=4 3402 B11R1.24 Cc1cccc(CCCO)n1 Amb2694519 [0,1,0,0,0,1|2,0,0]=4 3403 B11R1.24 Cc1cccc(CCON)c1 Amb25704227 [0,1,0,0,0,1|2,0,0]=4 3404 B11R1.24 Cc1cccc(CCON)n1 Amb33199942 [0,1,0,0,0,1|2,0,0]=4 3405 B11R1.24 Cc1cccc(NCCO)c1 Amb6706757 [0,1,0,0,0,1|2,0,0]=4 3406 B11R1.24 Cc1cccc(NCCO)n1 Amb18290373 [0,1,0,0,0,1|2,0,0]=4 3407 B11R1.24 Cc1cccc(OCCO)c1 Amb2209346 [0,1,0,0,0,1|2,0,0]=4 3408 B11R1.24 Cc1cccc(OCCO)n1 Amb22900069 [0,1,0,0,0,1|2,0,0]=4 3409 B11R1.24 Cc1ccnc(CCCO)c1 Amb26476245 [0,1,0,0,0,1|2,0,0]=4 3410 B11R1.24 Cc1ccnc(CCON)c1 Amb33318126 [0,1,0,0,0,1|2,0,0]=4 3411 B11R1.24 Cc1ccnc(NCCO)c1 Amb18981411 [0,1,0,0,0,1|2,0,0]=4 3412 B11R1.24 Cc1ccnc(NCCO)c1 Amb19374562 [0,1,0,0,0,1|2,0,0]=4 3413 B11R1.24 Cc1ccnc(NCCO)n1 Amb19000715 [0,1,0,0,0,1|2,0,0]=4 3414 B11R1.24 Cc1nccc(\C=C\CO)n1 Amb28453715 [0,1,0,0,0,1|1,0,1]=4 3415 B11R1.24 Nc1cc(CCCO)ccn1 Amb27598075 [0,1,0,0,0,1|2,0,0]=4 3416 B11R1.24 Nc1cc(NCCO)ccn1 Amb27406110 [0,1,0,0,0,1|2,0,0]=4 3417 B11R1.24 Nc1cc(NCCO)ncn1 Amb27862386 [0,1,0,0,0,1|2,0,0]=4 3418 B11R1.24 Nc1ncnc(NCCO)n1 Amb27650937 [0,1,0,0,0,1|2,0,0]=4 3419 B11R1.24 OCCCc1ccnc(Cl)c1 Amb26943153 [0,1,0,0,0,1|2,0,0]=4 3420 B11R1.24 OCCNc1cc(Br)ncn1 Amb27408723 [0,1,0,0,0,1|2,0,0]=4 3421 B11R1.24 OCCNc1cc(Cl)ncn1 Amb679501 [0,1,0,0,0,1|2,0,0]=4 3422 B11R1.24 OCCNc1ccnc(F)n1 Amb35677716 [0,1,0,0,0,1|2,0,0]=4 3423 B11R1.24 OCCOc1ccnc(Cl)c1 Amb22059320 [0,1,0,0,0,1|2,0,0]=4 3424 B11R1.24 OCCOc1ccnc(Cl)n1 Amb18804288 [0,1,0,0,0,1|2,0,0]=4 3425 B11R1.24 OCCOc1ccnc(F)n1 Amb35658112 [0,1,0,0,0,1|2,0,0]=4 3426 B11R1.24 OCCSc1cc(Br)ncn1 Amb27806522 [0,1,0,0,0,1|2,0,0]=4 3427 B11R1.24 OCCSc1ccnc(Cl)c1 Amb27831915 [0,1,0,0,0,1|2,0,0]=4 3428 B11R1.24 OCCSc1ccnc(F)n1 Amb35610854 [0,1,0,0,0,1|2,0,0]=4 3429 B11R1.24 [C-]#[N+]CCc1ccnc(C)c1 Amb33268185 [0,1,0,0,0,1|2,0,0]=4 3430 B11R1.34 CCCc1cc(Br)nc(C)n1 Amb24318401 [0,1,0,0,0,1|2,0,0]=4 3431 B11R1.34 CCCc1cc(C)nc(Br)c1 Amb28205318 [0,1,0,0,0,1|2,0,0]=4 3432 B11R1.34 CCCc1cc(C)nc(Cl)c1 Amb24723826 [0,1,0,0,0,1|2,0,0]=4 3433 B11R1.34 CCCc1cc(C)nc(Cl)n1 Amb27477361 [0,1,0,0,0,1|2,0,0]=4 3434 B11R1.34 CCCc1cc(C)nc(N)c1 Amb26912901 [0,1,0,0,0,1|2,0,0]=4 3435 B11R1.34 CCCc1cc(C)nc(N)n1 Amb18125319 [0,1,0,0,0,1|2,0,0]=4 3436 B11R1.34 CCCc1cc(Cl)nc(C)n1 Amb6806671 [0,1,0,0,0,1|2,0,0]=4 3437 B11R1.34 CCCc1cc(F)nc(C)n1 Amb35657466 [0,1,0,0,0,1|2,0,0]=4 3438 B11R1.34 CCCc1nc(C)nc(N)n1 Amb24412452 [0,1,0,0,0,1|2,0,0]=4 3439 B11R1.34 Cc1cc(Br)cc(CCO)c1 Amb33430247 [0,1,0,0,0,1|2,0,0]=4 3440 B11R1.34 Cc1cc(C)cc(CCO)c1 Amb18181672 [0,1,0,0,0,1|2,0,0]=4 3441 B11R1.34 Cc1cc(C)nc(CCO)c1 Amb10573521 [0,1,0,0,0,1|2,0,0]=4 3442 B11R1.34 Cc1cc(CCBr)cc(Cl)n1 Amb33431840 [0,1,0,0,0,1|2,0,0]=4 3443 B11R1.34 Cc1cc(CCBr)nc(Cl)n1 Amb33334067 [0,1,0,0,0,1|2,0,0]=4 3444 B11R1.34 Cc1cc(CCN)cc(Br)n1 Amb27494770 [0,1,0,0,0,1|2,0,0]=4 3445 B11R1.34 Cc1cc(CCN)cc(C)n1 Amb18831284 [0,1,0,0,0,1|2,0,0]=4 3446 B11R1.34 Cc1cc(CCN)cc(Cl)n1 Amb24509628 [0,1,0,0,0,1|2,0,0]=4 3447 B11R1.34 Cc1cc(CCN)cc(I)n1 Amb27870605 [0,1,0,0,0,1|2,0,0]=4 3448 B11R1.34 Cc1cc(CCN)nc(C)n1 Amb10610031 [0,1,0,0,0,1|2,0,0]=4 3449 B11R1.34 Cc1cc(CCN)nc(C)n1 Amb24117896 [0,1,0,0,0,1|2,0,0]=4 3450 B11R1.34 Cc1cc(CCN)nc(Cl)n1 Amb22496335 [0,1,0,0,0,1|2,0,0]=4 3451 B11R1.34 Cc1cc(CCN)nc(O)n1 Amb18224334 [0,1,0,0,0,1|2,0,0]=4 3452 B11R1.34 Cc1cc(CCO)cc(C)n1 Amb27983562 [0,1,0,0,0,1|1,0,0]=3 3453 B11R1.34 Cc1cc(CCO)cc(Cl)n1 Amb33221891 [0,1,0,0,0,1|1,0,0]=3 3454 B11R1.34 Cc1cc(CCS)cc(Cl)n1 Amb33222571 [0,1,0,0,0,1|1,1,0]=4 3455 B11R1.34 Cc1cc(CNO)cc(Cl)n1 Amb33221408 [0,1,0,0,0,1|2,0,0]=4 3456 B11R1.34 Cc1cc(F)cc(CCO)c1 Amb28341772 [0,1,0,0,0,1|2,0,0]=4 3457 B11R1.34 Cc1nc(C)nc(CCN)n1 Amb18224310 [0,1,0,0,0,1|2,0,0]=4 3458 B11R1.34 Cc1nc(C)nc(NCO)n1 Amb28246074 [0,1,0,0,0,1|2,0,0]=4 3459 B11R1.34 Cc1nc(Cl)cc(CCN)n1 Amb28288440 [0,1,0,0,0,1|2,0,0]=4 3460 B11R1.34 Cc1nc(N)cc(CCO)n1 Amb28368631 [0,1,0,0,0,1|1,0,0]=3 3461 B11R1.34 Cc1nc(O)cc(CCN)n1 Amb10608379 [0,1,0,0,0,1|2,0,0]=4 3462 B11R1.34 Cc1nc(O)cc(CCN)n1 Amb22587230 [0,1,0,0,0,1|2,0,0]=4 3463 B11R1.34 Nc1nc(Cl)nc(CCO)n1 Amb27230189 [0,1,0,0,0,1|2,0,0]=4 3464 B11R1.34 OCCc1cc(Br)nc(Br)c1 Amb27638545 [0,1,0,0,0,1|2,0,0]=4 3465 B11R1.34 OCCc1cc(Cl)nc(Cl)c1 Amb33257752 [0,1,0,0,0,1|2,0,0]=4 3466 B11R1.34 OCCc1nc(Cl)nc(Cl)n1 Amb27631787 [0,1,0,0,0,1|2,0,0]=4 3467 B11R1.34 OCCc1nc(O)nc(O)n1 Amb25091997 [0,1,0,0,0,1|2,0,0]=4 3468 B11R1.157 Cc1cc(CC(=O)O)ccn1 Amb18831266 [0,1,0,0,0,1|1,0,1]=4 3469 B11R1.157 Cc1cc(CC(=O)O)ncn1 Amb18862487 [0,1,0,0,0,1|1,0,1]=4 3470 B11R1.157 Cc1cc(CC(C)Br)ccn1 Amb33004946 [0,1,0,0,0,1|2,0,0]=4 3471 B11R1.157 Cc1cc(CC(C)O)ccn1 Amb33268652 [0,1,0,0,0,1|1,0,0]=3 3472 B11R1.157 Cc1cc(CN(C)O)ccn1 Amb33268542 [0,1,0,0,0,1|2,0,0]=4 3473 B11R1.157 Cc1cc(C[C@@H](C)N)ccn1 Amb33080425 [0,1,0,0,0,1|2,0,0]=4 3474 B11R1.157 Cc1cc(C[C@@H](C)O)ccn1 Amb32732942 [0,1,0,0,0,1|1,0,0]=3 3475 B11R1.157 Cc1cc(C[C@H](C)N)ccn1 Amb33429460 [0,1,0,0,0,1|2,0,0]=4 3476 B11R1.157 Cc1cc(C[C@H](C)O)ccn1 Amb32732943 [0,1,0,0,0,1|1,0,0]=3 3477 B11R1.157 Cc1cccc(CC(C)O)c1 Amb17138430 [0,1,0,0,0,1|2,0,0]=4 3478 B11R1.157 Cc1cccc(CC(C)O)n1 Amb1995165 [0,1,0,0,0,1|2,0,0]=4 3479 B11R1.157 Cc1cccc(C[C@@H](C)O)c1 Amb27478645 [0,1,0,0,0,1|2,0,0]=4 3480 B11R1.157 Cc1cccc(C[C@@H](C)O)n1 Amb33199929 [0,1,0,0,0,1|2,0,0]=4 3481 B11R1.157 Cc1cccc(C[C@H](C)O)c1 Amb33380850 [0,1,0,0,0,1|2,0,0]=4 3482 B11R1.157 Cc1cccc(C[C@H](C)O)n1 Amb33199930 [0,1,0,0,0,1|2,0,0]=4 3483 B11R1.157 Cc1ccnc(CC(C)O)c1 Amb1995158 [0,1,0,0,0,1|2,0,0]=4 3484 B11R1.157 Cc1ccnc(C[C@@H](C)O)c1 Amb33318105 [0,1,0,0,0,1|2,0,0]=4 3485 B11R1.157 Cc1ccnc(C[C@H](C)O)c1 Amb33318106 [0,1,0,0,0,1|2,0,0]=4 3486 B11R1.157 Cc1nccc(CC(=O)O)n1 Amb18201470 [0,1,0,0,0,1|1,0,1]=4 3487 B11R1.189 C#Cc1cc(CCO)ccn1 Amb25682555 [0,1,0,0,0,1|1,0,1]=4 3488 B11R1.189 C=Cc1cc(CCO)ccn1 Amb26981350 [0,1,0,0,0,1|1,0,1]=4 3489 B11R1.189 CCCc1ccnc(CN)c1 Amb18201856 [0,1,0,0,0,1|2,0,0]=4 3490 B11R1.189 CCc1cccc(CCO)c1 Amb28067627 [0,1,0,0,0,1|2,0,0]=4 3491 B11R1.189 COc1cc(CCBr)ccn1 Amb24665849 [0,1,0,0,0,1|2,0,0]=4 3492 B11R1.189 COc1cc(CCN)ccn1 Amb22277082 [0,1,0,0,0,1|2,0,0]=4 3493 B11R1.189 COc1cc(CCN)ccn1 Amb22886482 [0,1,0,0,0,1|2,0,0]=4 3494 B11R1.189 COc1cc(CCN)ccn1 Amb28872298 [0,1,0,0,0,1|2,0,0]=4 3495 B11R1.189 COc1cc(CCO)ccn1 Amb24099578 [0,1,0,0,0,1|1,0,0]=3 3496 B11R1.189 COc1cc(CCS)ccn1 Amb32730162 [0,1,0,0,0,1|1,1,0]=4 3497 B11R1.189 COc1cc(CNO)ccn1 Amb24749837 [0,1,0,0,0,1|2,0,0]=4 3498 B11R1.189 COc1cccc(CCO)c1 Amb3939093 [0,1,0,0,0,1|2,0,0]=4 3499 B11R1.189 COc1cccc(CCO)n1 Amb20623518 [0,1,0,0,0,1|2,0,0]=4 3500 B11R1.189 COc1ccnc(CCO)c1 Amb26493209 [0,1,0,0,0,1|2,0,0]=4 3501 B11R1.189 COc1nccc(CCN)n1 Amb27641142 [0,1,0,0,0,1|2,0,0]=4 3502 B11R1.189 COc1nccc(CCN)n1 Amb32683428 [0,1,0,0,0,1|2,0,0]=4 3503 B11R1.189 COc1nccc(CCO)n1 Amb27954673 [0,1,0,0,0,1|1,0,0]=3 3504 B11R1.189 COc1nccc(CNO)n1 Amb27472386 [0,1,0,0,0,1|2,0,0]=4 3505 B11R1.189 CSc1cccc(CCO)c1 Amb24484434 [0,1,0,0,0,1|2,0,0]=4 3506 B11R1.189 NCCc1ccnc(CN)c1 Amb28041151 [0,1,0,0,0,1|2,0,0]=4 3507 B11R1.189 NCc1cccc(CCO)c1 Amb22235875 [0,1,0,0,0,1|2,0,0]=4 3508 B11R1.189 NCc1cccc(CCO)c1 Amb35746572 [0,1,0,0,0,1|2,0,0]=4 3509 B11R1.192 Cc1cc(CCO)ccc1Br Amb28314338 [0,1,0,0,0,1|2,0,0]=4 3510 B11R1.192 Cc1cc(CCO)ccc1Cl Amb19928757 [0,1,0,0,0,1|2,0,0]=4 3511 B11R1.192 Cc1cc(CCO)ccc1F Amb17232132 [0,1,0,0,0,1|2,0,0]=4 3512 B11R1.192 Cc1ccc(CCO)cc1C Amb17232072 [0,1,0,0,0,1|2,0,0]=4 3513 B11R1.192 Cc1nc(CCO)ccc1F Amb24460334 [0,1,0,0,0,1|2,0,0]=4 3514 B11R1.18 C#CCCc1sccc1CC Amb32729042 [0,2,0,0,0,0|2,0,0]=4 3515 B11R1.18 CCCCc1ocnc1CBr Amb27491960 [0,2,0,0,0,0|1,1,0]=4 3516 B11R1.18 CCCCc1ocnc1CCl Amb27491957 [0,2,0,0,0,0|1,1,0]=4 3517 B11R1.18 CCCCc1ocnc1CN Amb27491993 [0,2,0,0,0,0|1,1,0]=4 3518 B11R1.18 CCCCc1ocnc1CO Amb27491994 [0,2,0,0,0,0|1,1,0]=4 3519 B11R1.18 CCCNc1snnc1CO Amb18180407 [0,2,0,0,0,0|2,0,0]=4 3520 B11R1.18 CCNCc1ocnc1CC Amb27671848 [0,2,0,0,0,0|1,1,0]=4 3521 B11R1.18 CCOCc1ocnc1CBr Amb27491954 [0,2,0,0,0,0|1,1,0]=4 3522 B11R1.18 CCOCc1ocnc1CCl Amb27491958 [0,2,0,0,0,0|1,1,0]=4 3523 B11R1.18 CCOCc1ocnc1CN Amb27491995 [0,2,0,0,0,0|1,1,0]=4 3524 B11R1.18 CCOCc1ocnc1CO Amb27491968 [0,2,0,0,0,0|1,1,0]=4 3525 B11R1.18 CCc1ccsc1CCC#N Amb32729300 [0,2,0,0,0,0|2,0,0]=4 3526 B11R1.18 CCc1ccsc1CCC=O Amb32729037 [0,2,0,0,0,0|1,0,1]=4 3527 B11R1.18 CCc1ccsc1CCCBr Amb33009177 [0,2,0,0,0,0|2,0,0]=4 3528 B11R1.18 CCc1ccsc1CCCN Amb32729314 [0,2,0,0,0,0|2,0,0]=4 3529 B11R1.18 CCc1ccsc1CCCO Amb32729033 [0,2,0,0,0,0|1,0,0]=3 3530 B11R1.18 CCc1ccsc1CCCS Amb32728960 [0,2,0,0,0,0|1,1,0]=4 3531 B11R1.18 CCc1ccsc1CCNC Amb32729310 [0,2,0,0,0,0|2,0,0]=4 3532 B11R1.18 CCc1ccsc1CCON Amb32729175 [0,2,0,0,0,0|1,0,0]=3 3533 B11R1.18 CCc1ccsc1OCCN Amb32728962 [0,2,0,0,0,0|2,0,0]=4 3534 B11R1.18 CCc1ccsc1\C=C\CO Amb32729093 [0,2,0,0,0,0|1,0,1]=4 3535 B11R1.18 CCc1nccn1CCCO Amb18177337 [0,2,0,0,0,0|2,0,0]=4 3536 B11R1.18 CCn1nccc1CCCO Amb27986873 [0,2,0,0,0,0|2,0,0]=4 3537 B11R1.18 CCn1nccc1CCON Amb33323927 [0,2,0,0,0,0|2,0,0]=4 3538 B11R1.18 CCn1ncnc1CCCO Amb27270154 [0,2,0,0,0,0|2,0,0]=4 3539 B11R1.18 CCn1ncnc1CCON Amb33416953 [0,2,0,0,0,0|2,0,0]=4 3540 B11R1.18 COCCc1ocnc1CBr Amb27491959 [0,2,0,0,0,0|0,1,0]=3 3541 B11R1.18 COCCc1ocnc1CCl Amb27491956 [0,2,0,0,0,0|0,1,0]=3 3542 B11R1.18 COCCc1ocnc1CN Amb27491965 [0,2,0,0,0,0|0,1,0]=3 3543 B11R1.18 COCCc1ocnc1CO Amb27491964 [0,2,0,0,0,0|0,1,0]=3 3544 B11R1.18 COCCn1ccnc1CCl Amb2592418 [0,2,0,0,0,0|2,0,0]=4 3545 B11R1.18 COCCn1ccnc1CN Amb2592412 [0,2,0,0,0,0|2,0,0]=4 3546 B11R1.18 COCCn1ccnc1CO Amb2592411 [0,2,0,0,0,0|2,0,0]=4 3547 B11R1.18 COCCn1ccnc1CS Amb32788771 [0,2,0,0,0,0|2,0,0]=4 3548 B11R1.18 COCCn1ncnc1CCl Amb27269900 [0,2,0,0,0,0|2,0,0]=4 3549 B11R1.18 COCCn1ncnc1CN Amb27670450 [0,2,0,0,0,0|2,0,0]=4 3550 B11R1.18 COCCn1ncnc1CO Amb28387076 [0,2,0,0,0,0|2,0,0]=4 3551 B11R1.18 COc1ccsc1CCCO Amb27989484 [0,2,0,0,0,0|1,0,0]=3 3552 B11R1.18 COc1nscc1CCCO Amb32945410 [0,2,0,0,0,0|2,0,0]=4 3553 B11R1.18 CSc1sccc1CCCO Amb28388109 [0,2,0,0,0,0|2,0,0]=4 3554 B11R1.18 [C-]#[N+]CCc1sccc1CC Amb32729194 [0,2,0,0,0,0|2,0,0]=4 3555 B11R1.57 CC(C)Cc1ocnc1CO Amb28344429 [0,2,0,0,0,0|1,1,0]=4 3556 B11R1.57 CC(O)Cn1ncnc1CCl Amb28365683 [0,2,0,0,0,0|2,0,0]=4 3557 B11R1.57 CCc1ccsc1CC(=O)O Amb26336047 [0,2,0,0,0,0|1,0,1]=4 3558 B11R1.57 CCc1ccsc1CC(C)Br Amb33009118 [0,2,0,0,0,0|2,0,0]=4 3559 B11R1.57 CCc1ccsc1CC(C)O Amb32729274 [0,2,0,0,0,0|1,0,0]=3 3560 B11R1.57 CCc1ccsc1CN(C)O Amb32729311 [0,2,0,0,0,0|2,0,0]=4 3561 B11R1.57 CCc1ccsc1C[C@@H](C)N Amb32729155 [0,2,0,0,0,0|2,0,0]=4 3562 B11R1.57 CCc1ccsc1C[C@@H](C)O Amb32729152 [0,2,0,0,0,0|1,0,0]=3 3563 B11R1.57 CCc1ccsc1C[C@H](C)N Amb32729154 [0,2,0,0,0,0|2,0,0]=4 3564 B11R1.57 CCc1ccsc1C[C@H](C)O Amb32729147 [0,2,0,0,0,0|1,0,0]=3 3565 B11R1.57 CCc1nccn1C[C@@H](C)O Amb27784213 [0,2,0,0,0,0|2,0,0]=4 3566 B11R1.57 CCc1ncoc1CC(=O)O Amb18830917 [0,2,0,0,0,0|0,1,1]=4 3567 B11R1.57 CCn1nccc1CC(C)O Amb33324446 [0,2,0,0,0,0|2,0,0]=4 3568 B11R1.57 CCn1nccc1C[C@@H](C)O Amb33324319 [0,2,0,0,0,0|2,0,0]=4 3569 B11R1.57 CCn1nccc1C[C@H](C)O Amb33324315 [0,2,0,0,0,0|2,0,0]=4 3570 B11R1.57 CCn1ncnc1CC(C)O Amb27599897 [0,2,0,0,0,0|2,0,0]=4 3571 B11R1.57 CCn1ncnc1C[C@@H](C)O Amb33416781 [0,2,0,0,0,0|2,0,0]=4 3572 B11R1.57 CCn1ncnc1C[C@H](C)O Amb33416782 [0,2,0,0,0,0|2,0,0]=4 3573 B11R1.57 CNc1ccsc1CC(C)C Amb28368385 [0,2,0,0,0,0|2,0,0]=4 3574 B11R1.57 COc1ccsc1CC(C)N Amb27234664 [0,2,0,0,0,0|2,0,0]=4 3575 B11R1.57 CSc1ccsc1CC(=O)O Amb18820762 [0,2,0,0,0,0|1,0,1]=4 3576 B11R1.59 CCC(C)c1ocnc1CCl Amb28139090 [0,2,0,0,0,0|1,1,0]=4 3577 B11R1.59 CC[C@@H](N)c1sccc1OC Amb27798494 [0,2,0,0,0,0|2,0,0]=4 3578 B11R1.59 CCc1ccsc1C(C)CBr Amb33009162 [0,2,0,0,0,0|2,0,0]=4 3579 B11R1.59 CCc1ccsc1C(C)CN Amb32729315 [0,2,0,0,0,0|2,0,0]=4 3580 B11R1.59 CCc1ccsc1C(F)CN Amb32729188 [0,2,0,0,0,0|2,0,0]=4 3581 B11R1.59 CCc1ccsc1C(N)CC Amb27183997 [0,2,0,0,0,0|2,0,0]=4 3582 B11R1.59 CCc1ccsc1C(N)CO Amb32729512 [0,2,0,0,0,0|1,0,0]=3 3583 B11R1.59 CCc1ccsc1C(O)CBr Amb33009168 [0,2,0,0,0,0|2,0,0]=4 3584 B11R1.59 CCc1ccsc1C(O)CCl Amb33221292 [0,2,0,0,0,0|2,0,0]=4 3585 B11R1.59 CCc1ccsc1C(O)CF Amb32729102 [0,2,0,0,0,0|2,0,0]=4 3586 B11R1.59 CCc1ccsc1C(O)CN Amb18198489 [0,2,0,0,0,0|2,0,0]=4 3587 B11R1.59 CCc1ccsc1C(O)CO Amb32729103 [0,2,0,0,0,0|1,0,0]=3 3588 B11R1.59 CCc1ccsc1[C@@H](N)CO Amb32729183 [0,2,0,0,0,0|1,0,0]=3 3589 B11R1.59 CCc1ccsc1[C@@H](O)CN Amb32729187 [0,2,0,0,0,0|2,0,0]=4 3590 B11R1.59 CCc1ccsc1[C@H](N)CO Amb32729184 [0,2,0,0,0,0|1,0,0]=3 3591 B11R1.59 CCc1ccsc1[C@H](O)CN Amb32729185 [0,2,0,0,0,0|2,0,0]=4 3592 B11R1.59 CCc1nccn1C(C)CO Amb27982405 [0,2,0,0,0,0|2,0,0]=4 3593 B11R1.59 CCc1nnsc1C(O)CC Amb27167449 [0,2,0,0,0,0|2,0,0]=4 3594 B11R1.59 CCc1occc1C(N)CO Amb28119946 [0,2,0,0,0,0|2,0,0]=4 3595 B11R1.59 CCn1nccc1C(N)CO Amb25365381 [0,2,0,0,0,0|2,0,0]=4 3596 B11R1.59 CCn1nccc1C(O)CO Amb33456773 [0,2,0,0,0,0|2,0,0]=4 3597 B11R1.59 CCn1nccc1[C@@H](N)CO Amb33326156 [0,2,0,0,0,0|2,0,0]=4 3598 B11R1.59 CCn1nccc1[C@H](N)CO Amb33326157 [0,2,0,0,0,0|2,0,0]=4 3599 B11R1.59 CCn1ncnc1C(N)CO Amb18995504 [0,2,0,0,0,0|2,0,0]=4 3600 B11R1.59 CCn1ncnc1C(O)CO Amb32796170 [0,2,0,0,0,0|2,0,0]=4 3601 B11R1.59 CCn1ncnc1[C@@H](N)CO Amb33318821 [0,2,0,0,0,0|2,0,0]=4 3602 B11R1.59 CCn1ncnc1[C@H](N)CO Amb33318823 [0,2,0,0,0,0|2,0,0]=4 3603 B11R1.59 COc1ccsc1[C@H](N)CO Amb28250415 [0,2,0,0,0,0|1,0,0]=3 3604 B11R1.59 COc1occc1[C@@H](N)CO Amb27617348 [0,2,0,0,0,0|2,0,0]=4 3605 B11R1.59 COc1sccc1C(N)CO Amb27839695 [0,2,0,0,0,0|2,0,0]=4 3606 B11R1.59 COc1sccc1[C@@H](N)CO Amb27839867 [0,2,0,0,0,0|2,0,0]=4 3607 B11R1.59 N#Cc1ccsc1[C@H](N)CO Amb27390645 [0,2,0,0,0,0|1,0,1]=4 3608 B11R1.59 N[C@@H](CO)c1ccsc1CO Amb27175204 [0,2,0,0,0,0|2,0,0]=4 3609 B11R1.109 CCCc1nccn1CCO Amb27672868 [0,2,0,0,0,0|2,0,0]=4 3610 B11R1.109 CCCc1ocnc1CNC Amb27491970 [0,2,0,0,0,0|1,1,0]=4 3611 B11R1.109 CCCn1nccc1CCO Amb24750673 [0,2,0,0,0,0|2,0,0]=4 3612 B11R1.109 CCCn1ncnc1CCO Amb26076774 [0,2,0,0,0,0|2,0,0]=4 3613 B11R1.109 CNCc1nccn1CCO Amb2592420 [0,2,0,0,0,0|2,0,0]=4 3614 B11R1.109 COCc1ccoc1CCO Amb33423324 [0,2,0,0,0,0|1,1,0]=4 3615 B11R1.109 N#CCc1nccn1CCO Amb28370575 [0,2,0,0,0,0|2,0,0]=4 3616 B11R1.109 NNCc1nccn1CCO Amb19664591 [0,2,0,0,0,0|2,0,0]=4 3617 B11R1.183 CCCc1oc(C)nc1CN Amb25781808 [0,2,0,0,0,0|1,1,0]=4 3618 B11R1.183 CCCc1sc(N)nc1CC Amb27657379 [0,2,0,0,0,0|1,0,0]=3 3619 B11R1.183 CCc1nc(C)oc1CCN Amb27248544 [0,2,0,0,0,0|1,1,0]=4 3620 B11R1.183 CCc1nc(C)sc1CCN Amb28279976 [0,2,0,0,0,0|1,0,0]=3 3621 B11R1.183 CCn1nc(C)cc1CCO Amb25348016 [0,2,0,0,0,0|2,0,0]=4 3622 B11R1.193 CC(C)c1nccn1CCO Amb9370264 [0,2,0,0,0,0|2,0,0]=4 3623 B11R1.193 CC(C)n1nccc1CCO Amb24452558 [0,2,0,0,0,0|2,0,0]=4 3624 B11R1.193 CC(C)n1ncnc1CCO Amb27392734 [0,2,0,0,0,0|2,0,0]=4 3625 B11R1.193 CCCc1scnc1C(=O)O Amb3938738 [0,2,0,0,0,0|1,0,1]=4 3626 B11R1.193 O=C(O)c1ccsc1CCO Amb32950904 [0,2,0,0,0,0|1,0,1]=4 3627 B11R1.193 O=C(O)c1ncsc1CCCl Amb27231115 [0,2,0,0,0,0|1,0,1]=4 3628 B11R1.303 CCn1cnc(Cl)c1CCO Amb33223108 [0,2,0,0,0,0|2,0,0]=4 3629 B11R1.303 CCn1ncc(Br)c1CCO Amb27184002 [0,2,0,0,0,0|2,0,0]=4 3630 B11R1.303 CCn1ncc(Cl)c1CCO Amb26415067 [0,2,0,0,0,0|2,0,0]=4 3631 B11R1.303 COc1cnn(C)c1CCO Amb25893576 [0,2,0,0,0,0|2,0,0]=4 3632 B11R1.303 COc1ncn(C)c1CCN Amb18830883 [0,2,0,0,0,0|2,0,0]=4 3633 B11R1.303 COc1noc(C)c1CCO Amb26071512 [0,2,0,0,0,0|2,0,0]=4 3634 B11R1.303 Cc1ncc(NO)n1CCO Amb28249156 [0,2,0,0,0,0|2,0,0]=4 3635 B11R1.303 OCCn1c(Cl)cnc1CCl Amb27401830 [0,2,0,0,0,0|2,0,0]=4 3636 B11R1.90 CC(=O)CCc1sccc1C Amb26320137 [0,2,0,0,0,0|1,0,1]=4 3637 B11R1.90 CC(=O)CCc1scnc1C Amb26936638 [0,2,0,0,0,0|0,0,1]=3 3638 B11R1.90 CC(O)CCc1ccnn1C Amb26618346 [0,2,0,0,0,0|2,0,0]=4 3639 B11R1.90 CC(O)CCc1sccc1Br Amb28043657 [0,2,0,0,0,0|2,0,0]=4 3640 B11R1.90 CC(O)CCc1sccc1Cl Amb25922725 [0,2,0,0,0,0|2,0,0]=4 3641 B11R1.90 C[C@@H](O)CCc1ccnn1C Amb33323508 [0,2,0,0,0,0|2,0,0]=4 3642 B11R1.90 C[C@@H](O)CCc1sccc1Br Amb33387207 [0,2,0,0,0,0|2,0,0]=4 3643 B11R1.90 C[C@@H](O)CCc1sccc1Cl Amb33257649 [0,2,0,0,0,0|2,0,0]=4 3644 B11R1.90 C[C@H](O)CCc1ccnn1C Amb33323511 [0,2,0,0,0,0|2,0,0]=4 3645 B11R1.90 C[C@H](O)CCc1sccc1Br Amb33387334 [0,2,0,0,0,0|2,0,0]=4 3646 B11R1.90 C[C@H](O)CCc1sccc1Cl Amb33257648 [0,2,0,0,0,0|2,0,0]=4 3647 B11R1.90 Cc1ccoc1CCC(=O)O Amb18200842 [0,2,0,0,0,0|1,1,0]=4 3648 B11R1.90 Cc1ccoc1CCC(C)O Amb26395906 [0,2,0,0,0,0|1,1,0]=4 3649 B11R1.90 Cc1ccoc1CC[C@@H](C)O Amb33292666 [0,2,0,0,0,0|1,1,0]=4 3650 B11R1.90 Cc1ccoc1CC[C@H](C)O Amb33292703 [0,2,0,0,0,0|1,1,0]=4 3651 B11R1.90 Cc1ccsc1CCC(=O)O Amb2592463 [0,2,0,0,0,0|1,0,0]=3 3652 B11R1.90 Cc1ccsc1CCC(C)N Amb25954794 [0,2,0,0,0,0|2,0,0]=4 3653 B11R1.90 Cc1ccsc1CCC(C)O Amb26436900 [0,2,0,0,0,0|1,0,0]=3 3654 B11R1.90 Cc1ccsc1CC[C@@H](C)N Amb33202964 [0,2,0,0,0,0|2,0,0]=4 3655 B11R1.90 Cc1ccsc1CC[C@@H](C)O Amb33202966 [0,2,0,0,0,0|1,0,0]=3 3656 B11R1.90 Cc1ccsc1CC[C@H](C)N Amb33202963 [0,2,0,0,0,0|2,0,0]=4 3657 B11R1.90 Cc1ccsc1CC[C@H](C)O Amb33202969 [0,2,0,0,0,0|1,0,0]=3 3658 B11R1.90 Cc1ccsc1CC[N+](=O)[O-] Amb33456694 [0,2,0,0,0,0|1,0,1]=4 3659 B11R1.90 Cc1ccsc1CNC(C)C Amb20673456 [0,2,0,0,0,0|2,0,0]=4 3660 B11R1.90 Cc1ccsc1CNC(C)C Amb2592457 [0,2,0,0,0,0|2,0,0]=4 3661 B11R1.90 Cc1ccsc1OCC(=O)O Amb33202602 [0,2,0,0,0,0|1,0,1]=4 3662 B11R1.90 Cc1cnsc1CCC(=O)O Amb18198609 [0,2,0,0,0,0|2,0,0]=4 3663 B11R1.90 Cc1nccn1CCC(=O)O Amb1099401 [0,2,0,0,0,0|2,0,0]=4 3664 B11R1.90 Cc1nccn1CCC(=O)O Amb1292944 [0,2,0,0,0,0|2,0,0]=4 3665 B11R1.90 Cc1nccn1CCC(=O)O Amb8503293 [0,2,0,0,0,0|2,0,0]=4 3666 B11R1.90 Cc1nccn1CCC(C)O Amb18182916 [0,2,0,0,0,0|2,0,0]=4 3667 B11R1.90 Cc1ncnn1CCC(=O)O Amb18254989 [0,2,0,0,0,0|2,0,0]=4 3668 B11R1.90 Cc1ncoc1CCC(=O)O Amb18830918 [0,2,0,0,0,0|0,1,0]=3 3669 B11R1.90 Cc1ncsc1C#CC(=O)O Amb27812681 [0,2,0,0,0,0|0,0,2]=4 3670 B11R1.90 Cc1ncsc1C#CC(C)N Amb35616600 [0,2,0,0,0,0|1,0,1]=4 3671 B11R1.90 Cc1ncsc1CCC(=O)O Amb3941253 [0,2,0,0,0,0|0,0,0]=2 3672 B11R1.90 Cc1ncsc1CCC(C)Br Amb35632698 [0,2,0,0,0,0|1,0,0]=3 3673 B11R1.90 Cc1ncsc1CCC(C)Cl Amb35632696 [0,2,0,0,0,0|1,0,0]=3 3674 B11R1.90 Cc1ncsc1CCC(C)N Amb8011418 [0,2,0,0,0,0|1,0,0]=3 3675 B11R1.90 Cc1ncsc1CCC(C)O Amb32877620 [0,2,0,0,0,0|0,0,0]=2 3676 B11R1.90 Cc1ncsc1CCS(=O)[O-] Amb32754888 [0,2,0,0,0,0|0,0,1]=3 3677 B11R1.90 Cc1ncsc1CC[C@@H](C)N Amb32875987 [0,2,0,0,0,0|1,0,0]=3 3678 B11R1.90 Cc1ncsc1CC[C@@H](C)O Amb32876842 [0,2,0,0,0,0|0,0,0]=2 3679 B11R1.90 Cc1ncsc1CC[C@H](C)N Amb32875986 [0,2,0,0,0,0|1,0,0]=3 3680 B11R1.90 Cc1ncsc1CC[C@H](C)O Amb32876843 [0,2,0,0,0,0|0,0,0]=2 3681 B11R1.90 Cc1ncsc1CC[N+](=O)[O-] Amb33456717 [0,2,0,0,0,0|0,0,1]=3 3682 B11R1.90 Cc1ncsc1CNC(C)C Amb2592081 [0,2,0,0,0,0|1,0,0]=3 3683 B11R1.90 Cc1ncsc1CNN(C)C Amb27184137 [0,2,0,0,0,0|2,0,0]=4 3684 B11R1.90 Cc1ncsc1COC(=O)Cl Amb33297067 [0,2,0,0,0,0|0,0,2]=4 3685 B11R1.90 Cc1ncsc1CSC(C)C Amb27840282 [0,2,0,0,0,0|1,0,0]=3 3686 B11R1.90 Cc1ncsc1OCC(=O)O Amb33271215 [0,2,0,0,0,0|0,0,1]=3 3687 B11R1.90 Cc1ncsc1\C=C\B(O)O Amb35640684 [0,2,0,0,0,0|0,0,2]=4 3688 B11R1.90 Cc1ncsc1\C=C\C(=O)O Amb33292464 [0,2,0,0,0,0|0,0,2]=4 3689 B11R1.90 Cc1ncsc1\C=C\C(C)Br Amb27768557 [0,2,0,0,0,0|1,0,1]=4 3690 B11R1.90 Cc1ncsc1\C=C\C(C)N Amb33171866 [0,2,0,0,0,0|1,0,1]=4 3691 B11R1.90 Cc1nnsc1CCC(=O)O Amb28239590 [0,2,0,0,0,0|1,0,0]=3 3692 B11R1.90 Cc1nnsc1CNC(C)C Amb28047699 [0,2,0,0,0,0|2,0,0]=4 3693 B11R1.90 Cc1nnsc1SCC(=O)O Amb2420951 [0,2,0,0,0,0|1,0,1]=4 3694 B11R1.90 Cc1nocc1CCC(=O)O Amb18200518 [0,2,0,0,0,0|2,0,0]=4 3695 B11R1.90 Cc1nonc1CCC(=O)O Amb18200254 [0,2,0,0,0,0|2,0,0]=4 3696 B11R1.90 Cc1nonc1CCC(C)O Amb27171082 [0,2,0,0,0,0|2,0,0]=4 3697 B11R1.90 Cc1nsnc1CCC(=O)O Amb18825365 [0,2,0,0,0,0|2,0,0]=4 3698 B11R1.90 Cc1occc1CCC(C)O Amb27407358 [0,2,0,0,0,0|2,0,0]=4 3699 B11R1.90 Cc1occc1CC[C@@H](C)O Amb33225865 [0,2,0,0,0,0|2,0,0]=4 3700 B11R1.90 Cc1occc1CC[C@H](C)O Amb33274785 [0,2,0,0,0,0|2,0,0]=4 3701 B11R1.90 Cc1ocnc1CCC(=O)O Amb18200534 [0,2,0,0,0,0|2,0,0]=4 3702 B11R1.90 Cc1sccc1CCC(=O)O Amb18198905 [0,2,0,0,0,0|2,0,0]=4 3703 B11R1.90 Cc1sccc1CCC(C)O Amb27461751 [0,2,0,0,0,0|2,0,0]=4 3704 B11R1.90 Cn1nccc1CCC(=O)O Amb6888350 [0,2,0,0,0,0|2,0,0]=4 3705 B11R1.90 Cn1ncnc1CCC(=O)O Amb18995485 [0,2,0,0,0,0|2,0,0]=4 3706 B11R1.90 O=C(O)CCc1sccc1Br Amb18293479 [0,2,0,0,0,0|2,0,0]=4 3707 B11R1.90 O=C(O)CCc1sccc1Cl Amb28061379 [0,2,0,0,0,0|2,0,0]=4 3708 B11R1.90 O=C(O)CCc1sccc1F Amb33470227 [0,2,0,0,0,0|2,0,0]=4 3709 B11R1.90 O=C(O)CCc1sccc1I Amb33470233 [0,2,0,0,0,0|2,0,0]=4 3710 B11R1.90 O=C(O)CCc1scnc1Br Amb18732847 [0,2,0,0,0,0|1,0,0]=3 3711 B11R1.180 C=CCNCc1sccc1C Amb10825131 [0,2,0,0,0,0|2,0,0]=4 3712 B11R1.180 C=CCNCc1sccc1C Amb1934178 [0,2,0,0,0,0|2,0,0]=4 3713 B11R1.180 C=CCNCc1sccc1C Amb19890383 [0,2,0,0,0,0|2,0,0]=4 3714 B11R1.180 C=CCNCc1scnc1C Amb27266602 [0,2,0,0,0,0|1,0,0]=3 3715 B11R1.180 C=CCSCc1scnc1C Amb28386989 [0,2,0,0,0,0|1,0,0]=3 3716 B11R1.180 CCCCSc1snnc1C Amb2424245 [0,2,0,0,0,0|2,0,0]=4 3717 B11R1.180 CCCNCc1ocnc1C Amb18200661 [0,2,0,0,0,0|1,1,0]=4 3718 B11R1.180 CCCNCc1sccc1C Amb19890330 [0,2,0,0,0,0|2,0,0]=4 3719 B11R1.180 CCCNCc1sccc1C Amb838001 [0,2,0,0,0,0|2,0,0]=4 3720 B11R1.180 CCCNCc1scnc1C Amb9214734 [0,2,0,0,0,0|1,0,0]=3 3721 B11R1.180 CCCNCc1snnc1C Amb27987043 [0,2,0,0,0,0|2,0,0]=4 3722 B11R1.180 CCCSCc1scnc1C Amb27270526 [0,2,0,0,0,0|1,0,0]=3 3723 B11R1.180 CCNCCc1sccc1C Amb27670956 [0,2,0,0,0,0|2,0,0]=4 3724 B11R1.180 CCOCCc1scnc1C Amb8629070 [0,2,0,0,0,0|0,0,0]=2 3725 B11R1.180 CCONCc1snnc1C Amb27491286 [0,2,0,0,0,0|2,0,0]=4 3726 B11R1.180 CCSCCc1scnc1C Amb27988885 [0,2,0,0,0,0|0,1,0]=3 3727 B11R1.180 CNCC#Cc1scnc1C Amb35616603 [0,2,0,0,0,0|1,0,1]=4 3728 B11R1.180 COCCCc1sccc1C Amb27266496 [0,2,0,0,0,0|1,0,0]=3 3729 B11R1.180 COCCOc1ocnc1C Amb27674373 [0,2,0,0,0,0|0,1,0]=3 3730 B11R1.180 COCCOc1sccc1C Amb27266497 [0,2,0,0,0,0|1,0,0]=3 3731 B11R1.180 CONCCn1ccnc1C Amb27987582 [0,2,0,0,0,0|2,0,0]=4 3732 B11R1.180 Cc1ccoc1CSCCO Amb32987905 [0,2,0,0,0,0|1,1,0]=4 3733 B11R1.180 Cc1ccsc1C#CCCCl Amb27668380 [0,2,0,0,0,0|2,0,0]=4 3734 B11R1.180 Cc1ccsc1CCCC=O Amb18126559 [0,2,0,0,0,0|1,0,1]=4 3735 B11R1.180 Cc1ccsc1CCCCN Amb18198972 [0,2,0,0,0,0|2,0,0]=4 3736 B11R1.180 Cc1ccsc1CCN=C=O Amb33203329 [0,2,0,0,0,0|1,0,1]=4 3737 B11R1.180 Cc1ccsc1CCN=[N+]=[N-] Amb33202594 [0,2,0,0,0,0|2,0,0]=4 3738 B11R1.180 Cc1ccsc1CNCCO Amb837984 [0,2,0,0,0,0|1,0,0]=3 3739 B11R1.180 Cc1ccsc1NCCCN Amb28365094 [0,2,0,0,0,0|2,0,0]=4 3740 B11R1.180 Cc1ccsc1OCCCN Amb33202595 [0,2,0,0,0,0|2,0,0]=4 3741 B11R1.180 Cc1ncoc1CCCCN Amb18200710 [0,2,0,0,0,0|1,1,0]=4 3742 B11R1.180 Cc1ncsc1C#CCCCl Amb35632676 [0,2,0,0,0,0|1,0,0]=3 3743 B11R1.180 Cc1ncsc1C#CCCN Amb35616602 [0,2,0,0,0,0|1,0,0]=3 3744 B11R1.180 Cc1ncsc1C#CCCO Amb35616584 [0,2,0,0,0,0|0,0,0]=2 3745 B11R1.180 Cc1ncsc1CCCC=O Amb33272495 [0,2,0,0,0,0|0,0,1]=3 3746 B11R1.180 Cc1ncsc1CCCCBr Amb26069627 [0,2,0,0,0,0|1,0,0]=3 3747 B11R1.180 Cc1ncsc1CCCCCl Amb25386245 [0,2,0,0,0,0|1,0,0]=3 3748 B11R1.180 Cc1ncsc1CCCCN Amb18312664 [0,2,0,0,0,0|1,0,0]=3 3749 B11R1.180 Cc1ncsc1CCN=C=O Amb25269181 [0,2,0,0,0,0|0,0,1]=3 3750 B11R1.180 Cc1ncsc1CCN=[N+]=[N-] Amb18185568 [0,2,0,0,0,0|1,0,0]=3 3751 B11R1.180 Cc1ncsc1CCOC=O Amb22234293 [0,2,0,0,0,0|0,0,0]=2 3752 B11R1.180 Cc1ncsc1CNCCF Amb27987660 [0,2,0,0,0,0|1,0,0]=3 3753 B11R1.180 Cc1ncsc1CNCCO Amb26650563 [0,2,0,0,0,0|0,0,0]=2 3754 B11R1.180 Cc1ncsc1CSCCO Amb28386990 [0,2,0,0,0,0|0,0,0]=2 3755 B11R1.180 Cc1ncsc1NCCCN Amb35591179 [0,2,0,0,0,0|1,0,0]=3 3756 B11R1.180 Cc1ncsc1OCCCN Amb33271209 [0,2,0,0,0,0|1,0,0]=3 3757 B11R1.180 Cc1ncsc1\C=C\CCBr Amb35635983 [0,2,0,0,0,0|1,0,0]=3 3758 B11R1.180 Cc1ncsc1\C=C\CCCl Amb35635982 [0,2,0,0,0,0|1,0,0]=3 3759 B11R1.180 Cc1nnsc1CCCCN Amb18198469 [0,2,0,0,0,0|2,0,0]=4 3760 B11R1.180 Cc1nnsc1CNCC#N Amb27803902 [0,2,0,0,0,0|2,0,0]=4 3761 B11R1.180 Cc1nnsc1\C=C\CCN Amb27847762 [0,2,0,0,0,0|2,0,0]=4 3762 B11R1.180 Cc1nonc1CNCCO Amb27266984 [0,2,0,0,0,0|2,0,0]=4 3763 B11R1.180 Cc1nonc1CSCCO Amb27266983 [0,2,0,0,0,0|2,0,0]=4 3764 B11R1.180 Cc1occc1SCCCO Amb27670678 [0,2,0,0,0,0|2,0,0]=4 3765 B11R1.180 Cc1ocnc1CSCCO Amb28387189 [0,2,0,0,0,0|2,0,0]=4 3766 B11R1.180 Cn1nccc1CCCCO Amb27987253 [0,2,0,0,0,0|2,0,0]=4 3767 B11R1.180 Cn1nccc1CNCCO Amb6891063 [0,2,0,0,0,0|2,0,0]=4 3768 B11R1.180 Cn1nccc1CSCCO Amb27271908 [0,2,0,0,0,0|2,0,0]=4 3769 B11R1.180 Cn1ncnc1CCCCO Amb27987882 [0,2,0,0,0,0|2,0,0]=4 3770 B11R1.180 Cn1ncnc1CNCCO Amb27987863 [0,2,0,0,0,0|2,0,0]=4 3771 B11R1.180 Cn1ncnc1CSCCO Amb27269895 [0,2,0,0,0,0|2,0,0]=4 3772 B11R1.180 Nc1ccsc1CNCCO Amb27271394 [0,2,0,0,0,0|2,0,0]=4 3773 B11R1.180 OCCCCc1sccc1Br Amb27986871 [0,2,0,0,0,0|2,0,0]=4 3774 B11R1.180 OCCCCc1sccc1Cl Amb27987123 [0,2,0,0,0,0|2,0,0]=4 3775 B11R1.180 OCCNCc1sccc1Br Amb27269144 [0,2,0,0,0,0|2,0,0]=4 3776 B11R1.180 OCCNCc1sccc1F Amb27270962 [0,2,0,0,0,0|2,0,0]=4 3777 B11R1.180 OCCNCc1sccc1I Amb27269433 [0,2,0,0,0,0|2,0,0]=4 3778 B11R1.180 OCCSCc1sccc1Br Amb27269143 [0,2,0,0,0,0|2,0,0]=4 3779 B11R1.180 OCCSCc1sccc1Cl Amb27987136 [0,2,0,0,0,0|2,0,0]=4 3780 B11R1.199 C#CCC(C)c1sccc1C Amb27603434 [0,2,0,0,0,0|2,0,0]=4 3781 B11R1.199 C#CCC(N)c1scnc1C Amb27945733 [0,2,0,0,0,0|1,0,0]=3 3782 B11R1.199 C=C(CCN)c1sccc1C Amb33202896 [0,2,0,0,0,0|2,0,0]=4 3783 B11R1.199 C=C(CCN)c1scnc1C Amb33271235 [0,2,0,0,0,0|1,0,0]=3 3784 B11R1.199 C=CCC(C)c1sccc1C Amb27169944 [0,2,0,0,0,0|2,0,0]=4 3785 B11R1.199 C=CC[C@@H](N)c1sccc1C Amb28397890 [0,2,0,0,0,0|2,0,0]=4 3786 B11R1.199 CC(CON)c1ccnn1C Amb33323515 [0,2,0,0,0,0|2,0,0]=4 3787 B11R1.199 CC(CON)c1sccc1Br Amb33387193 [0,2,0,0,0,0|2,0,0]=4 3788 B11R1.199 CC(CON)c1sccc1Cl Amb33257633 [0,2,0,0,0,0|2,0,0]=4 3789 B11R1.199 CCCC(=O)c1sccc1C Amb3940840 [0,2,0,0,0,0|2,0,0]=4 3790 B11R1.199 CCCC(=O)c1scnc1C Amb28041311 [0,2,0,0,0,0|1,0,0]=3 3791 B11R1.199 CCCC(=O)c1snnc1C Amb27248156 [0,2,0,0,0,0|2,0,0]=4 3792 B11R1.199 CCCC(Cl)c1sccc1C Amb27262009 [0,2,0,0,0,0|2,0,0]=4 3793 B11R1.199 CCCC(Cl)c1scnc1C Amb35635995 [0,2,0,0,0,0|1,0,0]=3 3794 B11R1.199 CCCC(N)c1sccc1C Amb18979695 [0,2,0,0,0,0|2,0,0]=4 3795 B11R1.199 CCCC(N)c1sccc1C Amb35745605 [0,2,0,0,0,0|2,0,0]=4 3796 B11R1.199 CCCC(N)c1scnc1C Amb27390895 [0,2,0,0,0,0|1,0,0]=3 3797 B11R1.199 CCCC(O)c1sccc1C Amb18180287 [0,2,0,0,0,0|2,0,0]=4 3798 B11R1.199 CCCC(O)c1scnc1Br Amb28062644 [0,2,0,0,0,0|2,0,0]=4 3799 B11R1.199 CCCC(O)c1scnc1C Amb27950830 [0,2,0,0,0,0|1,0,0]=3 3800 B11R1.199 CCCS(=O)c1snnc1C Amb2424258 [0,2,0,0,0,0|2,0,0]=4 3801 B11R1.199 CCC[C@@H](N)c1sccc1C Amb27413066 [0,2,0,0,0,0|2,0,0]=4 3802 B11R1.199 CCC[C@H](N)c1sccc1C Amb28046866 [0,2,0,0,0,0|2,0,0]=4 3803 B11R1.199 CCC[C@H](O)c1sccc1C Amb27965190 [0,2,0,0,0,0|2,0,0]=4 3804 B11R1.199 CCOC(=O)c1scnc1C Amb8391091 [0,2,0,0,0,0|1,0,1]=4 3805 B11R1.199 CNCC(=O)c1scnc1C Amb33131391 [0,2,0,0,0,0|1,0,1]=4 3806 B11R1.199 CNCC(O)c1sccc1C Amb18301176 [0,2,0,0,0,0|2,0,0]=4 3807 B11R1.199 CNCC(O)c1scnc1C Amb18198178 [0,2,0,0,0,0|1,0,0]=3 3808 B11R1.199 COCC(N)c1ccnn1C Amb10607927 [0,2,0,0,0,0|2,0,0]=4 3809 B11R1.199 COCC(N)c1ccsc1C Amb27647409 [0,2,0,0,0,0|2,0,0]=4 3810 B11R1.199 COCC(N)c1sccc1Cl Amb27391195 [0,2,0,0,0,0|2,0,0]=4 3811 B11R1.199 COCC(O)c1scnc1C Amb27989219 [0,2,0,0,0,0|0,0,0]=2 3812 B11R1.199 COC[C@H](N)c1sccc1Br Amb28398021 [0,2,0,0,0,0|2,0,0]=4 3813 B11R1.199 COC[C@H](N)c1sccc1Cl Amb28313612 [0,2,0,0,0,0|2,0,0]=4 3814 B11R1.199 CONC(C)c1sccc1C Amb28325018 [0,2,0,0,0,0|2,0,0]=4 3815 B11R1.199 CSCC(=O)c1scnc1C Amb35613078 [0,2,0,0,0,0|0,1,1]=4 3816 B11R1.199 CSCC(N)c1sccc1C Amb28187971 [0,2,0,0,0,0|1,1,0]=4 3817 B11R1.199 CSCC(N)c1scnc1C Amb35616610 [0,2,0,0,0,0|0,1,0]=3 3818 B11R1.199 CSCC(O)c1scnc1C Amb35612916 [0,2,0,0,0,0|0,1,0]=3 3819 B11R1.199 Cc1ccoc1C(C)CON Amb33343534 [0,2,0,0,0,0|1,1,0]=4 3820 B11R1.199 Cc1ccoc1C(N)CCO Amb24423917 [0,2,0,0,0,0|1,1,0]=4 3821 B11R1.199 Cc1ccsc1C(=O)CCBr Amb27427522 [0,2,0,0,0,0|2,0,0]=4 3822 B11R1.199 Cc1ccsc1C(=O)CCN Amb26870693 [0,2,0,0,0,0|2,0,0]=4 3823 B11R1.199 Cc1ccsc1C(C)CCCl Amb27168726 [0,2,0,0,0,0|2,0,0]=4 3824 B11R1.199 Cc1ccsc1C(C)CCN Amb26372371 [0,2,0,0,0,0|2,0,0]=4 3825 B11R1.199 Cc1ccsc1C(C)CCS Amb27853116 [0,2,0,0,0,0|1,1,0]=4 3826 B11R1.199 Cc1ccsc1C(C)CON Amb33202976 [0,2,0,0,0,0|1,0,0]=3 3827 B11R1.199 Cc1ccsc1C(F)CCN Amb24486935 [0,2,0,0,0,0|2,0,0]=4 3828 B11R1.199 Cc1ccsc1C(N)CCN Amb28197936 [0,2,0,0,0,0|2,0,0]=4 3829 B11R1.199 Cc1ccsc1C(N)CCO Amb18990236 [0,2,0,0,0,0|1,0,0]=3 3830 B11R1.199 Cc1ccsc1C(O)CC#N Amb25149160 [0,2,0,0,0,0|2,0,0]=4 3831 B11R1.199 Cc1ccsc1C(O)CCN Amb18252169 [0,2,0,0,0,0|2,0,0]=4 3832 B11R1.199 Cc1ccsc1C(O)CCO Amb22268369 [0,2,0,0,0,0|1,0,0]=3 3833 B11R1.199 Cc1ccsc1[C@@H](N)CCN Amb28142318 [0,2,0,0,0,0|2,0,0]=4 3834 B11R1.199 Cc1ccsc1[C@@H](N)CCO Amb26019553 [0,2,0,0,0,0|1,0,0]=3 3835 B11R1.199 Cc1ccsc1[C@@H](O)CCN Amb33202986 [0,2,0,0,0,0|2,0,0]=4 3836 B11R1.199 Cc1ccsc1[C@H](N)CC#N Amb27817796 [0,2,0,0,0,0|2,0,0]=4 3837 B11R1.199 Cc1ccsc1[C@H](N)CCO Amb27881637 [0,2,0,0,0,0|1,0,0]=3 3838 B11R1.199 Cc1ccsc1[C@H](O)CCN Amb33226393 [0,2,0,0,0,0|2,0,0]=4 3839 B11R1.199 Cc1ncoc1C(=O)CCN Amb18200811 [0,2,0,0,0,0|1,1,0]=4 3840 B11R1.199 Cc1ncoc1C(C)CCN Amb18200709 [0,2,0,0,0,0|1,1,0]=4 3841 B11R1.199 Cc1ncoc1C(O)CCN Amb18830790 [0,2,0,0,0,0|1,1,0]=4 3842 B11R1.199 Cc1ncsc1C(=O)CCN Amb18198889 [0,2,0,0,0,0|1,0,0]=3 3843 B11R1.199 Cc1ncsc1C(C)CCN Amb18825503 [0,2,0,0,0,0|1,0,0]=3 3844 B11R1.199 Cc1ncsc1C(C)CON Amb32876002 [0,2,0,0,0,0|0,0,0]=2 3845 B11R1.199 Cc1ncsc1C(C)N=C=O Amb32876319 [0,2,0,0,0,0|0,0,2]=4 3846 B11R1.199 Cc1ncsc1C(F)CCN Amb32877633 [0,2,0,0,0,0|1,0,0]=3 3847 B11R1.199 Cc1ncsc1C(N)CCO Amb32876346 [0,2,0,0,0,0|0,0,0]=2 3848 B11R1.199 Cc1ncsc1C(O)CC#N Amb32875936 [0,2,0,0,0,0|1,0,0]=3 3849 B11R1.199 Cc1ncsc1C(O)CCN Amb18198197 [0,2,0,0,0,0|1,0,0]=3 3850 B11R1.199 Cc1ncsc1[C@@H](N)CCO Amb32794325 [0,2,0,0,0,0|0,0,0]=2 3851 B11R1.199 Cc1ncsc1[C@@H](O)CCN Amb32876029 [0,2,0,0,0,0|1,0,0]=3 3852 B11R1.199 Cc1ncsc1[C@H](C)N=[N+]=[N-] Amb27982324 [0,2,0,0,0,0|2,0,0]=4 3853 B11R1.199 Cc1ncsc1[C@H](N)CCO Amb32794361 [0,2,0,0,0,0|0,0,0]=2 3854 B11R1.199 Cc1ncsc1[C@H](O)CCN Amb32876030 [0,2,0,0,0,0|1,0,0]=3 3855 B11R1.199 Cc1nnsc1C(O)CCN Amb27658198 [0,2,0,0,0,0|2,0,0]=4 3856 B11R1.199 Cc1occc1C(C)CON Amb33275062 [0,2,0,0,0,0|2,0,0]=4 3857 B11R1.199 Cc1occc1C(N)CCO Amb26361730 [0,2,0,0,0,0|2,0,0]=4 3858 B11R1.199 Cc1occc1[C@@H](N)CCO Amb26372226 [0,2,0,0,0,0|2,0,0]=4 3859 B11R1.199 Cc1occc1[C@H](N)CCO Amb27153746 [0,2,0,0,0,0|2,0,0]=4 3860 B11R1.199 Cc1sccc1[C@@H](N)CCO Amb28130670 [0,2,0,0,0,0|2,0,0]=4 3861 B11R1.199 Cc1sccc1[C@H](N)CCO Amb27839880 [0,2,0,0,0,0|2,0,0]=4 3862 B11R1.199 Cn1nccc1C(N)CCO Amb28050835 [0,2,0,0,0,0|2,0,0]=4 3863 B11R1.199 Cn1nccc1C(O)CCO Amb23456176 [0,2,0,0,0,0|2,0,0]=4 3864 B11R1.199 Cn1ncnc1C(N)CCO Amb18300408 [0,2,0,0,0,0|2,0,0]=4 3865 B11R1.199 NC(CCO)c1sccc1Br Amb24427640 [0,2,0,0,0,0|2,0,0]=4 3866 B11R1.199 NC(CCO)c1sccc1Cl Amb25326380 [0,2,0,0,0,0|2,0,0]=4 3867 B11R1.199 NC(CCO)c1sccc1O Amb27839716 [0,2,0,0,0,0|2,0,0]=4 3868 B11R1.199 NCCC(O)c1scnc1Cl Amb32693980 [0,2,0,0,0,0|2,0,0]=4 3869 B11R1.199 N[C@@H](CCO)c1sccc1Br Amb25363635 [0,2,0,0,0,0|2,0,0]=4 3870 B11R1.199 N[C@@H](CCO)c1sccc1Cl Amb25757247 [0,2,0,0,0,0|2,0,0]=4 3871 B11R1.199 N[C@@H](CCO)c1sccc1I Amb27438440 [0,2,0,0,0,0|2,0,0]=4 3872 B11R1.199 N[C@H](CCO)c1sccc1Br Amb25923133 [0,2,0,0,0,0|2,0,0]=4 3873 B11R1.199 N[C@H](CCO)c1sccc1Cl Amb24453238 [0,2,0,0,0,0|2,0,0]=4 3874 B11R1.199 N[C@H](CCO)c1sccc1F Amb27439103 [0,2,0,0,0,0|2,0,0]=4 3875 B11R1.199 Nc1ccsc1[C@@H](N)CCO Amb27450733 [0,2,0,0,0,0|2,0,0]=4 3876 B11R1.212 COCCc1scc(N)c1C Amb27613595 [0,2,0,0,0,0|1,0,0]=3 3877 B11R1.212 Cc1c(N)nsc1NCCO Amb27399130 [0,2,0,0,0,0|2,0,0]=4 3878 B11R1.212 Cc1csc(CCCO)c1Br Amb33434291 [0,2,0,0,0,0|2,0,0]=4 3879 B11R1.212 Cc1csc(CCON)c1Br Amb33434224 [0,2,0,0,0,0|2,0,0]=4 3880 B11R1.228 CC(CBr)Cc1scnc1Cl Amb32690325 [0,2,0,0,0,0|2,0,0]=4 3881 B11R1.228 CC(CCl)Cc1scnc1Cl Amb32690324 [0,2,0,0,0,0|2,0,0]=4 3882 B11R1.228 CC(CO)Cc1sccc1Cl Amb28044428 [0,2,0,0,0,0|2,0,0]=4 3883 B11R1.228 CCC(C)Sc1snnc1C Amb2424246 [0,2,0,0,0,0|2,0,0]=4 3884 B11R1.228 CCC(Cl)Cc1sccc1C Amb17477698 [0,2,0,0,0,0|2,0,0]=4 3885 B11R1.228 CCC(O)Cc1ncnn1C Amb28423677 [0,2,0,0,0,0|2,0,0]=4 3886 B11R1.228 CCC(O)Cc1sccc1Br Amb27617386 [0,2,0,0,0,0|2,0,0]=4 3887 B11R1.228 CCC(O)Cc1sccc1C Amb17477696 [0,2,0,0,0,0|1,0,0]=3 3888 B11R1.228 CCS(=O)Cc1scnc1C Amb27829512 [0,2,0,0,0,0|1,0,0]=3 3889 B11R1.228 COC(=O)Cc1scnc1F Amb25927173 [0,2,0,0,0,0|1,0,1]=4 3890 B11R1.228 CON(C)Cc1scnc1C Amb27594522 [0,2,0,0,0,0|1,0,0]=3 3891 B11R1.228 C\C(=C\c1sccc1C)CO Amb28128374 [0,2,0,0,0,0|1,0,1]=4 3892 B11R1.228 Cc1ccoc1CC(N)CO Amb33343551 [0,2,0,0,0,0|1,1,0]=4 3893 B11R1.228 Cc1ccoc1CC(O)CN Amb33343144 [0,2,0,0,0,0|1,1,0]=4 3894 B11R1.228 Cc1ccsc1CC(C)CN Amb27979140 [0,2,0,0,0,0|2,0,0]=4 3895 B11R1.228 Cc1ccsc1CC(C)CS Amb27968723 [0,2,0,0,0,0|1,1,0]=4 3896 B11R1.228 Cc1ccsc1CC(N)CO Amb28245406 [0,2,0,0,0,0|1,0,0]=3 3897 B11R1.228 Cc1ccsc1CC(O)CN Amb33202914 [0,2,0,0,0,0|1,0,0]=3 3898 B11R1.228 Cc1nccn1CC(N)CO Amb28241690 [0,2,0,0,0,0|2,0,0]=4 3899 B11R1.228 Cc1nccn1CC(O)CF Amb24646409 [0,2,0,0,0,0|2,0,0]=4 3900 B11R1.228 Cc1nccn1CC(O)CO Amb18337989 [0,2,0,0,0,0|2,0,0]=4 3901 B11R1.228 Cc1ncsc1CC(C)C=O Amb35608814 [0,2,0,0,0,0|0,0,1]=3 3902 B11R1.228 Cc1ncsc1CC(C)CBr Amb35632699 [0,2,0,0,0,0|1,0,0]=3 3903 B11R1.228 Cc1ncsc1CC(C)CCl Amb35632697 [0,2,0,0,0,0|1,0,0]=3 3904 B11R1.228 Cc1ncsc1CC(C)CN Amb29878274 [0,2,0,0,0,0|1,0,0]=3 3905 B11R1.228 Cc1ncsc1CC(C)CO Amb35590266 [0,2,0,0,0,0|0,0,0]=2 3906 B11R1.228 Cc1ncsc1CC(N)CN Amb27435618 [0,2,0,0,0,0|1,0,0]=3 3907 B11R1.228 Cc1ncsc1CC(N)CO Amb27976174 [0,2,0,0,0,0|0,0,0]=2 3908 B11R1.228 Cc1ncsc1CC(O)CCl Amb35632373 [0,2,0,0,0,0|0,0,0]=2 3909 B11R1.228 Cc1ncsc1CC(O)CN Amb33272889 [0,2,0,0,0,0|0,0,0]=2 3910 B11R1.228 Cc1ncsc1CN(C)C=O Amb27397110 [0,2,0,0,0,0|0,0,2]=4 3911 B11R1.228 Cc1ncsc1NC(=O)CO Amb27836633 [0,2,0,0,0,0|0,0,1]=3 3912 B11R1.228 Cc1nnsc1CC(C)CBr Amb26594814 [0,2,0,0,0,0|2,0,0]=4 3913 B11R1.228 Cc1nnsc1CC(C)CCl Amb26971043 [0,2,0,0,0,0|2,0,0]=4 3914 B11R1.228 Cc1occc1CC(N)CO Amb33275083 [0,2,0,0,0,0|2,0,0]=4 3915 B11R1.228 Cc1occc1CC(O)CN Amb33274370 [0,2,0,0,0,0|2,0,0]=4 3916 B11R1.228 Cc1sccc1CC(C)CO Amb27202175 [0,2,0,0,0,0|2,0,0]=4 3917 B11R1.228 Cn1nccc1CC(N)CO Amb33324365 [0,2,0,0,0,0|2,0,0]=4 3918 B11R1.228 Cn1nccc1CC(O)CN Amb27184014 [0,2,0,0,0,0|2,0,0]=4 3919 B11R1.228 Cn1ncnc1CC(N)CO Amb27752548 [0,2,0,0,0,0|2,0,0]=4 3920 B11R1.228 Cn1ncnc1CC(O)C=O Amb27982332 [0,2,0,0,0,0|2,0,0]=4 3921 B11R1.228 NC(CO)Cc1sccc1Br Amb25770782 [0,2,0,0,0,0|2,0,0]=4 3922 B11R1.228 NC(CO)Cc1sccc1Cl Amb25857310 [0,2,0,0,0,0|2,0,0]=4 3923 B11R1.228 NCC(=O)Cc1scnc1Cl Amb33307965 [0,2,0,0,0,0|2,0,0]=4 3924 B11R1.228 NCC(O)Cc1sccc1Br Amb28248590 [0,2,0,0,0,0|2,0,0]=4 3925 B11R1.228 NCC(O)Cc1sccc1Cl Amb25117083 [0,2,0,0,0,0|2,0,0]=4 3926 B11R1.228 O=CC(O)Cc1sccc1Br Amb27474535 [0,2,0,0,0,0|2,0,0]=4 3927 B11R1.230 C#CCSc1sc(N)nc1C Amb6261144 [0,2,0,0,0,0|1,0,1]=4 3928 B11R1.230 CC1=NC(=S)N=C1CCCN Amb27463205 [0,2,0,0,0,0|2,0,0]=4 3929 B11R1.230 CCCOc1sc(C)nc1Br Amb25040552 [0,2,0,0,0,0|2,0,0]=4 3930 B11R1.230 CCNCc1sc(C)nc1C Amb17518073 [0,2,0,0,0,0|1,0,0]=3 3931 B11R1.230 CNCCc1sc(C)nc1C Amb27782538 [0,2,0,0,0,0|1,0,0]=3 3932 B11R1.230 COCCN1SC(N)=NC1=O Amb23580015 [0,2,0,0,0,0|2,0,0]=4 3933 B11R1.230 COCCc1oc(N)nc1C Amb27435264 [0,2,0,0,0,0|0,1,0]=3 3934 B11R1.230 COCCc1sc(Br)nc1C Amb27785585 [0,2,0,0,0,0|0,0,0]=2 3935 B11R1.230 COCCc1sc(C)nc1C Amb27444749 [0,2,0,0,0,0|0,0,0]=2 3936 B11R1.230 COCCc1sc(Cl)nc1C Amb28434423 [0,2,0,0,0,0|0,0,0]=2 3937 B11R1.230 COCCc1sc(N)nc1C Amb27862733 [0,2,0,0,0,0|0,0,0]=2 3938 B11R1.230 Cc1cc(Br)c(CCCO)s1 Amb33431404 [0,2,0,0,0,0|2,0,0]=4 3939 B11R1.230 Cc1cc(Br)c(CCON)s1 Amb33430899 [0,2,0,0,0,0|2,0,0]=4 3940 B11R1.230 Cc1cc(Br)oc1CCCO Amb33387181 [0,2,0,0,0,0|1,1,0]=4 3941 B11R1.230 Cc1cc(Br)oc1CCON Amb33450795 [0,2,0,0,0,0|1,1,0]=4 3942 B11R1.230 Cc1cc(C)c(CCCO)o1 Amb27255249 [0,2,0,0,0,0|1,1,0]=4 3943 B11R1.230 Cc1cc(CCCO)c(C)o1 Amb33343605 [0,2,0,0,0,0|2,0,0]=4 3944 B11R1.230 Cc1cc(CCCO)c(C)s1 Amb28206107 [0,2,0,0,0,0|2,0,0]=4 3945 B11R1.230 Cc1cc(CCCO)n(C)n1 Amb24357831 [0,2,0,0,0,0|2,0,0]=4 3946 B11R1.230 Cc1cc(CCON)c(C)o1 Amb33225808 [0,2,0,0,0,0|2,0,0]=4 3947 B11R1.230 Cc1cc(CCON)c(C)s1 Amb33473067 [0,2,0,0,0,0|2,0,0]=4 3948 B11R1.230 Cc1cc(CCON)n(C)n1 Amb33318799 [0,2,0,0,0,0|2,0,0]=4 3949 B11R1.230 Cc1cn(CCCO)c(C)n1 Amb28188136 [0,2,0,0,0,0|2,0,0]=4 3950 B11R1.230 Cc1nc(C)c(CCC#N)s1 Amb18560816 [0,2,0,0,0,0|1,0,0]=3 3951 B11R1.230 Cc1nc(C)c(CCCBr)s1 Amb32689517 [0,2,0,0,0,0|1,0,0]=3 3952 B11R1.230 Cc1nc(C)c(CCCCl)s1 Amb32689516 [0,2,0,0,0,0|1,0,0]=3 3953 B11R1.230 Cc1nc(C)c(CCCN)s1 Amb18908830 [0,2,0,0,0,0|1,0,0]=3 3954 B11R1.230 Cc1nc(C)c(CCCO)s1 Amb28140900 [0,2,0,0,0,0|0,0,0]=2 3955 B11R1.230 Cc1nc(C)c(\C=C\CBr)s1 Amb27401346 [0,2,0,0,0,0|1,0,1]=4 3956 B11R1.230 Cc1nc(C)c(\C=C\CN)s1 Amb27220451 [0,2,0,0,0,0|1,0,1]=4 3957 B11R1.230 Cc1nc(C)n(CCCO)n1 Amb16186551 [0,2,0,0,0,0|2,0,0]=4 3958 B11R1.230 Cc1nc(CCCO)c(C)s1 Amb33213198 [0,2,0,0,0,0|2,0,0]=4 3959 B11R1.230 Cc1nc(CCCO)n(C)n1 Amb32945679 [0,2,0,0,0,0|2,0,0]=4 3960 B11R1.230 Cc1nc(N)sc1SCC#N Amb6275994 [0,2,0,0,0,0|1,0,1]=4 3961 B11R1.230 Cc1nc(N)sc1SCCF Amb28072444 [0,2,0,0,0,0|1,0,0]=3 3962 B11R1.230 Cc1nc(N)sc1SCCO Amb6702417 [0,2,0,0,0,0|0,0,0]=2 3963 B11R1.230 Cc1nn(C)cc1CCCO Amb24509884 [0,2,0,0,0,0|2,0,0]=4 3964 B11R1.230 Cc1nn(C)cc1CCON Amb33270431 [0,2,0,0,0,0|2,0,0]=4 3965 B11R1.230 Cn1nc(Br)cc1CCCO Amb33431265 [0,2,0,0,0,0|2,0,0]=4 3966 B11R1.230 Cn1nc(Br)cc1CCON Amb33436166 [0,2,0,0,0,0|2,0,0]=4 3967 B11R1.465 COCCc1c(Br)cnn1C Amb33298732 [0,2,0,0,0,0|2,0,0]=4 3968 B11R1.465 COCCc1c(C)noc1N Amb26880153 [0,2,0,0,0,0|2,0,0]=4 3969 B11R1.465 COCCc1c(I)cnn1C Amb33298762 [0,2,0,0,0,0|2,0,0]=4 3970 B11R1.465 COCCc1c(N)cnn1C Amb33377012 [0,2,0,0,0,0|2,0,0]=4 3971 B11R1.465 Cc1cnc(C)n1CCCO Amb27752371 [0,2,0,0,0,0|2,0,0]=4 3972 B11R1.465 Cc1cnn(C)c1CCCO Amb25721414 [0,2,0,0,0,0|2,0,0]=4 3973 B11R1.465 Cc1cnn(C)c1CCON Amb33414272 [0,2,0,0,0,0|2,0,0]=4 3974 B11R1.465 Cc1noc(C)c1CCCO Amb25100855 [0,2,0,0,0,0|2,0,0]=4 3975 B11R1.465 Cc1noc(C)c1CCON Amb33226012 [0,2,0,0,0,0|2,0,0]=4 3976 B11R1.465 Cn1cnc(Cl)c1CCCO Amb33222476 [0,2,0,0,0,0|2,0,0]=4 3977 B11R1.465 Cn1cnc(Cl)c1CCON Amb33057199 [0,2,0,0,0,0|2,0,0]=4 3978 B11R1.465 Cn1ncc(Br)c1CCCO Amb25691070 [0,2,0,0,0,0|2,0,0]=4 3979 B11R1.89 C=C(C(=O)O)c1scnc1C Amb32875935 [0,2,0,0,0,0|0,0,2]=4 3980 B11R1.89 CC(C)C(O)c1scnc1Br Amb28144392 [0,2,0,0,0,0|2,0,0]=4 3981 B11R1.89 CC(O)C(C)c1ccnn1C Amb26977162 [0,2,0,0,0,0|2,0,0]=4 3982 B11R1.89 CC(O)C(C)c1ncnn1C Amb27175248 [0,2,0,0,0,0|2,0,0]=4 3983 B11R1.89 CC(O)C(C)c1sccc1Br Amb27807370 [0,2,0,0,0,0|2,0,0]=4 3984 B11R1.89 CC(O)C(C)c1sccc1Cl Amb25304609 [0,2,0,0,0,0|2,0,0]=4 3985 B11R1.89 CC(O)C(C)c1scnc1Br Amb33213200 [0,2,0,0,0,0|1,0,0]=3 3986 B11R1.89 CC(O)C(N)c1ccnn1C Amb35740839 [0,2,0,0,0,0|2,0,0]=4 3987 B11R1.89 CC(O)C(N)c1ncnn1C Amb18287020 [0,2,0,0,0,0|2,0,0]=4 3988 B11R1.89 CC(O)C(N)c1sccc1Br Amb27813306 [0,2,0,0,0,0|2,0,0]=4 3989 B11R1.89 CC(O)[C@@H](N)c1sccc1Cl Amb27762614 [0,2,0,0,0,0|2,0,0]=4 3990 B11R1.89 CC(O)[C@H](N)c1sccc1Br Amb28341179 [0,2,0,0,0,0|2,0,0]=4 3991 B11R1.89 C[C@@H](O)[C@@H](N)c1sccc1Br Amb27655033 [0,2,0,0,0,0|2,0,0]=4 3992 B11R1.89 C[C@@H](O)[C@H](N)c1sccc1I Amb27796249 [0,2,0,0,0,0|2,0,0]=4 3993 B11R1.89 Cc1ccsc1C(C)C(=O)O Amb24626981 [0,2,0,0,0,0|1,0,1]=4 3994 B11R1.89 Cc1ccsc1C(C)C(C)Br Amb27594255 [0,2,0,0,0,0|2,0,0]=4 3995 B11R1.89 Cc1ccsc1C(C)C(C)O Amb24603727 [0,2,0,0,0,0|1,0,0]=3 3996 B11R1.89 Cc1ccsc1C(F)C(=O)O Amb25345878 [0,2,0,0,0,0|1,0,1]=4 3997 B11R1.89 Cc1ccsc1C(N)C(=O)O Amb3941903 [0,2,0,0,0,0|1,0,1]=4 3998 B11R1.89 Cc1ccsc1C(N)C(C)C Amb18957016 [0,2,0,0,0,0|2,0,0]=4 3999 B11R1.89 Cc1ccsc1C(N)C(C)C Amb35745638 [0,2,0,0,0,0|2,0,0]=4 4000 B11R1.89 Cc1ccsc1C(N)C(C)N Amb27195783 [0,2,0,0,0,0|2,0,0]=4 4001 B11R1.89 Cc1ccsc1C(N)C(F)F Amb24488063 [0,2,0,0,0,0|2,0,0]=4 4002 B11R1.89 Cc1ccsc1C(O)C(=O)O Amb18953608 [0,2,0,0,0,0|1,0,1]=4 4003 B11R1.89 Cc1ccsc1C(O)C(C)O Amb28042017 [0,2,0,0,0,0|1,0,0]=3 4004 B11R1.89 Cc1ccsc1C(O)C(F)F Amb27448592 [0,2,0,0,0,0|2,0,0]=4 4005 B11R1.89 Cc1ccsc1C(O)[C@@H](C)N Amb35624095 [0,2,0,0,0,0|2,0,0]=4 4006 B11R1.89 Cc1ccsc1C(O)[C@H](C)N Amb35737935 [0,2,0,0,0,0|2,0,0]=4 4007 B11R1.89 Cc1ccsc1[C@@H](N)C(C)C Amb27950661 [0,2,0,0,0,0|2,0,0]=4 4008 B11R1.89 Cc1ccsc1[C@@H](N)C(C)O Amb27395777 [0,2,0,0,0,0|1,0,0]=3 4009 B11R1.89 Cc1ccsc1[C@H](N)C(C)C Amb27258638 [0,2,0,0,0,0|2,0,0]=4 4010 B11R1.89 Cc1ccsc1[C@H](N)C(F)F Amb27630372 [0,2,0,0,0,0|2,0,0]=4 4011 B11R1.89 Cc1ccsc1[C@H](N)[C@H](C)N Amb27204855 [0,2,0,0,0,0|2,0,0]=4 4012 B11R1.89 Cc1ncsc1C(=O)C(=O)O Amb18198676 [0,2,0,0,0,0|0,0,2]=4 4013 B11R1.89 Cc1ncsc1C(=O)C(C)N Amb18198872 [0,2,0,0,0,0|1,0,1]=4 4014 B11R1.89 Cc1ncsc1C(=O)C(C)O Amb35613077 [0,2,0,0,0,0|0,0,1]=3 4015 B11R1.89 Cc1ncsc1C(=O)C(F)F Amb33411784 [0,2,0,0,0,0|1,0,1]=4 4016 B11R1.89 Cc1ncsc1C(=O)[C@@H](C)N Amb33131727 [0,2,0,0,0,0|1,0,1]=4 4017 B11R1.89 Cc1ncsc1C(=O)[C@H](C)N Amb30024441 [0,2,0,0,0,0|1,0,1]=4 4018 B11R1.89 Cc1ncsc1C(C)C(=O)O Amb32713476 [0,2,0,0,0,0|0,0,1]=3 4019 B11R1.89 Cc1ncsc1C(C)C(C)Br Amb35632681 [0,2,0,0,0,0|1,0,0]=3 4020 B11R1.89 Cc1ncsc1C(C)C(C)Cl Amb35632680 [0,2,0,0,0,0|1,0,0]=3 4021 B11R1.89 Cc1ncsc1C(C)C(C)N Amb35608565 [0,2,0,0,0,0|1,0,0]=3 4022 B11R1.89 Cc1ncsc1C(C)C(C)O Amb33213079 [0,2,0,0,0,0|0,0,0]=2 4023 B11R1.89 Cc1ncsc1C(Cl)C(C)C Amb35635993 [0,2,0,0,0,0|1,0,0]=3 4024 B11R1.89 Cc1ncsc1C(F)C(=O)O Amb32713477 [0,2,0,0,0,0|0,0,1]=3 4025 B11R1.89 Cc1ncsc1C(N)C(=O)O Amb18198322 [0,2,0,0,0,0|0,0,1]=3 4026 B11R1.89 Cc1ncsc1C(N)C(F)F Amb33409890 [0,2,0,0,0,0|1,0,0]=3 4027 B11R1.89 Cc1ncsc1C(O)C(=O)O Amb18825306 [0,2,0,0,0,0|0,0,1]=3 4028 B11R1.89 Cc1ncsc1C(O)C(C)N Amb18198183 [0,2,0,0,0,0|1,0,0]=3 4029 B11R1.89 Cc1ncsc1C(O)C(C)O Amb35612915 [0,2,0,0,0,0|0,0,0]=2 4030 B11R1.89 Cc1ncsc1C(O)C(F)F Amb33409902 [0,2,0,0,0,0|1,0,0]=3 4031 B11R1.89 Cc1ncsc1C(O)[C@@H](C)N Amb30024417 [0,2,0,0,0,0|1,0,0]=3 4032 B11R1.89 Cc1ncsc1C(O)[C@H](C)N Amb35738114 [0,2,0,0,0,0|1,0,0]=3 4033 B11R1.89 Cc1nnsc1C(N)C(=O)O Amb27781742 [0,2,0,0,0,0|1,0,1]=4 4034 B11R1.89 Cc1nnsc1C(O)C(C)N Amb28137042 [0,2,0,0,0,0|2,0,0]=4 4035 B11R1.89 Cc1sccc1C(C)C(C)O Amb27834402 [0,2,0,0,0,0|2,0,0]=4 4036 B11R1.105 CC(C)(O)Cc1sccc1Br Amb26502697 [0,2,0,0,0,0|2,0,0]=4 4037 B11R1.105 CC(C)(O)Cc1sccc1Cl Amb24435187 [0,2,0,0,0,0|2,0,0]=4 4038 B11R1.105 Cc1ccoc1CC(C)(C)O Amb33343934 [0,2,0,0,0,0|1,1,0]=4 4039 B11R1.105 Cc1ccsc1CC(C)(C)N Amb33197583 [0,2,0,0,0,0|2,0,0]=4 4040 B11R1.105 Cc1ccsc1CC(C)(C)O Amb26893170 [0,2,0,0,0,0|1,0,0]=3 4041 B11R1.105 Cc1nccn1CC(C)(C)O Amb18791576 [0,2,0,0,0,0|2,0,0]=4 4042 B11R1.105 Cc1ncsc1CC(C)(C)N Amb32876358 [0,2,0,0,0,0|1,0,0]=3 4043 B11R1.105 Cc1ncsc1CC(C)(C)O Amb32876819 [0,2,0,0,0,0|0,0,0]=2 4044 B11R1.105 Cc1ncsc1CS(=O)(=O)Cl Amb25762571 [0,2,0,0,0,0|1,0,1]=4 4045 B11R1.105 Cc1ncsc1CS(=O)(=O)F Amb33484959 [0,2,0,0,0,0|1,0,1]=4 4046 B11R1.105 Cc1ncsc1CS(C)(=O)=O Amb28124300 [0,2,0,0,0,0|1,0,1]=4 4047 B11R1.105 Cc1ncsc1CS(N)(=O)=O Amb25722708 [0,2,0,0,0,0|1,0,1]=4 4048 B11R1.105 Cc1ncsc1NS(=O)(=O)O Amb28255853 [0,2,0,0,0,0|2,0,0]=4 4049 B11R1.105 Cc1nnsc1CC(C)(C)N Amb28322251 [0,2,0,0,0,0|2,0,0]=4 4050 B11R1.105 Cc1occc1CC(C)(C)O Amb33275142 [0,2,0,0,0,0|2,0,0]=4 4051 B11R1.105 Cn1nccc1CC(C)(C)O Amb33324294 [0,2,0,0,0,0|2,0,0]=4 4052 B11R1.313 Cc1csc(CC(C)O)c1Br Amb33433891 [0,2,0,0,0,0|2,0,0]=4 4053 B11R1.313 Cc1csc(C[C@@H](C)O)c1Br Amb33434240 [0,2,0,0,0,0|2,0,0]=4 4054 B11R1.313 Cc1csc(C[C@H](C)O)c1Br Amb33434238 [0,2,0,0,0,0|2,0,0]=4 4055 B11R1.495 CC(O)Cc1c(Cl)ncn1C Amb33057126 [0,2,0,0,0,0|2,0,0]=4 4056 B11R1.495 C[C@@H](O)Cc1c(Cl)ncn1C Amb33057498 [0,2,0,0,0,0|2,0,0]=4 4057 B11R1.495 C[C@H](O)Cc1c(Cl)ncn1C Amb33057491 [0,2,0,0,0,0|2,0,0]=4 4058 B11R1.495 Cc1cnn(C)c1CC(C)O Amb33414662 [0,2,0,0,0,0|2,0,0]=4 4059 B11R1.495 Cc1cnn(C)c1C[C@@H](C)O Amb33414263 [0,2,0,0,0,0|2,0,0]=4 4060 B11R1.495 Cc1cnn(C)c1C[C@H](C)O Amb33414265 [0,2,0,0,0,0|2,0,0]=4 4061 B11R1.495 Cc1ncc(N)n1CC(C)O Amb28132818 [0,2,0,0,0,0|2,0,0]=4 4062 B11R1.495 Cc1ncn(C)c1CC(=O)O Amb18562849 [0,2,0,0,0,0|1,0,1]=4 4063 B11R1.495 Cc1noc(C)c1CC(C)O Amb33418336 [0,2,0,0,0,0|2,0,0]=4 4064 B11R1.495 Cc1noc(C)c1C[C@@H](C)O Amb33326324 [0,2,0,0,0,0|2,0,0]=4 4065 B11R1.495 Cc1noc(C)c1C[C@H](C)O Amb33326325 [0,2,0,0,0,0|2,0,0]=4 4066 B11R1.645 CC(=O)Cc1sc(Br)nc1C Amb18159490 [0,2,0,0,0,0|0,0,2]=4 4067 B11R1.645 CC(=O)Cc1sc(C)nc1C Amb18062039 [0,2,0,0,0,0|0,0,2]=4 4068 B11R1.645 CC(O)Cc1cc(Br)nn1C Amb33436038 [0,2,0,0,0,0|2,0,0]=4 4069 B11R1.645 CC1=C(CC(=O)O)SC(=O)N1 Amb18041895 [0,2,0,0,0,0|0,0,2]=4 4070 B11R1.645 CC1=C(CC(=O)O)SC(=S)N1 Amb18949300 [0,2,0,0,0,0|0,0,2]=4 4071 B11R1.645 C[C@@H](O)Cc1cc(Br)nn1C Amb33436176 [0,2,0,0,0,0|2,0,0]=4 4072 B11R1.645 C[C@H](O)Cc1cc(Br)nn1C Amb33436175 [0,2,0,0,0,0|2,0,0]=4 4073 B11R1.645 Cc1cc(Br)c(CC(C)O)s1 Amb33430869 [0,2,0,0,0,0|2,0,0]=4 4074 B11R1.645 Cc1cc(Br)c(C[C@@H](C)O)s1 Amb33431379 [0,2,0,0,0,0|2,0,0]=4 4075 B11R1.645 Cc1cc(Br)c(C[C@H](C)O)s1 Amb33431384 [0,2,0,0,0,0|2,0,0]=4 4076 B11R1.645 Cc1cc(Br)oc1CC(C)O Amb33450697 [0,2,0,0,0,0|1,1,0]=4 4077 B11R1.645 Cc1cc(Br)oc1C[C@@H](C)O Amb33450780 [0,2,0,0,0,0|1,1,0]=4 4078 B11R1.645 Cc1cc(Br)oc1C[C@H](C)O Amb33450777 [0,2,0,0,0,0|1,1,0]=4 4079 B11R1.645 Cc1cc(Br)sc1CC(=O)O Amb22009221 [0,2,0,0,0,0|1,0,1]=4 4080 B11R1.645 Cc1cc(C)c(CC(=O)O)s1 Amb26848561 [0,2,0,0,0,0|1,0,1]=4 4081 B11R1.645 Cc1cc(C)c(CC(C)N)s1 Amb28072991 [0,2,0,0,0,0|2,0,0]=4 4082 B11R1.645 Cc1cc(CC(C)O)c(C)o1 Amb33344676 [0,2,0,0,0,0|2,0,0]=4 4083 B11R1.645 Cc1cc(CC(C)O)c(C)s1 Amb33266355 [0,2,0,0,0,0|2,0,0]=4 4084 B11R1.645 Cc1cc(C[C@@H](C)O)c(C)o1 Amb33344057 [0,2,0,0,0,0|2,0,0]=4 4085 B11R1.645 Cc1cc(C[C@@H](C)O)c(C)s1 Amb33472652 [0,2,0,0,0,0|2,0,0]=4 4086 B11R1.645 Cc1cc(C[C@@H](C)O)n(C)n1 Amb33318785 [0,2,0,0,0,0|2,0,0]=4 4087 B11R1.645 Cc1cc(C[C@H](C)O)c(C)o1 Amb33344058 [0,2,0,0,0,0|2,0,0]=4 4088 B11R1.645 Cc1cc(C[C@H](C)O)c(C)s1 Amb33472653 [0,2,0,0,0,0|2,0,0]=4 4089 B11R1.645 Cc1cc(C[C@H](C)O)n(C)n1 Amb33318786 [0,2,0,0,0,0|2,0,0]=4 4090 B11R1.645 Cc1cc(N)sc1CC(=O)O Amb18198589 [0,2,0,0,0,0|1,0,1]=4 4091 B11R1.645 Cc1nc(Br)oc1CC(C)C Amb27664454 [0,2,0,0,0,0|1,1,0]=4 4092 B11R1.645 Cc1nc(Br)sc1CC(=O)O Amb17409135 [0,2,0,0,0,0|0,0,1]=3 4093 B11R1.645 Cc1nc(C)c(CC(=O)O)o1 Amb17399990 [0,2,0,0,0,0|0,1,1]=4 4094 B11R1.645 Cc1nc(C)c(CC(=O)O)s1 Amb2610770 [0,2,0,0,0,0|0,0,1]=3 4095 B11R1.645 Cc1nc(C)c(CC(=O)O)s1 Amb32680327 [0,2,0,0,0,0|0,0,1]=3 4096 B11R1.645 Cc1nc(C)c(CC(C)N)s1 Amb18825500 [0,2,0,0,0,0|1,0,0]=3 4097 B11R1.645 Cc1nc(C)c(CC(N)=O)s1 Amb2610769 [0,2,0,0,0,0|0,0,2]=4 4098 B11R1.645 Cc1nc(C)c(CN(C)C)s1 Amb33616910 [0,2,0,0,0,0|2,0,0]=4 4099 B11R1.645 Cc1nc(Cl)c(CC(=O)O)s1 Amb18816866 [0,2,0,0,0,0|1,0,1]=4 4100 B11R1.645 Cc1nc(N)oc1CC(C)C Amb27207186 [0,2,0,0,0,0|1,1,0]=4 4101 B11R1.645 Cc1nc(N)sc1CC(=O)O Amb8082053 [0,2,0,0,0,0|0,0,1]=3 4102 B11R1.645 Cc1nc(N)sc1CC(C)C Amb26490843 [0,2,0,0,0,0|1,0,0]=3 4103 B11R1.645 Cc1nc(N)sc1CC(C)C Amb32662892 [0,2,0,0,0,0|1,0,0]=3 4104 B11R1.645 Cc1nc(N)sc1CC(N)=O Amb24571204 [0,2,0,0,0,0|0,0,2]=4 4105 B11R1.645 Cc1nc(O)c(CC(=O)O)s1 Amb25854264 [0,2,0,0,0,0|1,0,1]=4 4106 B11R1.645 Cc1nc(O)sc1CC(C)Cl Amb27955870 [0,2,0,0,0,0|1,0,0]=3 4107 B11R1.645 Cc1nc(S)oc1CC(C)C Amb27246921 [0,2,0,0,0,0|1,1,0]=4 4108 B11R1.645 Cc1nc(S)sc1CC(=O)O Amb2371537 [0,2,0,0,0,0|0,0,1]=3 4109 B11R1.645 Cc1nc(S)sc1CC(C)N Amb27654160 [0,2,0,0,0,0|1,0,0]=3 4110 B11R1.645 Cc1nc(S)sc1CC(N)=O Amb483258 [0,2,0,0,0,0|0,0,2]=4 4111 B11R1.645 Cc1nn(C)cc1CC(C)O Amb33270477 [0,2,0,0,0,0|2,0,0]=4 4112 B11R1.645 Cc1nn(C)cc1C[C@@H](C)O Amb33225254 [0,2,0,0,0,0|2,0,0]=4 4113 B11R1.645 Cc1nn(C)cc1C[C@H](C)O Amb33270177 [0,2,0,0,0,0|2,0,0]=4 4114 B11R1.645 O=C(O)Cc1sc(O)nc1O Amb4035843 [0,2,0,0,0,0|1,0,1]=4 4115 B11R1.125 CC[n+]1csc(CCO)c1C Amb8385346 [0,2,0,0,0,0|0,0,1]=3 4116 B11R1.125 Cc1c(CO)csc1CCO Amb27204454 [0,2,0,0,0,0|1,0,0]=3 4117 B11R1.186 CCCc1sc(Cl)c(N)c1C Amb27447614 [0,2,0,0,0,0|2,0,0]=4 4118 B11R1.186 Cc1cc(CCO)c(C)n1C Amb18243533 [0,2,0,0,0,0|1,0,1]=4 4119 B11R1.598 Cc1nc(C)n(C)c1CCN Amb18200947 [0,2,0,0,0,0|2,0,0]=4 4120 B11R1.598 Cc1nc(O)n(C)c1CCN Amb18830876 [0,2,0,0,0,0|2,0,0]=4 4121 B11R1.598 Cc1nc(S)n(C)c1CCN Amb18198451 [0,2,0,0,0,0|2,0,0]=4 4122 B11R1.598 Cc1nn(C)c(C)c1CCO Amb7089005 [0,2,0,0,0,0|2,0,0]=4 4123 B11R1.598 Cc1nn(C)c(CCO)c1Cl Amb27197307 [0,2,0,0,0,0|2,0,0]=4 4124 B11R1.598 Cc1nn(C)c(Cl)c1CCO Amb26634843 [0,2,0,0,0,0|2,0,0]=4 4125 B11R1.598 Cc1nn(C)c(O)c1CCO Amb13881347 [0,2,0,0,0,0|2,0,0]=4 4126 B11R1.598 Cc1sc(C)c(CCO)c1Br Amb33213696 [0,2,0,0,0,0|2,0,0]=4 4127 B11R1.598 Cn1nc(N)c(N)c1CCO Amb28143045 [0,2,0,0,0,0|2,0,0]=4 4128 B11R1.865 CC[C@H](N)c1scc(Br)c1C Amb27794253 [0,2,0,0,0,0|2,0,0]=4 4129 B11R1.865 Cc1c(Br)csc1[C@H](N)CO Amb27794567 [0,2,0,0,0,0|1,0,0]=3 4130 B11R1.865 Cc1csc(C(N)CO)c1Br Amb33433488 [0,2,0,0,0,0|2,0,0]=4 4131 B11R1.865 Cc1csc(C(N)CO)c1Cl Amb25679664 [0,2,0,0,0,0|2,0,0]=4 4132 B11R1.865 Cc1csc(C(O)CO)c1Br Amb33434246 [0,2,0,0,0,0|2,0,0]=4 4133 B11R1.865 Cc1csc([C@@H](N)CO)c1Br Amb33433924 [0,2,0,0,0,0|2,0,0]=4 4134 B11R1.865 Cc1csc([C@@H](N)CO)c1Cl Amb25679665 [0,2,0,0,0,0|2,0,0]=4 4135 B11R1.865 Cc1csc([C@H](N)CO)c1Br Amb33433920 [0,2,0,0,0,0|2,0,0]=4 4136 B11R1.865 Cc1csc([C@H](N)CO)c1Cl Amb26509248 [0,2,0,0,0,0|2,0,0]=4 4137 B11R1.185 CCCc1sc(C=O)nc1C Amb27442783 [0,2,0,0,0,0|1,0,0]=3 4138 B11R1.185 CCCc1sc(CC)nc1C Amb27613381 [0,2,0,0,0,0|1,0,0]=3 4139 B11R1.185 CCCc1sc(CCl)nc1C Amb27444412 [0,2,0,0,0,0|1,0,0]=3 4140 B11R1.185 CCCc1sc(NN)nc1C Amb27613399 [0,2,0,0,0,0|1,0,0]=3 4141 B11R1.185 CCc1nc(C)c(CCN)o1 Amb18200692 [0,2,0,0,0,0|1,1,0]=4 4142 B11R1.185 CCc1nc(CCO)c(C)o1 Amb5732358 [0,2,0,0,0,0|2,0,0]=4 4143 B11R1.185 CCn1cc(CCO)c(C)n1 Amb24509231 [0,2,0,0,0,0|2,0,0]=4 4144 B11R1.185 CNCc1sc(CO)nc1C Amb28322392 [0,2,0,0,0,0|2,0,0]=4 4145 B11R1.185 CNCc1sc(OC)nc1C Amb2592180 [0,2,0,0,0,0|2,0,0]=4 4146 B11R1.185 CNc1nc(C)c(CCN)s1 Amb17400359 [0,2,0,0,0,0|1,0,0]=3 4147 B11R1.185 COCc1sc(C=O)nc1C Amb18177975 [0,2,0,0,0,0|2,0,0]=4 4148 B11R1.185 COCc1sc(NN)nc1C Amb18807875 [0,2,0,0,0,0|2,0,0]=4 4149 B11R1.185 COc1nc(C)c(CCN)s1 Amb2592210 [0,2,0,0,0,0|1,0,0]=3 4150 B11R1.185 COc1nc(C)c(CNN)s1 Amb19664575 [0,2,0,0,0,0|2,0,0]=4 4151 B11R1.185 COc1nc(Cl)c(CCBr)s1 Amb33431749 [0,2,0,0,0,0|2,0,0]=4 4152 B11R1.185 CSc1nc(CCO)c(C)s1 Amb28207225 [0,2,0,0,0,0|2,0,0]=4 4153 B11R1.185 Cc1nc(C#N)sc1CCCl Amb25891483 [0,2,0,0,0,0|1,0,0]=3 4154 B11R1.185 Cc1nc(CO)sc1CCCl Amb27164060 [0,2,0,0,0,0|1,0,0]=3 4155 B11R1.185 Cc1nc(CO)sc1CCN Amb28323858 [0,2,0,0,0,0|1,0,0]=3 4156 B11R1.185 Cc1nc(CO)sc1CCO Amb28348393 [0,2,0,0,0,0|0,0,0]=2 4157 B11R1.185 Cc1oc(CCl)nc1CCO Amb27823123 [0,2,0,0,0,0|2,0,0]=4 4158 B11R1.225 C#CC(O)c1sc(C)nc1C Amb27401350 [0,2,0,0,0,0|1,0,1]=4 4159 B11R1.225 CC1=C(C(N)CO)NC(=O)N1 Amb18200007 [0,2,0,0,0,0|1,0,1]=4 4160 B11R1.225 CCC(=O)c1sc(N)nc1C Amb18126712 [0,2,0,0,0,0|1,0,1]=4 4161 B11R1.225 CCC(N)c1sc(C)cc1C Amb28364199 [0,2,0,0,0,0|2,0,0]=4 4162 B11R1.225 CCC(O)c1oc(N)nc1C Amb18125979 [0,2,0,0,0,0|1,1,0]=4 4163 B11R1.225 CC[C@H](O)c1sc(C)cc1C Amb28388468 [0,2,0,0,0,0|2,0,0]=4 4164 B11R1.225 CNC(C)c1sc(C)nc1C Amb18951718 [0,2,0,0,0,0|2,0,0]=4 4165 B11R1.225 C\C(=N/O)c1sc(C)nc1C Amb5794283 [0,2,0,0,0,0|1,0,1]=4 4166 B11R1.225 C\C(=N/O)c1sc(N)nc1C Amb25217413 [0,2,0,0,0,0|1,0,1]=4 4167 B11R1.225 Cc1cc(Br)c(C(N)CO)s1 Amb33431106 [0,2,0,0,0,0|2,0,0]=4 4168 B11R1.225 Cc1cc(Br)c(C(O)CO)s1 Amb33435339 [0,2,0,0,0,0|2,0,0]=4 4169 B11R1.225 Cc1cc(Br)c([C@@H](N)CO)s1 Amb33431111 [0,2,0,0,0,0|2,0,0]=4 4170 B11R1.225 Cc1cc(Br)c([C@H](N)CO)s1 Amb33431110 [0,2,0,0,0,0|2,0,0]=4 4171 B11R1.225 Cc1cc(Br)oc1C(N)CO Amb33451858 [0,2,0,0,0,0|1,1,0]=4 4172 B11R1.225 Cc1cc(Br)oc1C(O)CO Amb33450864 [0,2,0,0,0,0|1,1,0]=4 4173 B11R1.225 Cc1cc(Br)oc1[C@@H](N)CO Amb33450813 [0,2,0,0,0,0|1,1,0]=4 4174 B11R1.225 Cc1cc(Br)oc1[C@H](N)CO Amb33450812 [0,2,0,0,0,0|1,1,0]=4 4175 B11R1.225 Cc1cc(C(N)CO)c(C)o1 Amb28340928 [0,2,0,0,0,0|2,0,0]=4 4176 B11R1.225 Cc1cc(C(N)CO)c(C)s1 Amb18282865 [0,2,0,0,0,0|2,0,0]=4 4177 B11R1.225 Cc1cc(C(N)CO)n(C)n1 Amb33319580 [0,2,0,0,0,0|2,0,0]=4 4178 B11R1.225 Cc1cc(C(O)CO)c(C)o1 Amb33344049 [0,2,0,0,0,0|2,0,0]=4 4179 B11R1.225 Cc1cc(C(O)CO)c(C)s1 Amb25704729 [0,2,0,0,0,0|2,0,0]=4 4180 B11R1.225 Cc1cc(C(O)CO)n(C)n1 Amb33456768 [0,2,0,0,0,0|2,0,0]=4 4181 B11R1.225 Cc1cc(C)c(C(N)CO)o1 Amb27632986 [0,2,0,0,0,0|1,1,0]=4 4182 B11R1.225 Cc1cc([C@@H](N)CO)c(C)o1 Amb24401015 [0,2,0,0,0,0|2,0,0]=4 4183 B11R1.225 Cc1cc([C@@H](N)CO)c(C)s1 Amb25823694 [0,2,0,0,0,0|2,0,0]=4 4184 B11R1.225 Cc1cc([C@@H](N)CO)n(C)n1 Amb33318804 [0,2,0,0,0,0|2,0,0]=4 4185 B11R1.225 Cc1cc([C@H](N)CO)c(C)o1 Amb25340435 [0,2,0,0,0,0|2,0,0]=4 4186 B11R1.225 Cc1cc([C@H](N)CO)c(C)s1 Amb25877485 [0,2,0,0,0,0|2,0,0]=4 4187 B11R1.225 Cc1cc([C@H](N)CO)n(C)n1 Amb33318805 [0,2,0,0,0,0|2,0,0]=4 4188 B11R1.225 Cc1nc(C(N)CO)n(C)n1 Amb18963530 [0,2,0,0,0,0|2,0,0]=4 4189 B11R1.225 Cc1nc(C)c(C(=O)CBr)s1 Amb22546305 [0,2,0,0,0,0|1,0,1]=4 4190 B11R1.225 Cc1nc(C)c(C(=O)CBr)s1 Amb28239430 [0,2,0,0,0,0|1,0,1]=4 4191 B11R1.225 Cc1nc(C)c(C(=O)CN)s1 Amb18198882 [0,2,0,0,0,0|1,0,1]=4 4192 B11R1.225 Cc1nc(C)c(C(=O)CO)s1 Amb24486270 [0,2,0,0,0,0|0,0,1]=3 4193 B11R1.225 Cc1nc(C)c(C(Br)C#N)s1 Amb28384186 [0,2,0,0,0,0|1,0,1]=4 4194 B11R1.225 Cc1nc(C)c(C(N)CO)o1 Amb18830781 [0,2,0,0,0,0|0,1,0]=3 4195 B11R1.225 Cc1nc(C)c(C(O)C#N)s1 Amb27483575 [0,2,0,0,0,0|1,0,1]=4 4196 B11R1.225 Cc1nc(C)c(C(O)CN)s1 Amb18825332 [0,2,0,0,0,0|1,0,0]=3 4197 B11R1.225 Cc1nc(C)c(\C(N)=N\O)s1 Amb27785707 [0,2,0,0,0,0|1,0,1]=4 4198 B11R1.225 Cc1nc(C)n(C(C)CO)n1 Amb10608111 [0,2,0,0,0,0|2,0,0]=4 4199 B11R1.225 Cc1nc(N)sc1C(=O)CBr Amb21961235 [0,2,0,0,0,0|1,0,1]=4 4200 B11R1.225 Cc1nn(C)cc1C(O)CO Amb27153522 [0,2,0,0,0,0|2,0,0]=4 4201 B11R1.225 Cc1nn(C)cc1[C@@H](N)CO Amb33270437 [0,2,0,0,0,0|2,0,0]=4 4202 B11R1.225 Cc1nn(C)cc1[C@H](N)CO Amb33270438 [0,2,0,0,0,0|2,0,0]=4 4203 B11R1.225 Cn1nc(Br)cc1C(N)CO Amb33337305 [0,2,0,0,0,0|2,0,0]=4 4204 B11R1.225 Cn1nc(Br)cc1C(O)CO Amb33430342 [0,2,0,0,0,0|2,0,0]=4 4205 B11R1.225 Cn1nc(Br)cc1[C@@H](N)CO Amb33333841 [0,2,0,0,0,0|2,0,0]=4 4206 B11R1.225 Cn1nc(Br)cc1[C@H](N)CO Amb33333842 [0,2,0,0,0,0|2,0,0]=4 4207 B11R1.137 C#CC(C)(C)c1scnc1C Amb32875940 [0,2,0,0,0,0|1,0,1]=4 4208 B11R1.137 CC(C)(CO)c1sccc1Br Amb33450859 [0,2,0,0,0,0|2,0,0]=4 4209 B11R1.137 CC(C)(CO)c1sccc1Cl Amb33257488 [0,2,0,0,0,0|2,0,0]=4 4210 B11R1.137 CC(N)(CO)c1sccc1Br Amb25826486 [0,2,0,0,0,0|2,0,0]=4 4211 B11R1.137 CC(N)(CO)c1sccc1Cl Amb24714705 [0,2,0,0,0,0|2,0,0]=4 4212 B11R1.137 CCC(C)(N)c1scnc1C Amb35636272 [0,2,0,0,0,0|1,0,0]=3 4213 B11R1.137 CCC(C)(O)c1sccc1C Amb26856714 [0,2,0,0,0,0|2,0,0]=4 4214 B11R1.137 CCC(C)(O)c1scnc1C Amb35632372 [0,2,0,0,0,0|1,0,0]=3 4215 B11R1.137 CNC(C)(C)c1scnc1C Amb33271238 [0,2,0,0,0,0|2,0,0]=4 4216 B11R1.137 C[C@@](N)(CO)c1sccc1Cl Amb27453622 [0,2,0,0,0,0|2,0,0]=4 4217 B11R1.137 Cc1ccoc1C(C)(C)CO Amb33343939 [0,2,0,0,0,0|1,1,0]=4 4218 B11R1.137 Cc1ccoc1C(C)(N)CO Amb33343162 [0,2,0,0,0,0|1,1,0]=4 4219 B11R1.137 Cc1ccoc1C(F)(F)CO Amb33404822 [0,2,0,0,0,0|1,1,0]=4 4220 B11R1.137 Cc1ccsc1C(C)(C)CBr Amb33335032 [0,2,0,0,0,0|2,0,0]=4 4221 B11R1.137 Cc1ccsc1C(C)(C)CN Amb26372300 [0,2,0,0,0,0|2,0,0]=4 4222 B11R1.137 Cc1ccsc1C(C)(C)CO Amb33203321 [0,2,0,0,0,0|1,0,0]=3 4223 B11R1.137 Cc1ccsc1C(C)(F)CN Amb27242297 [0,2,0,0,0,0|2,0,0]=4 4224 B11R1.137 Cc1ccsc1C(C)(N)CO Amb24351106 [0,2,0,0,0,0|1,0,0]=3 4225 B11R1.137 Cc1ccsc1C(C)(O)CN Amb24380480 [0,2,0,0,0,0|2,0,0]=4 4226 B11R1.137 Cc1ccsc1C(F)(F)CN Amb25304632 [0,2,0,0,0,0|2,0,0]=4 4227 B11R1.137 Cc1ccsc1C(F)(F)CO Amb33010445 [0,2,0,0,0,0|1,0,0]=3 4228 B11R1.137 Cc1ccsc1[C@](C)(N)CO Amb27761817 [0,2,0,0,0,0|1,0,0]=3 4229 B11R1.137 Cc1ncsc1C(C)(C)C#N Amb32876337 [0,2,0,0,0,0|1,0,1]=4 4230 B11R1.137 Cc1ncsc1C(C)(C)C=O Amb32876312 [0,2,0,0,0,0|0,0,2]=4 4231 B11R1.137 Cc1ncsc1C(C)(C)CBr Amb33006861 [0,2,0,0,0,0|1,0,0]=3 4232 B11R1.137 Cc1ncsc1C(C)(C)CN Amb32877649 [0,2,0,0,0,0|1,0,0]=3 4233 B11R1.137 Cc1ncsc1C(C)(C)CO Amb32876311 [0,2,0,0,0,0|0,0,0]=2 4234 B11R1.137 Cc1ncsc1C(C)(C)ON Amb32876000 [0,2,0,0,0,0|2,0,0]=4 4235 B11R1.137 Cc1ncsc1C(C)(N)CO Amb32875931 [0,2,0,0,0,0|0,0,0]=2 4236 B11R1.137 Cc1ncsc1C(C)(O)C=O Amb35632371 [0,2,0,0,0,0|0,0,2]=4 4237 B11R1.137 Cc1ncsc1C(C)(O)CN Amb32877618 [0,2,0,0,0,0|1,0,0]=3 4238 B11R1.137 Cc1ncsc1C(F)(F)CN Amb33409236 [0,2,0,0,0,0|1,0,0]=3 4239 B11R1.137 Cc1ncsc1C(F)(F)CO Amb33409243 [0,2,0,0,0,0|0,0,0]=2 4240 B11R1.137 Cc1occc1C(C)(C)CO Amb33473268 [0,2,0,0,0,0|2,0,0]=4 4241 B11R1.137 Cc1occc1C(C)(N)CO Amb33274764 [0,2,0,0,0,0|2,0,0]=4 4242 B11R1.137 Cc1occc1C(F)(F)CO Amb32743209 [0,2,0,0,0,0|2,0,0]=4 4243 B11R1.137 Cn1nccc1C(C)(C)CO Amb33323863 [0,2,0,0,0,0|2,0,0]=4 4244 B11R1.137 Cn1nccc1C(C)(N)CO Amb33324295 [0,2,0,0,0,0|2,0,0]=4 4245 B11R1.137 Cn1nccc1C(F)(F)CO Amb32747603 [0,2,0,0,0,0|2,0,0]=4 4246 B11R1.137 Cn1ncnc1C(F)(F)CO Amb32796212 [0,2,0,0,0,0|2,0,0]=4 4247 B11R1.137 OCC(F)(F)c1sccc1Br Amb32813933 [0,2,0,0,0,0|2,0,0]=4 4248 B11R1.137 OCC(F)(F)c1sccc1Cl Amb32809946 [0,2,0,0,0,0|2,0,0]=4 4249 B11R1.168 C#CC(NN)c1scnc1C Amb28073771 [0,2,0,0,0,0|1,0,1]=4 4250 B11R1.168 CNC(CO)c1ccsc1C Amb28248502 [0,2,0,0,0,0|2,0,0]=4 4251 B11R1.168 COC(CN)c1sccc1C Amb18980305 [0,2,0,0,0,0|2,0,0]=4 4252 B11R1.168 COC(CN)c1scnc1C Amb33035141 [0,2,0,0,0,0|1,0,0]=3 4253 B11R1.168 COC(CN)c1scnc1Cl Amb33034867 [0,2,0,0,0,0|2,0,0]=4 4254 B11R1.168 COC(CN)c1snnc1C Amb26894095 [0,2,0,0,0,0|2,0,0]=4 4255 B11R1.168 Cc1ccoc1C(CN)CO Amb33343549 [0,2,0,0,0,0|1,1,0]=4 4256 B11R1.168 Cc1ccsc1C(CN)CO Amb33203308 [0,2,0,0,0,0|1,0,0]=3 4257 B11R1.168 Cc1ccsc1[C@@H](CO)NO Amb27970190 [0,2,0,0,0,0|1,0,0]=3 4258 B11R1.168 Cc1ncsc1C(CN)CO Amb32878136 [0,2,0,0,0,0|0,0,0]=2 4259 B11R1.168 Cc1occc1C(CN)CO Amb33275081 [0,2,0,0,0,0|2,0,0]=4 4260 B11R1.168 Cn1nccc1C(CN)CO Amb33323524 [0,2,0,0,0,0|2,0,0]=4 4261 B11R1.168 NCC(CO)c1sccc1Br Amb33387166 [0,2,0,0,0,0|2,0,0]=4 4262 B11R1.168 NCC(CO)c1sccc1Cl Amb33257632 [0,2,0,0,0,0|2,0,0]=4 4263 B11R1.875 Cc1cnn(C)c1C(N)CO Amb33415023 [0,2,0,0,0,0|2,0,0]=4 4264 B11R1.875 Cc1cnn(C)c1C(O)CO Amb33456780 [0,2,0,0,0,0|2,0,0]=4 4265 B11R1.875 Cc1cnn(C)c1[C@@H](N)CO Amb33414295 [0,2,0,0,0,0|2,0,0]=4 4266 B11R1.875 Cc1cnn(C)c1[C@H](N)CO Amb33414296 [0,2,0,0,0,0|2,0,0]=4 4267 B11R1.875 Cc1noc(C)c1C(N)CO Amb33418633 [0,2,0,0,0,0|2,0,0]=4 4268 B11R1.875 Cc1noc(C)c1C(O)CO Amb33456750 [0,2,0,0,0,0|2,0,0]=4 4269 B11R1.875 Cc1noc(C)c1[C@@H](N)CO Amb33418314 [0,2,0,0,0,0|2,0,0]=4 4270 B11R1.875 Cc1noc(C)c1[C@H](N)CO Amb33418315 [0,2,0,0,0,0|2,0,0]=4 4271 B11R1.875 Cn1cnc(Cl)c1C(N)CO Amb33056798 [0,2,0,0,0,0|2,0,0]=4 4272 B11R1.875 Cn1cnc(Cl)c1C(O)CO Amb33057214 [0,2,0,0,0,0|2,0,0]=4 4273 B11R1.875 Cn1cnc(Cl)c1[C@@H](N)CO Amb33057161 [0,2,0,0,0,0|2,0,0]=4 4274 B11R1.875 Cn1cnc(Cl)c1[C@H](N)CO Amb33057159 [0,2,0,0,0,0|2,0,0]=4 4275 B9R1.2 Cc1cc(CO)ccn1 Amb10067646 [0,0,1,1,0,0|1,0,1]=4 4276 B9R1.2 Cc1cc(CO)ncn1 Amb22059114 [0,0,1,1,0,0|1,0,1]=4 4277 B9R1.49 CC1=CCC(O)CC=C1 Amb28123967 [0,0,1,1,0,0|2,0,0]=4 4278 B9R2.2 c1cc(C2CO2)co1 Amb24483221 [1,0,0,1,0,0|2,0,0]=4 4279 B9R2.2 c1cc(C2CO2)cs1 Amb26515734 [1,0,0,1,0,0|2,0,0]=4 4280 B9R2.2 c1cc(C2CO2)sn1 Amb35731168 [1,0,0,1,0,0|2,0,0]=4 4281 B9R2.2 c1cc([C@@H]2CO2)co1 Amb33360079 [1,0,0,1,0,0|2,0,0]=4 4282 B9R2.2 c1cc([C@@H]2CO2)cs1 Amb27410328 [1,0,0,1,0,0|2,0,0]=4 4283 B9R2.2 c1cc([C@H]2CO2)co1 Amb33360230 [1,0,0,1,0,0|2,0,0]=4 4284 B9R2.2 c1cc([C@H]2CO2)cs1 Amb27648615 [1,0,0,1,0,0|2,0,0]=4 4285 B9R2.2 c1coc(C2CO2)c1 Amb1135121 [1,0,0,1,0,0|1,1,0]=4 4286 B9R2.2 c1coc([C@@H]2CO2)c1 Amb33360896 [1,0,0,1,0,0|1,1,0]=4 4287 B9R2.2 c1coc([C@H]2CO2)c1 Amb33360893 [1,0,0,1,0,0|1,1,0]=4 4288 B9R2.2 c1csc(C2CC2)c1 Amb24323171 [1,0,0,1,0,0|2,0,0]=4 4289 B9R2.2 c1csc(C2CN2)c1 Amb18222208 [1,0,0,1,0,0|2,0,0]=4 4290 B9R2.2 c1csc(C2CO2)c1 Amb1140287 [1,0,0,1,0,0|1,0,0]=3 4291 B9R2.2 c1csc(C2CO2)n1 Amb26850759 [1,0,0,1,0,0|2,0,0]=4 4292 B9R2.2 c1csc([C@@H]2CO2)c1 Amb24384733 [1,0,0,1,0,0|1,0,0]=3 4293 B9R2.2 c1csc([C@@H]2CO2)n1 Amb27952634 [1,0,0,1,0,0|2,0,0]=4 4294 B9R2.2 c1csc([C@H]2CO2)c1 Amb27395531 [1,0,0,1,0,0|1,0,0]=3 4295 B9R2.2 c1csc([C@H]2CO2)n1 Amb25126543 [1,0,0,1,0,0|2,0,0]=4 4296 B9R2.2 c1nc(C2CO2)cs1 Amb25067225 [1,0,0,1,0,0|2,0,0]=4 4297 B9R2.2 c1nc([C@@H]2CO2)cs1 Amb33417263 [1,0,0,1,0,0|2,0,0]=4 4298 B9R2.2 c1nc([C@H]2CO2)cs1 Amb33417249 [1,0,0,1,0,0|2,0,0]=4 4299 B9R2.2 c1ncc(C2CC2)o1 Amb27624972 [1,0,0,1,0,0|1,1,0]=4 4300 B9R2.2 c1ncc(C2CC2)s1 Amb28200548 [1,0,0,1,0,0|1,0,0]=3 4301 B9R2.2 c1ncc(C2CO2)o1 Amb33415266 [1,0,0,1,0,0|0,1,0]=3 4302 B9R2.2 c1ncc(C2CO2)s1 Amb24097147 [1,0,0,1,0,0|0,0,0]=2 4303 B9R2.2 c1ncc([C@@H]2CO2)o1 Amb33226884 [1,0,0,1,0,0|0,1,0]=3 4304 B9R2.2 c1ncc([C@@H]2CO2)s1 Amb33268651 [1,0,0,1,0,0|0,0,0]=2 4305 B9R2.2 c1ncc([C@H]2CO2)o1 Amb33319172 [1,0,0,1,0,0|0,1,0]=3 4306 B9R2.2 c1ncc([C@H]2CO2)s1 Amb33268006 [1,0,0,1,0,0|0,0,0]=2 4307 B9R2.3 c1cc2c(s1)CCN2 Amb18203309 [1,0,0,1,0,0|2,0,0]=4 4308 B9R2.3 c1cc2scnc2o1 Amb23412528 [1,0,0,1,0,0|0,0,2]=4 4309 B9R2.3 c1nc2c(s1)CCC2 Amb16231387 [1,0,0,1,0,0|1,0,0]=3 4310 B9R2.3 c1nc2c(s1)CCN2 Amb18197797 [1,0,0,1,0,0|1,0,0]=3 4311 B9R2.3 c1nc2c(s1)CNC2 Amb18202528 [1,0,0,1,0,0|2,0,0]=4 4312 B9R2.3 c1nc2c(s1)CNC2 Amb22497195 [1,0,0,1,0,0|2,0,0]=4 4313 B9R2.3 c1nc2c(s1)CNC2 Amb30640028 [1,0,0,1,0,0|2,0,0]=4 4314 B9R2.3 c1nc2c(s1)NCC2 Amb18202537 [1,0,0,1,0,0|2,0,0]=4 4315 B9R2.3 c1nc2c(s1)SCO2 Amb27803822 [1,0,0,1,0,0|1,0,0]=3 4316 B9R2.3 c1ncn2c1CCC2 Amb24588043 [1,0,0,1,0,0|2,0,0]=4 4317 B11R2.10 CC1Cc2cccnc2C1 Amb27404234 [0,0,0,1,0,1|2,0,0]=4 4318 B11R2.10 NC1Cc2cccnc2C1 Amb22831095 [0,0,0,1,0,1|2,0,0]=4 4319 B11R2.10 NC1Cc2cccnc2C1 Amb24105466 [0,0,0,1,0,1|2,0,0]=4 4320 B11R2.10 NC1Cc2ccncc2C1 Amb25936300 [0,0,0,1,0,1|2,0,0]=4 4321 B11R2.10 NC1Cc2ccncc2C1 Amb28895993 [0,0,0,1,0,1|2,0,0]=4 4322 B11R2.10 NC1Cc2cncnc2C1 Amb18203098 [0,0,0,1,0,1|2,0,0]=4 4323 B11R2.10 NC1Cc2cncnc2C1 Amb24117877 [0,0,0,1,0,1|2,0,0]=4 4324 B11R2.10 OC1Cc2ccccc2C1 Amb3940105 [0,0,0,1,0,1|2,0,0]=4 4325 B11R2.20 c1cc2c(cn1)CCCC2 Amb5399109 [0,0,0,1,0,1|2,0,0]=4 4326 B11R2.20 c1cc2c(cn1)CCOC2 Amb26845927 [0,0,0,1,0,1|2,0,0]=4 4327 B11R2.20 c1cc2c(cn1)CNCC2 Amb19958148 [0,0,0,1,0,1|2,0,0]=4 4328 B11R2.20 c1cc2c(cn1)CNCC2 Amb21858409 [0,0,0,1,0,1|2,0,0]=4 4329 B11R2.20 c1cc2c(cn1)CNCC2 Amb8011539 [0,0,0,1,0,1|2,0,0]=4 4330 B11R2.20 c1cc2c(cn1)COCC2 Amb28255495 [0,0,0,1,0,1|1,0,0]=3 4331 B11R2.20 c1cc2c(nn1)CCCC2 Amb22752027 [0,0,0,1,0,1|2,0,0]=4 4332 B11R2.20 c1ccc2c(c1)CCOC2 Amb2725513 [0,0,0,1,0,1|2,0,0]=4 4333 B11R2.20 c1cnc2c(c1)CCCC2 Amb2390042 [0,0,0,1,0,1|2,0,0]=4 4334 B11R2.20 c1cnc2c(c1)CCNC2 Amb21858385 [0,0,0,1,0,1|2,0,0]=4 4335 B11R2.20 c1cnc2c(c1)CCNC2 Amb22436767 [0,0,0,1,0,1|2,0,0]=4 4336 B11R2.20 c1cnc2c(c1)CCNC2 Amb8011540 [0,0,0,1,0,1|2,0,0]=4 4337 B11R2.20 c1cnc2c(n1)CCCC2 Amb2724356 [0,0,0,1,0,1|2,0,0]=4 4338 B11R2.20 c1cnc2c(n1)CCNC2 Amb32661126 [0,0,0,1,0,1|2,0,0]=4 4339 B11R2.20 c1cnc2c(n1)CCNC2 Amb33544098 [0,0,0,1,0,1|2,0,0]=4 4340 B11R2.20 c1ncc2c(n1)CCCC2 Amb19515985 [0,0,0,1,0,1|2,0,0]=4 4341 B11R2.20 c1ncc2c(n1)CCNC2 Amb17072186 [0,0,0,1,0,1|2,0,0]=4 4342 B11R2.20 c1ncc2c(n1)CCNC2 Amb19515826 [0,0,0,1,0,1|2,0,0]=4 4343 B11R2.20 c1ncc2c(n1)CCNC2 Amb19957549 [0,0,0,1,0,1|2,0,0]=4 4344 B11R2.20 c1ncc2c(n1)CCNC2 Amb22728973 [0,0,0,1,0,1|2,0,0]=4 4345 B11R2.20 c1ncc2c(n1)CCNC2 Amb28991254 [0,0,0,1,0,1|2,0,0]=4 4346 B11R2.20 c1ncc2c(n1)CNCC2 Amb18832496 [0,0,0,1,0,1|2,0,0]=4 4347 B11R2.20 c1ncc2c(n1)CNCC2 Amb22494240 [0,0,0,1,0,1|2,0,0]=4 4348 B11R2.20 c1ncc2c(n1)NOCC2 Amb24626072 [0,0,0,1,0,1|2,0,0]=4 4349 B11R2.55 Brc1cnccc1C2CO2 Amb26338193 [0,0,0,1,0,1|2,0,0]=4 4350 B11R2.55 Brc1cnccc1[C@@H]2CO2 Amb33388934 [0,0,0,1,0,1|2,0,0]=4 4351 B11R2.55 Brc1cnccc1[C@H]2CO2 Amb33388992 [0,0,0,1,0,1|2,0,0]=4 4352 B11R2.55 Brc1ncccc1C2CO2 Amb23586098 [0,0,0,1,0,1|2,0,0]=4 4353 B11R2.55 Brc1ncccc1[C@@H]2CO2 Amb33388158 [0,0,0,1,0,1|2,0,0]=4 4354 B11R2.55 Brc1ncccc1[C@H]2CO2 Amb33388161 [0,0,0,1,0,1|2,0,0]=4 4355 B11R2.55 Cc1ccccc1C2CO2 Amb1140946 [0,0,0,1,0,1|2,0,0]=4 4356 B11R2.55 Cc1ccccc1[C@@H]2CO2 Amb26498851 [0,0,0,1,0,1|2,0,0]=4 4357 B11R2.55 Cc1ccccc1[C@H]2CO2 Amb24478493 [0,0,0,1,0,1|2,0,0]=4 4358 B11R2.55 Cc1cccnc1C2CO2 Amb28315792 [0,0,0,1,0,1|2,0,0]=4 4359 B11R2.55 Cc1cccnc1[C@@H]2CO2 Amb33359953 [0,0,0,1,0,1|2,0,0]=4 4360 B11R2.55 Cc1cccnc1[C@H]2CO2 Amb33359955 [0,0,0,1,0,1|2,0,0]=4 4361 B11R2.55 Cc1ccncc1C2CO2 Amb33377092 [0,0,0,1,0,1|2,0,0]=4 4362 B11R2.55 Cc1ccncc1[C@@H]2CO2 Amb33374922 [0,0,0,1,0,1|2,0,0]=4 4363 B11R2.55 Cc1ccncc1[C@H]2CO2 Amb33374923 [0,0,0,1,0,1|2,0,0]=4 4364 B11R2.55 Cc1cnccc1C2CO2 Amb33414504 [0,0,0,1,0,1|1,0,0]=3 4365 B11R2.55 Cc1cnccc1[C@@H]2CO2 Amb33426082 [0,0,0,1,0,1|1,0,0]=3 4366 B11R2.55 Cc1cnccc1[C@H]2CO2 Amb33426083 [0,0,0,1,0,1|1,0,0]=3 4367 B11R2.55 Cc1ncccc1C2CC2 Amb22276237 [0,0,0,1,0,1|2,0,0]=4 4368 B11R2.55 Cc1ncccc1C2CO2 Amb32880122 [0,0,0,1,0,1|1,0,0]=3 4369 B11R2.55 Cc1ncccc1[C@@H]2CO2 Amb33224402 [0,0,0,1,0,1|1,0,0]=3 4370 B11R2.55 Cc1ncccc1[C@H]2CO2 Amb32877471 [0,0,0,1,0,1|1,0,0]=3 4371 B11R2.55 Cc1nccnc1C2CO2 Amb33142500 [0,0,0,1,0,1|1,0,0]=3 4372 B11R2.55 Cc1nccnc1[C@@H]2CO2 Amb26642365 [0,0,0,1,0,1|1,0,0]=3 4373 B11R2.55 Cc1nccnc1[C@H]2CO2 Amb24601905 [0,0,0,1,0,1|1,0,0]=3 4374 B11R2.55 Cc1ncncc1C2CO2 Amb33472484 [0,0,0,1,0,1|1,0,0]=3 4375 B11R2.55 Cc1ncncc1[C@@H]2CO2 Amb32876359 [0,0,0,1,0,1|1,0,0]=3 4376 B11R2.55 Cc1ncncc1[C@H]2CO2 Amb32876360 [0,0,0,1,0,1|1,0,0]=3 4377 B11R2.55 Clc1cnccc1C2CO2 Amb26343754 [0,0,0,1,0,1|2,0,0]=4 4378 B11R2.55 Clc1cnccc1[C@@H]2CO2 Amb33057024 [0,0,0,1,0,1|2,0,0]=4 4379 B11R2.55 Clc1cnccc1[C@H]2CO2 Amb33057023 [0,0,0,1,0,1|2,0,0]=4 4380 B11R2.55 Clc1ncccc1C2CO2 Amb33257235 [0,0,0,1,0,1|2,0,0]=4 4381 B11R2.55 Clc1ncccc1[C@@H]2CO2 Amb33263119 [0,0,0,1,0,1|2,0,0]=4 4382 B11R2.55 Clc1ncccc1[C@H]2CO2 Amb33257394 [0,0,0,1,0,1|2,0,0]=4 4383 B11R2.55 Fc1cnccc1C2CO2 Amb26427650 [0,0,0,1,0,1|2,0,0]=4 4384 B11R2.55 Fc1cnccc1[C@@H]2CO2 Amb33316456 [0,0,0,1,0,1|2,0,0]=4 4385 B11R2.55 Fc1cnccc1[C@H]2CO2 Amb33316457 [0,0,0,1,0,1|2,0,0]=4 4386 B11R2.55 Fc1ncccc1C2CO2 Amb33378310 [0,0,0,1,0,1|2,0,0]=4 4387 B11R2.55 Fc1ncccc1[C@@H]2CO2 Amb33376448 [0,0,0,1,0,1|2,0,0]=4 4388 B11R2.55 Fc1ncccc1[C@H]2CO2 Amb33376449 [0,0,0,1,0,1|2,0,0]=4 4389 B11R2.55 Nc1ncccc1C2CO2 Amb27872157 [0,0,0,1,0,1|2,0,0]=4 4390 B11R2.55 Nc1ncccc1[C@@H]2CO2 Amb28341885 [0,0,0,1,0,1|2,0,0]=4 4391 B11R2.55 Oc1ncccc1C2CO2 Amb27950554 [0,0,0,1,0,1|2,0,0]=4 4392 B11R2.106 Cc1ccnc2c1CCO2 Amb24070496 [0,0,0,1,0,1|2,0,0]=4 4393 B11R2.106 Cc1nccc2c1CCC2 Amb27589775 [0,0,0,1,0,1|2,0,0]=4 4394 B11R2.106 Clc1ncnc2c1CCO2 Amb24389572 [0,0,0,1,0,1|2,0,0]=4 4395 B11R2.106 Nc1nccc2c1CCO2 Amb35788336 [0,0,0,1,0,1|2,0,0]=4 4396 B11R2.106 Oc1ncnc2c1CCO2 Amb16218115 [0,0,0,1,0,1|2,0,0]=4 4397 B11R2.988 OCC1Cc2ccccc21 Amb8395939 [0,0,0,1,0,1|2,0,0]=4 4398 B11R2.35 Cc1cc(C2CC2)ccn1 Amb10573795 [0,0,0,1,0,1|2,0,0]=4 4399 B11R2.35 Cc1cc(C2CO2)ccn1 Amb33268218 [0,0,0,1,0,1|1,0,0]=3 4400 B11R2.35 Cc1cc([C@@H]2CO2)ccn1 Amb32733326 [0,0,0,1,0,1|1,0,0]=3 4401 B11R2.35 Cc1cc([C@H]2CO2)ccn1 Amb32733328 [0,0,0,1,0,1|1,0,0]=3 4402 B11R2.35 Cc1cccc(C2CO2)c1 Amb17090251 [0,0,0,1,0,1|2,0,0]=4 4403 B11R2.35 Cc1cccc(C2CO2)n1 Amb28045270 [0,0,0,1,0,1|2,0,0]=4 4404 B11R2.35 Cc1cccc([C@@H]2CO2)c1 Amb26345259 [0,0,0,1,0,1|2,0,0]=4 4405 B11R2.35 Cc1cccc([C@@H]2CO2)n1 Amb33199217 [0,0,0,1,0,1|2,0,0]=4 4406 B11R2.35 Cc1cccc([C@H]2CO2)c1 Amb26865926 [0,0,0,1,0,1|2,0,0]=4 4407 B11R2.35 Cc1cccc([C@H]2CO2)n1 Amb33226182 [0,0,0,1,0,1|2,0,0]=4 4408 B11R2.35 Cc1ccnc(C2CO2)c1 Amb33318404 [0,0,0,1,0,1|2,0,0]=4 4409 B11R2.35 Cc1ccnc([C@@H]2CO2)c1 Amb33317764 [0,0,0,1,0,1|2,0,0]=4 4410 B11R2.35 Cc1ccnc([C@H]2CO2)c1 Amb33317765 [0,0,0,1,0,1|2,0,0]=4 4411 B11R2.36 Cc1ccc2c(c1)CCO2 Amb2447310 [0,0,0,1,0,1|2,0,0]=4 4412 B11R2.36 Cc1ncc2c(n1)CCN2 Amb18832488 [0,0,0,1,0,1|2,0,0]=4 4413 B11R2.36 Nc1cc2c(cn1)OCC2 Amb27646803 [0,0,0,1,0,1|2,0,0]=4 4414 B11R2.8 NC1c2sccc2CC1O Amb27966739 [0,1,0,1,0,0|1,0,0]=3 4415 B11R2.8 N[C@@H]1c2sccc2C[C@H]1O Amb27441694 [0,1,0,1,0,0|1,0,0]=3 4416 B11R2.8 N[C@H]1c2sccc2C[C@H]1O Amb27851420 [0,1,0,1,0,0|1,0,0]=3 4417 B11R2.8 O=C1c2sccc2C[C@H]1O Amb27453565 [0,1,0,1,0,0|1,0,1]=4 4418 B11R2.18 C1CCc2nnsc2NC1 Amb18200368 [0,1,0,1,0,0|2,0,0]=4 4419 B11R2.18 c1cc2c(s1)CCCCN2 Amb19373421 [0,1,0,1,0,0|2,0,0]=4 4420 B11R2.18 c1cc2c(s1)CCCCN2 Amb32644496 [0,1,0,1,0,0|2,0,0]=4 4421 B11R2.18 c1cc2c(s1)CCCNC2 Amb19373401 [0,1,0,1,0,0|2,0,0]=4 4422 B11R2.18 c1cc2c(s1)CCCNC2 Amb25296448 [0,1,0,1,0,0|2,0,0]=4 4423 B11R2.18 c1cc2c(s1)CCNCC2 Amb18831055 [0,1,0,1,0,0|2,0,0]=4 4424 B11R2.18 c1cc2c(s1)CNCCC2 Amb18200901 [0,1,0,1,0,0|2,0,0]=4 4425 B11R2.18 c1cc2c(s1)CNCCC2 Amb22899030 [0,1,0,1,0,0|2,0,0]=4 4426 B11R2.18 c1nc2c(o1)CNCCC2 Amb27958896 [0,1,0,1,0,0|1,1,0]=4 4427 B11R2.18 c1nc2c(s1)CNCCC2 Amb27867912 [0,1,0,1,0,0|1,0,0]=3 4428 B11R2.191 NCc1ncn2c1CCC2 Amb18832300 [0,1,0,1,0,0|2,0,0]=4 4429 B11R2.191 OCC1CCc2nccn21 Amb22886795 [0,1,0,1,0,0|2,0,0]=4 4430 B11R2.191 OCC1CCc2ncnn21 Amb22284622 [0,1,0,1,0,0|2,0,0]=4 4431 B11R2.191 OC[C@@H]1CCc2ncnn21 Amb22745570 [0,1,0,1,0,0|2,0,0]=4 4432 B11R2.216 CCc1ccsc1C2CO2 Amb32729291 [0,1,0,1,0,0|1,0,0]=3 4433 B11R2.216 CCc1ccsc1[C@@H]2CO2 Amb32726040 [0,1,0,1,0,0|1,0,0]=3 4434 B11R2.216 CCc1ccsc1[C@H]2CO2 Amb33224498 [0,1,0,1,0,0|1,0,0]=3 4435 B11R2.216 CCn1nccc1C2CO2 Amb33324432 [0,1,0,1,0,0|2,0,0]=4 4436 B11R2.216 CCn1nccc1[C@@H]2CO2 Amb33319433 [0,1,0,1,0,0|2,0,0]=4 4437 B11R2.216 CCn1nccc1[C@H]2CO2 Amb33319437 [0,1,0,1,0,0|2,0,0]=4 4438 B11R2.216 CCn1ncnc1C2CO2 Amb33417236 [0,1,0,1,0,0|2,0,0]=4 4439 B11R2.216 CCn1ncnc1[C@@H]2CO2 Amb33321568 [0,1,0,1,0,0|2,0,0]=4 4440 B11R2.216 CCn1ncnc1[C@H]2CO2 Amb33321569 [0,1,0,1,0,0|2,0,0]=4 4441 B11R2.216 ClCc1ncoc1C2CC2 Amb22059818 [0,1,0,1,0,0|1,1,0]=4 4442 B11R2.216 NCc1ncoc1C2CC2 Amb18908313 [0,1,0,1,0,0|1,1,0]=4 4443 B11R2.216 NCc1ncoc1C2CC2 Amb33483456 [0,1,0,1,0,0|1,1,0]=4 4444 B11R2.216 OCc1ncoc1C2CC2 Amb28067487 [0,1,0,1,0,0|1,1,0]=4 4445 B11R2.1 Brc1cnc2n1CCOC2 Amb26635539 [0,1,0,1,0,0|2,0,0]=4 4446 B11R2.1 Brc1csc2c1CCCC2 Amb18143547 [0,1,0,1,0,0|2,0,0]=4 4447 B11R2.1 Brc1csc2c1CNCC2 Amb24183571 [0,1,0,1,0,0|2,0,0]=4 4448 B11R2.1 Cc1csc2c1CNCC2 Amb25823894 [0,1,0,1,0,0|2,0,0]=4 4449 B11R2.1 Cc1ncn2c1CCCC2 Amb27796128 [0,1,0,1,0,0|2,0,0]=4 4450 B11R2.1 Cc1ncn2c1CNCC2 Amb18832311 [0,1,0,1,0,0|2,0,0]=4 4451 B11R2.1 Cn1cnc2c1CCCC2 Amb9767558 [0,1,0,1,0,0|2,0,0]=4 4452 B11R2.1 Cn1cnc2c1CCNC2 Amb19457625 [0,1,0,1,0,0|2,0,0]=4 4453 B11R2.1 Cn1cnc2c1CCNC2 Amb23456818 [0,1,0,1,0,0|2,0,0]=4 4454 B11R2.1 Cn1cnc2c1CCNC2 Amb540580 [0,1,0,1,0,0|2,0,0]=4 4455 B11R2.1 Cn1cnc2c1CCOC2 Amb33078542 [0,1,0,1,0,0|1,0,0]=3 4456 B11R2.1 Cn1ncc2c1NCCO2 Amb28388407 [0,1,0,1,0,0|2,0,0]=4 4457 B11R2.1 Ic1cnc2n1CCOC2 Amb32685619 [0,1,0,1,0,0|2,0,0]=4 4458 B11R2.1 Nc1cnc2n1CCOC2 Amb32410278 [0,1,0,1,0,0|2,0,0]=4 4459 B11R2.1 Nc1cnc2n1CCOC2 Amb35751391 [0,1,0,1,0,0|2,0,0]=4 4460 B11R2.1 Nc1csc2c1CCCC2 Amb25842894 [0,1,0,1,0,0|2,0,0]=4 4461 B11R2.1 Nc1onc2c1CCOC2 Amb27849087 [0,1,0,1,0,0|2,0,0]=4 4462 B11R2.1 Oc1cnc2n1CCOC2 Amb35630832 [0,1,0,1,0,0|2,0,0]=4 4463 B11R2.1 Oc1csc2c1CCCC2 Amb23590873 [0,1,0,1,0,0|2,0,0]=4 4464 B11R2.1 Sc1csc2c1CCCC2 Amb33271046 [0,1,0,1,0,0|2,0,0]=4 4465 B11R2.15 O=CC1Cc2ccsc2C1 Amb18831189 [0,1,0,1,0,0|1,0,1]=4 4466 B11R2.51 Cc1ccsc1C2CC2N Amb9677205 [0,1,0,1,0,0|2,0,0]=4 4467 B11R2.51 Cc1ccsc1[C@@H]2C[C@H]2N Amb33203327 [0,1,0,1,0,0|2,0,0]=4 4468 B11R2.51 Cc1ncsc1C2CC2N Amb24604455 [0,1,0,1,0,0|1,0,0]=3 4469 B11R2.51 Cc1ncsc1[C@@H]2C[C@H]2N Amb26027123 [0,1,0,1,0,0|1,0,0]=3 4470 B11R2.51 Cc1nnsc1C2CC2N Amb27669356 [0,1,0,1,0,0|2,0,0]=4 4471 B11R2.115 Brc1ccsc1CC2CO2 Amb25274664 [0,1,0,1,0,0|2,0,0]=4 4472 B11R2.115 Cc1ccoc1CC2CO2 Amb33342973 [0,1,0,1,0,0|1,1,0]=4 4473 B11R2.115 Cc1ccsc1CC2CO2 Amb24357824 [0,1,0,1,0,0|1,0,0]=3 4474 B11R2.115 Cc1ncsc1CC2CO2 Amb24070516 [0,1,0,1,0,0|0,0,0]=2 4475 B11R2.115 Cc1occc1CC2CO2 Amb33274776 [0,1,0,1,0,0|2,0,0]=4 4476 B11R2.115 Clc1ccsc1CC2CO2 Amb28068494 [0,1,0,1,0,0|2,0,0]=4 4477 B11R2.115 Cn1nccc1CC2CO2 Amb27444538 [0,1,0,1,0,0|2,0,0]=4 4478 B11R2.459 Brc1ncsc1C2CCC2 Amb20617258 [0,1,0,1,0,0|2,0,0]=4 4479 B11R2.459 Cc1ccsc1C2CCN2 Amb24433322 [0,1,0,1,0,0|2,0,0]=4 4480 B11R2.459 Cc1ccsc1C2CNC2 Amb24636265 [0,1,0,1,0,0|2,0,0]=4 4481 B11R2.459 Cc1ncsc1C2CCN2 Amb32876846 [0,1,0,1,0,0|1,0,0]=3 4482 B11R2.459 Cc1ncsc1C2CNC2 Amb29878253 [0,1,0,1,0,0|1,0,0]=3 4483 B11R2.459 Cc1nnsc1C2CCN2 Amb27966907 [0,1,0,1,0,0|2,0,0]=4 4484 B11R2.459 Nc1ncsc1C2CCC2 Amb24317509 [0,1,0,1,0,0|2,0,0]=4 4485 B11R2.66 Cc1ncn2c1CC(N)C2 Amb18832302 [0,1,0,1,0,0|2,0,0]=4 4486 B11R2.66 Cn1cnc2c1CC(N)C2 Amb18832297 [0,1,0,1,0,0|2,0,0]=4 4487 B11R2.1073 Cc1csc(C2CO2)c1Br Amb33433877 [0,1,0,1,0,0|2,0,0]=4 4488 B11R2.1073 Cc1csc([C@@H]2CO2)c1Br Amb33432458 [0,1,0,1,0,0|2,0,0]=4 4489 B11R2.1073 Cc1csc([C@H]2CO2)c1Br Amb33432453 [0,1,0,1,0,0|2,0,0]=4 4490 B11R2.356 Brc1cc(Br)c(C2CO2)s1 Amb33006769 [0,1,0,1,0,0|2,0,0]=4 4491 B11R2.356 Brc1cc(Br)c([C@@H]2CO2)s1 Amb33005275 [0,1,0,1,0,0|2,0,0]=4 4492 B11R2.356 Brc1cc(Br)c([C@H]2CO2)s1 Amb33005273 [0,1,0,1,0,0|2,0,0]=4 4493 B11R2.356 Cc1cc(Br)c(C2CO2)s1 Amb33263097 [0,1,0,1,0,0|2,0,0]=4 4494 B11R2.356 Cc1cc(Br)c([C@@H]2CO2)s1 Amb33431723 [0,1,0,1,0,0|2,0,0]=4 4495 B11R2.356 Cc1cc(Br)c([C@H]2CO2)s1 Amb33431739 [0,1,0,1,0,0|2,0,0]=4 4496 B11R2.356 Cc1cc(Br)oc1C2CO2 Amb33450692 [0,1,0,1,0,0|1,1,0]=4 4497 B11R2.356 Cc1cc(Br)oc1[C@@H]2CO2 Amb33387606 [0,1,0,1,0,0|1,1,0]=4 4498 B11R2.356 Cc1cc(Br)oc1[C@H]2CO2 Amb33387610 [0,1,0,1,0,0|1,1,0]=4 4499 B11R2.356 Cc1cc(Br)sc1C2CC2 Amb10600998 [0,1,0,1,0,0|2,0,0]=4 4500 B11R2.356 Cc1cc(C2CO2)c(C)o1 Amb7776998 [0,1,0,1,0,0|2,0,0]=4 4501 B11R2.356 Cc1cc(C2CO2)c(C)s1 Amb18796790 [0,1,0,1,0,0|2,0,0]=4 4502 B11R2.356 Cc1cc(C2CO2)n(C)n1 Amb23586116 [0,1,0,1,0,0|2,0,0]=4 4503 B11R2.356 Cc1cc([C@@H]2CO2)c(C)o1 Amb33342135 [0,1,0,1,0,0|2,0,0]=4 4504 B11R2.356 Cc1cc([C@@H]2CO2)c(C)s1 Amb33223849 [0,1,0,1,0,0|2,0,0]=4 4505 B11R2.356 Cc1cc([C@@H]2CO2)n(C)n1 Amb33417268 [0,1,0,1,0,0|2,0,0]=4 4506 B11R2.356 Cc1cc([C@H]2CO2)c(C)o1 Amb33342136 [0,1,0,1,0,0|2,0,0]=4 4507 B11R2.356 Cc1cc([C@H]2CO2)c(C)s1 Amb33266880 [0,1,0,1,0,0|2,0,0]=4 4508 B11R2.356 Cc1cc([C@H]2CO2)n(C)n1 Amb33417266 [0,1,0,1,0,0|2,0,0]=4 4509 B11R2.356 Cc1nc(C)c(C2CO2)s1 Amb28146372 [0,1,0,1,0,0|0,0,0]=2 4510 B11R2.356 Cc1nn(C)cc1C2CO2 Amb26887272 [0,1,0,1,0,0|2,0,0]=4 4511 B11R2.356 Cc1nn(C)cc1[C@@H]2CO2 Amb25286948 [0,1,0,1,0,0|2,0,0]=4 4512 B11R2.356 Cc1nn(C)cc1[C@H]2CO2 Amb28399587 [0,1,0,1,0,0|2,0,0]=4 4513 B11R2.356 Cn1nc(Br)cc1C2CO2 Amb33436037 [0,1,0,1,0,0|2,0,0]=4 4514 B11R2.356 Cn1nc(Br)cc1[C@@H]2CO2 Amb33430693 [0,1,0,1,0,0|2,0,0]=4 4515 B11R2.356 Cn1nc(Br)cc1[C@H]2CO2 Amb33430692 [0,1,0,1,0,0|2,0,0]=4 4516 B11R2.356 Oc1nc(Br)sc1C2CC2 Amb18766891 [0,1,0,1,0,0|2,0,0]=4 4517 B11R2.43 CC1(c2sccc2Br)CO1 Amb33387627 [0,1,0,1,0,0|2,0,0]=4 4518 B11R2.43 CC1(c2sccc2Cl)CO1 Amb33257970 [0,1,0,1,0,0|2,0,0]=4 4519 B11R2.43 Cc1ccoc1C2(C)CO2 Amb33343164 [0,1,0,1,0,0|1,1,0]=4 4520 B11R2.43 Cc1ccsc1C2(C)CO2 Amb33202951 [0,1,0,1,0,0|1,0,0]=3 4521 B11R2.43 Cc1ccsc1C2(N)CC2 Amb25809441 [0,1,0,1,0,0|2,0,0]=4 4522 B11R2.43 Cc1ccsc1C2(O)CC2 Amb18796786 [0,1,0,1,0,0|2,0,0]=4 4523 B11R2.43 Cc1ncsc1C2(C)CO2 Amb32875896 [0,1,0,1,0,0|0,0,0]=2 4524 B11R2.43 Cc1ncsc1C2(N)CC2 Amb18830955 [0,1,0,1,0,0|1,0,0]=3 4525 B11R2.43 Cc1ncsc1C2(O)CC2 Amb18796864 [0,1,0,1,0,0|1,0,0]=3 4526 B11R2.43 Cc1nnsc1C2(C)CO2 Amb33732297 [0,1,0,1,0,0|1,0,0]=3 4527 B11R2.43 Cc1nnsc1C2(O)CC2 Amb27223529 [0,1,0,1,0,0|2,0,0]=4 4528 B11R2.43 Cc1nscc1C2(C)CO2 Amb33748205 [0,1,0,1,0,0|2,0,0]=4 4529 B11R2.43 Cc1occc1C2(C)CO2 Amb33274767 [0,1,0,1,0,0|2,0,0]=4 4530 B11R2.43 Cn1nccc1C2(C)CO2 Amb33324296 [0,1,0,1,0,0|2,0,0]=4 4531 B11R2.206 Cc1cnn(C)c1C2CO2 Amb33414673 [0,1,0,1,0,0|2,0,0]=4 4532 B11R2.206 Cc1cnn(C)c1[C@@H]2CO2 Amb33320079 [0,1,0,1,0,0|2,0,0]=4 4533 B11R2.206 Cc1cnn(C)c1[C@H]2CO2 Amb33320080 [0,1,0,1,0,0|2,0,0]=4 4534 B11R2.206 Cc1noc(C)c1C2CO2 Amb33418354 [0,1,0,1,0,0|2,0,0]=4 4535 B11R2.206 Cc1noc(C)c1[C@@H]2CO2 Amb33422195 [0,1,0,1,0,0|2,0,0]=4 4536 B11R2.206 Cc1noc(C)c1[C@H]2CO2 Amb33422196 [0,1,0,1,0,0|2,0,0]=4 4537 B11R2.206 Cn1cnc(Cl)c1C2CO2 Amb33057131 [0,1,0,1,0,0|2,0,0]=4 4538 B11R2.206 Cn1cnc(Cl)c1[C@@H]2CO2 Amb33222792 [0,1,0,1,0,0|2,0,0]=4 4539 B11R2.206 Cn1cnc(Cl)c1[C@H]2CO2 Amb33222788 [0,1,0,1,0,0|2,0,0]=4 4540 B7R1.6 OCCC1=CCC1 Amb28189596 [1,0,0,0,1,0|1,0,1]=4 4541 B7R1.5 O=C1C=C1CCO Amb33330739 [0,0,0,0,2,0|1,0,0]=3