0 B14R1.863 C#CC(O)\C=C\c1ccccc1OC Amb27761560 [0,0,0,0,0,0|2,0,2]=4 1 B14R1.863 C#C[C@@H](O)\C=C\c1ccccc1OC Amb28064151 [0,0,0,0,0,0|2,0,2]=4 2 B14R1.863 C#C[C@H](O)\C=C\c1ccccc1OC Amb27191250 [0,0,0,0,0,0|2,0,2]=4 3 B14R1.863 CCC(=O)CSc1ccccc1OC Amb32682975 [0,0,0,0,0,0|1,1,2]=4 4 B14R1.863 CCC(C)CNc1ccccc1OC Amb6720064 [0,0,0,0,0,0|3,0,0]=3 5 B14R1.863 CCC(C)CNc1ccccc1SC Amb9548798 [0,0,0,0,0,0|3,1,0]=4 6 B14R1.863 CCC(C)CNc1cccnc1OC Amb9587538 [0,0,0,0,0,0|4,0,0]=4 7 B14R1.863 CCC(C)NCc1ccccc1OC Amb19890327 [0,0,0,0,0,0|4,0,0]=4 8 B14R1.863 CCC(C)NCc1ccccc1OC Amb9732547 [0,0,0,0,0,0|4,0,0]=4 9 B14R1.863 CCc1ccccc1OCC(C)C#N Amb9028652 [0,0,0,0,0,0|3,0,1]=4 10 B14R1.863 CCc1ccccc1OCC(N)C#N Amb17076571 [0,0,0,0,0,0|3,0,1]=4 11 B14R1.863 CNC(C)CCc1ccccc1OC Amb17507416 [0,0,0,0,0,0|4,0,0]=4 12 B14R1.863 COC(=O)COc1ccccc1OC Amb6540785 [0,0,0,0,0,0|2,0,2]=4 13 B14R1.863 COc1ccccc1CCC(C)CN Amb33746144 [0,0,0,0,0,0|3,0,0]=3 14 B14R1.863 COc1ccccc1CCC(C)CO Amb33745858 [0,0,0,0,0,0|2,0,0]=2 15 B14R1.863 COc1ccccc1CC[C@@H](C)CN Amb33744947 [0,0,0,0,0,0|3,0,0]=3 16 B14R1.863 COc1ccccc1CC[C@@H](C)CO Amb33746890 [0,0,0,0,0,0|2,0,0]=2 17 B14R1.863 COc1ccccc1CC[C@H](C)CN Amb33730087 [0,0,0,0,0,0|3,0,0]=3 18 B14R1.863 COc1ccccc1CC[C@H](C)CO Amb33731291 [0,0,0,0,0,0|2,0,0]=2 19 B14R1.863 COc1ccccc1CNC(=O)CO Amb9421494 [0,0,0,0,0,0|2,0,2]=4 20 B14R1.863 COc1ccccc1CNC(C)CO Amb9359877 [0,0,0,0,0,0|3,0,0]=3 21 B14R1.863 COc1ccccc1NCC(C)C#N Amb9024708 [0,0,0,0,0,0|3,0,1]=4 22 B14R1.863 COc1ccccc1OCC(=O)CCl Amb17140890 [0,0,0,0,0,0|1,0,2]=3 23 B14R1.863 COc1ccccc1OCC(=O)NN Amb6337237 [0,0,0,0,0,0|2,0,2]=4 24 B14R1.863 COc1ccccc1OCC(=O)NO Amb17236541 [0,0,0,0,0,0|1,0,2]=3 25 B14R1.863 COc1ccccc1OCC(C)C#N Amb8868637 [0,0,0,0,0,0|2,0,1]=3 26 B14R1.863 COc1ccccc1OCC(C)CN Amb9029327 [0,0,0,0,0,0|2,0,0]=2 27 B14R1.863 COc1ccccc1OCC(N)C#N Amb17076568 [0,0,0,0,0,0|2,0,1]=3 28 B14R1.863 COc1ccccc1OCC(O)CN Amb9711025 [0,0,0,0,0,0|1,0,0]=1 29 B14R1.863 COc1ccccc1OCC(O)CO Amb932803 [0,0,0,0,0,0|0,0,0]=0 30 B14R1.863 COc1ccccc1OC[C@@H](O)CO Amb28519699 [0,0,0,0,0,0|0,0,0]=0 31 B14R1.863 COc1ccccc1SCC(C)CN Amb19373201 [0,0,0,0,0,0|2,1,0]=3 32 B14R1.863 COc1ccccc1SCC(C)CN Amb22058919 [0,0,0,0,0,0|2,1,0]=3 33 B14R1.863 N#Cc1ccccc1NCC(N)CO Amb27965272 [0,0,0,0,0,0|4,0,0]=4 34 B14R1.863 N#Cc1ccccc1NCC(O)CN Amb18564868 [0,0,0,0,0,0|4,0,0]=4 35 B14R1.863 N#Cc1ccccc1NCC(O)CO Amb17336425 [0,0,0,0,0,0|3,0,0]=3 36 B14R1.863 N#Cc1ccccc1NC[C@H](O)CO Amb27769804 [0,0,0,0,0,0|3,0,0]=3 37 B14R1.863 N#Cc1ccccc1OCC(O)CCl Amb8384745 [0,0,0,0,0,0|3,0,0]=3 38 B14R1.863 N#Cc1ccccc1SCC(O)CO Amb17579290 [0,0,0,0,0,0|2,1,0]=3 39 B14R1.863 N#Cc1cccnc1SCC(O)CO Amb17579320 [0,0,0,0,0,0|3,1,0]=4 40 B14R1.863 N#Cc1cnccc1NCC(O)CO Amb27245033 [0,0,0,0,0,0|4,0,0]=4 41 B13R1.84 C#CCCNc1ccccc1OC Amb28242083 [1,0,0,0,0,0|2,0,1]=4 42 B13R1.84 C#Cc1ccccc1OCCCN Amb33373852 [1,0,0,0,0,0|2,0,1]=4 43 B13R1.84 CCCCNc1ccccc1OC Amb6688441 [1,0,0,0,0,0|2,0,0]=3 44 B13R1.84 CCCCNc1ccccc1SC Amb9226543 [1,0,0,0,0,0|2,1,0]=4 45 B13R1.84 CCCCOc1ccccc1C=O Amb6705789 [1,0,0,0,0,0|3,0,0]=4 46 B13R1.84 CCCCOc1ccccc1CO Amb6296943 [1,0,0,0,0,0|3,0,0]=4 47 B13R1.84 CCCNCc1ccccc1OC Amb19890382 [1,0,0,0,0,0|3,0,0]=4 48 B13R1.84 CCCNCc1ccccc1OC Amb837723 [1,0,0,0,0,0|3,0,0]=4 49 B13R1.84 CCc1ccccc1CCCCN Amb33474508 [1,0,0,0,0,0|3,0,0]=4 50 B13R1.84 CCc1ccccc1NCCCO Amb17305812 [1,0,0,0,0,0|2,0,0]=3 51 B13R1.84 CCc1ccccc1OCCC#N Amb9024012 [1,0,0,0,0,0|2,0,1]=4 52 B13R1.84 CCc1ccccc1OCCC=O Amb5731769 [1,0,0,0,0,0|1,0,2]=4 53 B13R1.84 CCc1ccccc1OCCCN Amb5731729 [1,0,0,0,0,0|2,0,0]=3 54 B13R1.84 CCc1ccccc1OCCNC Amb3433752 [1,0,0,0,0,0|3,0,0]=4 55 B13R1.84 CCc1ccccc1OCCNC Amb9024984 [1,0,0,0,0,0|3,0,0]=4 56 B13R1.84 CNCCCc1ccccc1OC Amb17104505 [1,0,0,0,0,0|3,0,0]=4 57 B13R1.84 CNCCOc1ccccc1OC Amb30982583 [1,0,0,0,0,0|2,0,0]=3 58 B13R1.84 CNCCOc1ccccc1OC Amb33528818 [1,0,0,0,0,0|2,0,0]=3 59 B13R1.84 COc1ccccc1C#CCCCl Amb19052133 [1,0,0,0,0,0|2,0,1]=4 60 B13R1.84 COc1ccccc1CCCC#N Amb17233102 [1,0,0,0,0,0|2,0,1]=4 61 B13R1.84 COc1ccccc1CCCC=O Amb18549414 [1,0,0,0,0,0|1,0,2]=4 62 B13R1.84 COc1ccccc1CCCCBr Amb34914036 [1,0,0,0,0,0|2,0,0]=3 63 B13R1.84 COc1ccccc1CCCCI Amb34914022 [1,0,0,0,0,0|2,0,0]=3 64 B13R1.84 COc1ccccc1CCCCN Amb18015289 [1,0,0,0,0,0|2,0,0]=3 65 B13R1.84 COc1ccccc1CCCCN Amb5735498 [1,0,0,0,0,0|2,0,0]=3 66 B13R1.84 COc1ccccc1CCCCO Amb17106039 [1,0,0,0,0,0|1,0,0]=2 67 B13R1.84 COc1ccccc1CNCCN Amb17091025 [1,0,0,0,0,0|3,0,0]=4 68 B13R1.84 COc1ccccc1CNCCO Amb13949022 [1,0,0,0,0,0|2,0,0]=3 69 B13R1.84 COc1ccccc1CNCCO Amb6708475 [1,0,0,0,0,0|2,0,0]=3 70 B13R1.84 COc1ccccc1COCCN Amb17470641 [1,0,0,0,0,0|3,0,0]=4 71 B13R1.84 COc1ccccc1COCCN Amb28600283 [1,0,0,0,0,0|3,0,0]=4 72 B13R1.84 COc1ccccc1NCCC#N Amb1103896 [1,0,0,0,0,0|2,0,1]=4 73 B13R1.84 COc1ccccc1NCCCN Amb17057731 [1,0,0,0,0,0|2,0,0]=3 74 B13R1.84 COc1ccccc1NCCCO Amb17306866 [1,0,0,0,0,0|1,0,0]=2 75 B13R1.84 COc1ccccc1OC#CCO Amb27197998 [1,0,0,0,0,0|0,0,2]=3 76 B13R1.84 COc1ccccc1OCCC#N Amb1635748 [1,0,0,0,0,0|1,0,1]=3 77 B13R1.84 COc1ccccc1OCCC=O Amb5731772 [1,0,0,0,0,0|0,0,2]=3 78 B13R1.84 COc1ccccc1OCCCBr Amb2694435 [1,0,0,0,0,0|1,0,0]=2 79 B13R1.84 COc1ccccc1OCCCN Amb1128912 [1,0,0,0,0,0|1,0,0]=2 80 B13R1.84 COc1ccccc1OCCCN Amb19959604 [1,0,0,0,0,0|1,0,0]=2 81 B13R1.84 COc1ccccc1SCCC=O Amb18318084 [1,0,0,0,0,0|0,1,2]=4 82 B13R1.84 COc1ccccc1\C=C\CCBr Amb17159035 [1,0,0,0,0,0|2,0,1]=4 83 B13R1.84 COc1ccccc1\C=C\CCCl Amb17236512 [1,0,0,0,0,0|2,0,1]=4 84 B13R1.84 COc1ccccc1\C=C\CCN Amb17138818 [1,0,0,0,0,0|2,0,1]=4 85 B13R1.84 COc1cccnc1CCCCN Amb18128756 [1,0,0,0,0,0|3,0,0]=4 86 B13R1.84 COc1cccnc1OCCCN Amb33171458 [1,0,0,0,0,0|2,0,0]=3 87 B13R1.84 COc1ccncc1C#CCCO Amb28078374 [1,0,0,0,0,0|2,0,1]=4 88 B13R1.84 COc1ncccc1CCCCN Amb33378575 [1,0,0,0,0,0|3,0,0]=4 89 B13R1.84 COc1ncccc1OCCCN Amb33378283 [1,0,0,0,0,0|2,0,0]=3 90 B13R1.84 CSc1ccccc1CCCCN Amb32876728 [1,0,0,0,0,0|2,1,0]=4 91 B13R1.84 CSc1ccccc1OCCCN Amb33449269 [1,0,0,0,0,0|1,1,0]=3 92 B13R1.84 N#Cc1ccccc1NCCCO Amb8903748 [1,0,0,0,0,0|3,0,0]=4 93 B13R1.84 N#Cc1ccccc1OCCCN Amb17740017 [1,0,0,0,0,0|3,0,0]=4 94 B13R1.84 N#Cc1ccccc1OCCCO Amb8841031 [1,0,0,0,0,0|2,0,0]=3 95 B13R1.84 [C-]#[N+]CCOc1ccccc1OC Amb33745673 [1,0,0,0,0,0|2,0,0]=3 96 B13R1.90 C#Cc1ccccc1CCC(C)O Amb33203589 [1,0,0,0,0,0|2,0,1]=4 97 B13R1.90 C#Cc1ccccc1CC[C@@H](C)O Amb33203587 [1,0,0,0,0,0|2,0,1]=4 98 B13R1.90 C#Cc1ccccc1CC[C@H](C)O Amb33203588 [1,0,0,0,0,0|2,0,1]=4 99 B13R1.90 C=C(C)CCc1ccccc1OC Amb6299118 [1,0,0,0,0,0|2,0,1]=4 100 B13R1.90 C=C(C)CNc1ccccc1OC Amb17306865 [1,0,0,0,0,0|2,0,1]=4 101 B13R1.90 CC(C)COc1ccccc1C#N Amb6275552 [1,0,0,0,0,0|3,0,0]=4 102 B13R1.90 CC(C)COc1ccccc1C=O Amb6335920 [1,0,0,0,0,0|3,0,0]=4 103 B13R1.90 CC(C)COc1ccccc1CBr Amb8835554 [1,0,0,0,0,0|3,0,0]=4 104 B13R1.90 CC(C)COc1ccccc1CN Amb1140371 [1,0,0,0,0,0|3,0,0]=4 105 B13R1.90 CC(C)COc1ccccc1CO Amb6706313 [1,0,0,0,0,0|3,0,0]=4 106 B13R1.90 CC(O)CCc1ccccc1C#N Amb33314664 [1,0,0,0,0,0|3,0,0]=4 107 B13R1.90 CC(O)CNc1ccccc1C#N Amb9246993 [1,0,0,0,0,0|3,0,0]=4 108 B13R1.90 CC(O)CNc1ccccc1CN Amb5786776 [1,0,0,0,0,0|3,0,0]=4 109 B13R1.90 CC(O)COc1ccccc1CN Amb18304085 [1,0,0,0,0,0|2,0,0]=3 110 B13R1.90 CC(O)COc1ccccc1CN Amb33548182 [1,0,0,0,0,0|2,0,0]=3 111 B13R1.90 CCc1ccccc1CCC(C)N Amb33474276 [1,0,0,0,0,0|3,0,0]=4 112 B13R1.90 CCc1ccccc1CCC(C)O Amb32953763 [1,0,0,0,0,0|2,0,0]=3 113 B13R1.90 CCc1ccccc1CC[C@@H](C)N Amb33449220 [1,0,0,0,0,0|3,0,0]=4 114 B13R1.90 CCc1ccccc1CC[C@@H](C)O Amb33198991 [1,0,0,0,0,0|2,0,0]=3 115 B13R1.90 CCc1ccccc1CC[C@H](C)N Amb32954758 [1,0,0,0,0,0|3,0,0]=4 116 B13R1.90 CCc1ccccc1CC[C@H](C)O Amb33198992 [1,0,0,0,0,0|2,0,0]=3 117 B13R1.90 CCc1ccccc1NCC(C)C Amb6698937 [1,0,0,0,0,0|3,0,0]=4 118 B13R1.90 CCc1ccccc1NCC(C)O Amb17138928 [1,0,0,0,0,0|2,0,0]=3 119 B13R1.90 CCc1ccccc1OCC(=O)O Amb1102823 [1,0,0,0,0,0|1,0,2]=4 120 B13R1.90 CCc1ccccc1OCC(C)N Amb8867407 [1,0,0,0,0,0|2,0,0]=3 121 B13R1.90 CCc1ccccc1OC[C@@H](C)N Amb18035943 [1,0,0,0,0,0|2,0,0]=3 122 B13R1.90 CNc1ccccc1OCC(=O)O Amb27256911 [1,0,0,0,0,0|1,0,2]=4 123 B13R1.90 CNc1ccccc1OCC(C)C Amb18316375 [1,0,0,0,0,0|2,0,0]=3 124 B13R1.90 COc1ccccc1CCC(=O)O Amb1209239 [1,0,0,0,0,0|1,0,2]=4 125 B13R1.90 COc1ccccc1CCC(C)=O Amb17400663 [1,0,0,0,0,0|1,0,2]=4 126 B13R1.90 COc1ccccc1CCC(C)N Amb17507289 [1,0,0,0,0,0|2,0,0]=3 127 B13R1.90 COc1ccccc1CCC(C)O Amb17507225 [1,0,0,0,0,0|1,0,0]=2 128 B13R1.90 COc1ccccc1CCN(C)N Amb18564139 [1,0,0,0,0,0|3,0,0]=4 129 B13R1.90 COc1ccccc1CC[C@@H](C)N Amb33359274 [1,0,0,0,0,0|2,0,0]=3 130 B13R1.90 COc1ccccc1CC[C@@H](C)O Amb33362085 [1,0,0,0,0,0|1,0,0]=2 131 B13R1.90 COc1ccccc1CC[C@H](C)N Amb33359070 [1,0,0,0,0,0|2,0,0]=3 132 B13R1.90 COc1ccccc1CC[C@H](C)O Amb33362086 [1,0,0,0,0,0|1,0,0]=2 133 B13R1.90 COc1ccccc1CNC(C)C Amb2118521 [1,0,0,0,0,0|3,0,0]=4 134 B13R1.90 COc1ccccc1CNC(C)C Amb838822 [1,0,0,0,0,0|3,0,0]=4 135 B13R1.90 COc1ccccc1NCC(=O)O Amb840516 [1,0,0,0,0,0|1,0,2]=4 136 B13R1.90 COc1ccccc1NCC(C)=O Amb25214659 [1,0,0,0,0,0|1,0,2]=4 137 B13R1.90 COc1ccccc1NCC(C)C Amb6688337 [1,0,0,0,0,0|2,0,0]=3 138 B13R1.90 COc1ccccc1NCC(C)O Amb17139006 [1,0,0,0,0,0|1,0,0]=2 139 B13R1.90 COc1ccccc1NC[C@H](C)O Amb27878467 [1,0,0,0,0,0|1,0,0]=2 140 B13R1.90 COc1ccccc1OCC(=N)N Amb2721929 [1,0,0,0,0,0|2,0,1]=4 141 B13R1.90 COc1ccccc1OCC(=N)N Amb8626916 [1,0,0,0,0,0|2,0,1]=4 142 B13R1.90 COc1ccccc1OCC(=O)Cl Amb4461056 [1,0,0,0,0,0|1,0,2]=4 143 B13R1.90 COc1ccccc1OCC(=O)O Amb6335348 [1,0,0,0,0,0|0,0,2]=3 144 B13R1.90 COc1ccccc1OCC(=O)[O-] Amb6350061 [1,0,0,0,0,0|0,0,3]=4 145 B13R1.90 COc1ccccc1OCC(C)=O Amb3940654 [1,0,0,0,0,0|0,0,2]=3 146 B13R1.90 COc1ccccc1OCC(C)N Amb10609793 [1,0,0,0,0,0|1,0,0]=2 147 B13R1.90 COc1ccccc1OCC(C)N Amb9756360 [1,0,0,0,0,0|1,0,0]=2 148 B13R1.90 COc1ccccc1OCC(C)O Amb18187074 [1,0,0,0,0,0|0,0,0]=1 149 B13R1.90 COc1ccccc1OCC(N)=O Amb6346006 [1,0,0,0,0,0|1,0,2]=4 150 B13R1.90 COc1ccccc1OCC(N)=S Amb6270225 [1,0,0,0,0,0|1,1,1]=4 151 B13R1.90 COc1ccccc1OC[C@@H](C)N Amb18035955 [1,0,0,0,0,0|1,0,0]=2 152 B13R1.90 COc1ccccc1SCC(=O)O Amb5761739 [1,0,0,0,0,0|0,1,2]=4 153 B13R1.90 COc1ccccc1SCC(C)=O Amb18318076 [1,0,0,0,0,0|0,1,2]=4 154 B13R1.90 COc1ccccc1\C=C/C(C)C Amb22546751 [1,0,0,0,0,0|2,0,1]=4 155 B13R1.90 COc1ccccc1\C=C\B(O)O Amb27608751 [1,0,0,0,0,0|2,0,1]=4 156 B13R1.90 COc1ccccc1\C=C\C(C)N Amb33450168 [1,0,0,0,0,0|2,0,1]=4 157 B13R1.90 COc1ccccc1\C=C\C(C)O Amb27604726 [1,0,0,0,0,0|1,0,1]=3 158 B13R1.90 COc1cccnc1CCC(C)N Amb33359067 [1,0,0,0,0,0|3,0,0]=4 159 B13R1.90 COc1cccnc1CCC(C)O Amb33358329 [1,0,0,0,0,0|2,0,0]=3 160 B13R1.90 COc1cccnc1CC[C@@H](C)N Amb33272864 [1,0,0,0,0,0|3,0,0]=4 161 B13R1.90 COc1cccnc1CC[C@@H](C)O Amb33272995 [1,0,0,0,0,0|2,0,0]=3 162 B13R1.90 COc1cccnc1CC[C@H](C)N Amb33272863 [1,0,0,0,0,0|3,0,0]=4 163 B13R1.90 COc1cccnc1CC[C@H](C)O Amb33272996 [1,0,0,0,0,0|2,0,0]=3 164 B13R1.90 COc1cccnc1NCC(C)Cl Amb27390295 [1,0,0,0,0,0|3,0,0]=4 165 B13R1.90 COc1cccnc1OCC(=O)O Amb24068925 [1,0,0,0,0,0|1,0,2]=4 166 B13R1.90 COc1ncccc1CCC(C)N Amb32954212 [1,0,0,0,0,0|3,0,0]=4 167 B13R1.90 COc1ncccc1CCC(C)O Amb33480790 [1,0,0,0,0,0|2,0,0]=3 168 B13R1.90 COc1ncccc1CC[C@@H](C)N Amb33358242 [1,0,0,0,0,0|3,0,0]=4 169 B13R1.90 COc1ncccc1CC[C@@H](C)O Amb33358245 [1,0,0,0,0,0|2,0,0]=3 170 B13R1.90 COc1ncccc1CC[C@H](C)N Amb33358241 [1,0,0,0,0,0|3,0,0]=4 171 B13R1.90 COc1ncccc1CC[C@H](C)O Amb33358246 [1,0,0,0,0,0|2,0,0]=3 172 B13R1.90 COc1ncccc1NCC(C)C Amb9587627 [1,0,0,0,0,0|3,0,0]=4 173 B13R1.90 COc1ncccc1OCC(=O)O Amb33378289 [1,0,0,0,0,0|1,0,2]=4 174 B13R1.90 COc1nccnc1NCC(C)O Amb27769679 [1,0,0,0,0,0|3,0,0]=4 175 B13R1.90 CSc1ccccc1CCC(C)N Amb33223792 [1,0,0,0,0,0|2,1,0]=4 176 B13R1.90 CSc1ccccc1CCC(C)O Amb33465850 [1,0,0,0,0,0|1,1,0]=3 177 B13R1.90 CSc1ccccc1CC[C@@H](C)N Amb33449930 [1,0,0,0,0,0|2,1,0]=4 178 B13R1.90 CSc1ccccc1CC[C@@H](C)O Amb33465848 [1,0,0,0,0,0|1,1,0]=3 179 B13R1.90 CSc1ccccc1CC[C@H](C)N Amb33358733 [1,0,0,0,0,0|2,1,0]=4 180 B13R1.90 CSc1ccccc1CC[C@H](C)O Amb33465849 [1,0,0,0,0,0|1,1,0]=3 181 B13R1.90 CSc1ccccc1NCC(C)C Amb9548857 [1,0,0,0,0,0|2,1,0]=4 182 B13R1.90 CSc1ccccc1NC[C@H](C)O Amb28078027 [1,0,0,0,0,0|1,1,0]=3 183 B13R1.90 CSc1ccccc1OCC(=O)O Amb6752027 [1,0,0,0,0,0|0,1,2]=4 184 B13R1.90 C[C@@H](N)COc1ccccc1C#N Amb35714362 [1,0,0,0,0,0|3,0,0]=4 185 B13R1.90 C[C@@H](O)CCc1ccccc1C#N Amb33314661 [1,0,0,0,0,0|3,0,0]=4 186 B13R1.90 C[C@H](N)COc1ccccc1C#N Amb35714361 [1,0,0,0,0,0|3,0,0]=4 187 B13R1.90 C[C@H](O)CCc1ccccc1C#N Amb33314662 [1,0,0,0,0,0|3,0,0]=4 188 B13R1.90 C[C@H](O)COc1ccccc1C#N Amb28382816 [1,0,0,0,0,0|2,0,0]=3 189 B13R1.528 CC(CN)COc1ccccc1Br Amb9392446 [1,0,0,0,0,0|3,0,0]=4 190 B13R1.528 CC(CN)COc1ccccc1Cl Amb9392560 [1,0,0,0,0,0|3,0,0]=4 191 B13R1.528 CC(CN)COc1ccccc1F Amb9029281 [1,0,0,0,0,0|3,0,0]=4 192 B13R1.528 CC(CO)CNc1ccccc1N Amb28381615 [1,0,0,0,0,0|3,0,0]=4 193 B13R1.528 CC(CO)COc1ccccc1Br Amb17257491 [1,0,0,0,0,0|2,0,0]=3 194 B13R1.528 CC(CO)COc1ccccc1Cl Amb17237188 [1,0,0,0,0,0|2,0,0]=3 195 B13R1.528 CC(CO)COc1ccccc1F Amb17234069 [1,0,0,0,0,0|2,0,0]=3 196 B13R1.528 CC(CO)NCc1ccccc1O Amb9359816 [1,0,0,0,0,0|3,0,0]=4 197 B13R1.528 CCC(C)CNc1ccccc1C Amb6620312 [1,0,0,0,0,0|3,0,0]=4 198 B13R1.528 CCC(F)CNc1ccccc1C Amb27853057 [1,0,0,0,0,0|3,0,0]=4 199 B13R1.528 CCC(N)COc1ccccc1Cl Amb18332680 [1,0,0,0,0,0|3,0,0]=4 200 B13R1.528 CCC(N)COc1ccccc1Cl Amb32662253 [1,0,0,0,0,0|3,0,0]=4 201 B13R1.528 CCC(N)COc1ccccc1F Amb18328168 [1,0,0,0,0,0|3,0,0]=4 202 B13R1.528 CCC(N)COc1ccccc1F Amb19351287 [1,0,0,0,0,0|3,0,0]=4 203 B13R1.528 CCC(O)CNc1ccccc1C Amb18304030 [1,0,0,0,0,0|2,0,0]=3 204 B13R1.528 CCC(O)CNc1ccncc1C Amb28369252 [1,0,0,0,0,0|3,0,0]=4 205 B13R1.528 CC[C@@H](O)C#Cc1ccccc1C Amb27801558 [1,0,0,0,0,0|2,0,1]=4 206 B13R1.528 CC[C@@H](O)CNc1ccccc1Br Amb28365055 [1,0,0,0,0,0|3,0,0]=4 207 B13R1.528 CC[C@@H](O)CNc1ccccc1C Amb27659614 [1,0,0,0,0,0|2,0,0]=3 208 B13R1.528 CC[C@@H](O)CNc1ccccc1F Amb27854398 [1,0,0,0,0,0|3,0,0]=4 209 B13R1.528 CC[C@@H](O)CNc1ccccc1I Amb28200230 [1,0,0,0,0,0|3,0,0]=4 210 B13R1.528 CC[C@H](O)CNc1ccccc1Br Amb28382805 [1,0,0,0,0,0|3,0,0]=4 211 B13R1.528 CC[C@H](O)CNc1ccccc1C Amb27188363 [1,0,0,0,0,0|2,0,0]=3 212 B13R1.528 C[C@H](CO)\N=C\c1ccccc1O Amb28386624 [1,0,0,0,0,0|3,0,0]=4 213 B13R1.528 C\C(COc1ccccc1O)=N\O Amb27818171 [1,0,0,0,0,0|2,0,1]=4 214 B13R1.528 Cc1ccccc1CCC(=O)CO Amb18065752 [1,0,0,0,0,0|1,0,2]=4 215 B13R1.528 Cc1ccccc1CCC(N)CO Amb18065850 [1,0,0,0,0,0|2,0,0]=3 216 B13R1.528 Cc1ccccc1CCC(O)CN Amb18065879 [1,0,0,0,0,0|2,0,0]=3 217 B13R1.528 Cc1ccccc1CNC(C)CO Amb9359873 [1,0,0,0,0,0|3,0,0]=4 218 B13R1.528 Cc1ccccc1NCC(O)CCl Amb27179187 [1,0,0,0,0,0|2,0,0]=3 219 B13R1.528 Cc1ccccc1NCC(O)CF Amb25965638 [1,0,0,0,0,0|2,0,0]=3 220 B13R1.528 Cc1ccccc1NCC(O)CN Amb17138993 [1,0,0,0,0,0|2,0,0]=3 221 B13R1.528 Cc1ccccc1OCC(=O)CCl Amb17139728 [1,0,0,0,0,0|1,0,2]=4 222 B13R1.528 Cc1ccccc1OCC(=O)CO Amb18065910 [1,0,0,0,0,0|0,0,2]=3 223 B13R1.528 Cc1ccccc1OCC(C)C#N Amb8868636 [1,0,0,0,0,0|2,0,1]=4 224 B13R1.528 Cc1ccccc1OCC(C)CN Amb9029313 [1,0,0,0,0,0|2,0,0]=3 225 B13R1.528 Cc1ccccc1OCC(C)CO Amb17233714 [1,0,0,0,0,0|1,0,0]=2 226 B13R1.528 Cc1ccccc1OCC(C)NN Amb18065972 [1,0,0,0,0,0|3,0,0]=4 227 B13R1.528 Cc1ccccc1OCC(N)C#N Amb17076556 [1,0,0,0,0,0|2,0,1]=4 228 B13R1.528 Cc1ccccc1OCC(N)CO Amb18564170 [1,0,0,0,0,0|1,0,0]=2 229 B13R1.528 Cc1ccccc1OCC(O)CN Amb1124687 [1,0,0,0,0,0|1,0,0]=2 230 B13R1.528 Cc1ccccc1OCC(O)CN Amb35753655 [1,0,0,0,0,0|1,0,0]=2 231 B13R1.528 Cc1ccccc1OCC(O)CO Amb6357560 [1,0,0,0,0,0|0,0,0]=1 232 B13R1.528 Cc1ccccc1SCC(C)CCl Amb32670802 [1,0,0,0,0,0|2,1,0]=4 233 B13R1.528 Cc1cccnc1SCC(O)CF Amb33220453 [1,0,0,0,0,0|2,1,0]=4 234 B13R1.528 Cc1cnccc1NCC(O)CN Amb27431800 [1,0,0,0,0,0|3,0,0]=4 235 B13R1.528 Cc1cnccc1NCC(O)CO Amb27668563 [1,0,0,0,0,0|2,0,0]=3 236 B13R1.528 Cc1nccnc1NCC(O)CO Amb27772739 [1,0,0,0,0,0|3,0,0]=4 237 B13R1.528 NC(CO)CCc1ccccc1Br Amb18071604 [1,0,0,0,0,0|3,0,0]=4 238 B13R1.528 NC(CO)CCc1ccccc1Cl Amb18066512 [1,0,0,0,0,0|3,0,0]=4 239 B13R1.528 NC(CO)CCc1ccccc1F Amb18066104 [1,0,0,0,0,0|3,0,0]=4 240 B13R1.528 NC(CO)CNc1ccccc1Cl Amb28118423 [1,0,0,0,0,0|3,0,0]=4 241 B13R1.528 NC(CO)COc1ccccc1Br Amb18579699 [1,0,0,0,0,0|2,0,0]=3 242 B13R1.528 NC(CO)COc1ccccc1Cl Amb18566446 [1,0,0,0,0,0|2,0,0]=3 243 B13R1.528 NC(CO)COc1ccccc1F Amb18066160 [1,0,0,0,0,0|2,0,0]=3 244 B13R1.528 NCC(O)CCc1ccccc1Br Amb18155749 [1,0,0,0,0,0|3,0,0]=4 245 B13R1.528 NCC(O)CCc1ccccc1Cl Amb18066529 [1,0,0,0,0,0|3,0,0]=4 246 B13R1.528 NCC(O)CNc1ccccc1Br Amb9802654 [1,0,0,0,0,0|3,0,0]=4 247 B13R1.528 NCC(O)CNc1ccccc1Cl Amb9802655 [1,0,0,0,0,0|3,0,0]=4 248 B13R1.528 NCC(O)CNc1ccccc1F Amb17139089 [1,0,0,0,0,0|3,0,0]=4 249 B13R1.528 NCC(O)COc1ccccc1Br Amb9722749 [1,0,0,0,0,0|2,0,0]=3 250 B13R1.528 NCC(O)COc1ccccc1Cl Amb1128690 [1,0,0,0,0,0|2,0,0]=3 251 B13R1.528 Nc1ccccc1NCC(O)CCl Amb18653417 [1,0,0,0,0,0|3,0,0]=4 252 B13R1.528 Nc1ccccc1NCC(O)CO Amb28143482 [1,0,0,0,0,0|2,0,0]=3 253 B13R1.528 Nc1ccccc1OCC(O)CF Amb33495434 [1,0,0,0,0,0|2,0,0]=3 254 B13R1.528 Nc1ccccc1SCC(O)CF Amb33219925 [1,0,0,0,0,0|2,1,0]=4 255 B13R1.528 O=C(CO)COc1ccccc1Br Amb18072010 [1,0,0,0,0,0|1,0,2]=4 256 B13R1.528 O=C(CO)COc1ccccc1Cl Amb18566284 [1,0,0,0,0,0|1,0,2]=4 257 B13R1.528 O=C(CO)COc1ccccc1F Amb18564273 [1,0,0,0,0,0|1,0,2]=4 258 B13R1.528 O=C(COc1ccccc1O)NO Amb1332070 [1,0,0,0,0,0|1,0,2]=4 259 B13R1.528 OC(CF)CNc1ccccc1Br Amb26021493 [1,0,0,0,0,0|3,0,0]=4 260 B13R1.528 OC(CF)CNc1ccccc1Cl Amb25943357 [1,0,0,0,0,0|3,0,0]=4 261 B13R1.528 OC(CF)CNc1ccccc1F Amb26447631 [1,0,0,0,0,0|3,0,0]=4 262 B13R1.528 OC(CF)CNc1ccccc1I Amb26409626 [1,0,0,0,0,0|3,0,0]=4 263 B13R1.528 OCC(O)CNc1ccccc1Cl Amb17337707 [1,0,0,0,0,0|2,0,0]=3 264 B13R1.528 OCC(O)CNc1ccccc1F Amb17335735 [1,0,0,0,0,0|2,0,0]=3 265 B13R1.528 OCC(O)CNc1ccccc1O Amb27642316 [1,0,0,0,0,0|1,0,0]=2 266 B13R1.528 OCC(O)CNc1ccncc1Br Amb27665572 [1,0,0,0,0,0|3,0,0]=4 267 B13R1.528 OCC(O)CNc1ccncc1Cl Amb27415867 [1,0,0,0,0,0|3,0,0]=4 268 B13R1.528 OCC(O)CNc1ccncc1F Amb30020368 [1,0,0,0,0,0|3,0,0]=4 269 B13R1.528 OCC(O)CNc1ncccc1Br Amb28280169 [1,0,0,0,0,0|3,0,0]=4 270 B13R1.528 OCC(O)CNc1ncccc1F Amb27668564 [1,0,0,0,0,0|3,0,0]=4 271 B13R1.528 OC[C@@H](O)CNc1ccccc1Cl Amb27480195 [1,0,0,0,0,0|2,0,0]=3 272 B13R1.528 [O-]CC(O)COc1ccccc1F Amb24113409 [1,0,0,0,0,0|1,0,1]=3 273 B15R1.87 COc1ccccc1CCC(C)C(=O)O Amb17239744 [0,1,0,0,0,0|2,0,1]=4 274 B15R1.87 COc1ccccc1CCC(N)C(=O)O Amb17471347 [0,1,0,0,0,0|2,0,1]=4 275 B15R1.87 COc1ccccc1CC[C@@H](C)C(=O)O Amb33727256 [0,1,0,0,0,0|2,0,1]=4 276 B15R1.87 COc1ccccc1CC[C@@H](N)C(=O)O Amb34158244 [0,1,0,0,0,0|2,0,1]=4 277 B15R1.87 COc1ccccc1CC[C@H](C)C(=O)O Amb33744637 [0,1,0,0,0,0|2,0,1]=4 278 B15R1.87 COc1ccccc1CC[C@H](N)C(=O)O Amb34913211 [0,1,0,0,0,0|2,0,1]=4 279 B15R1.87 COc1ccccc1OCC(N)C(C)C Amb17110160 [0,1,0,0,0,0|2,0,0]=3 280 B15R1.87 COc1ccccc1OCC(O)C(=O)O Amb24061246 [0,1,0,0,0,0|0,0,1]=2 281 B15R1.273 C=CCc1ccccc1OCC(O)CN Amb1058546 [0,1,0,0,0,0|2,0,1]=4 282 B15R1.273 CCOc1ccccc1CNC(C)CO Amb9359880 [0,1,0,0,0,0|3,0,0]=4 283 B15R1.273 CCOc1ccccc1NCC(C)CC Amb6622859 [0,1,0,0,0,0|3,0,0]=4 284 B15R1.768 CCCC(C)CNc1ccccc1OC Amb6630032 [0,1,0,0,0,0|3,0,0]=4 285 B15R1.768 CCOC(=O)COc1ccccc1OC Amb6357791 [0,1,0,0,0,0|1,0,2]=4 286 B15R1.768 CNCC(O)COc1ccccc1OC Amb6678605 [0,1,0,0,0,0|1,0,0]=2 287 B15R1.768 COCC(=O)CSc1ccccc1OC Amb32683194 [0,1,0,0,0,0|0,1,2]=4 288 B15R1.768 COCC(C)NCc1ccccc1OC Amb9733746 [0,1,0,0,0,0|3,0,0]=4 289 B15R1.768 COCC(O)CNc1ccccc1OC Amb2722099 [0,1,0,0,0,0|1,0,0]=2 290 B15R1.768 COc1ccccc1CCN(C)CCO Amb17339372 [0,1,0,0,0,0|3,0,0]=4 291 B15R1.1108 CC(=O)c1ccccc1OCC(O)CO Amb18092927 [0,1,0,0,0,0|1,0,0]=2 292 B15R1.1108 CC(C)c1ccccc1OCC(O)CN Amb1128287 [0,1,0,0,0,0|2,0,0]=3 293 B15R1.1108 CC(C)c1ccccc1OCC(O)CN Amb1420283 [0,1,0,0,0,0|2,0,0]=3 294 B15R1.1146 CCC(CC)CNc1ccccc1OC Amb6688343 [0,1,0,0,0,0|3,0,0]=4 295 B15R1.1146 CCC(CO)NCc1ccccc1OC Amb838318 [0,1,0,0,0,0|3,0,0]=4 296 B15R1.1146 COc1ccccc1CNC(CO)CO Amb33363020 [0,1,0,0,0,0|2,0,0]=3 297 B15R1.1146 COc1ccccc1SCC(OC)OC Amb32683140 [0,1,0,0,0,0|2,1,0]=4 298 B15R1.1147 CCC(C)C(C)Nc1ccccc1OC Amb6624410 [0,1,0,0,0,0|3,0,0]=4 299 B15R1.1147 COc1ccccc1CC(C)C(C)CN Amb33746142 [0,1,0,0,0,0|3,0,0]=4 300 B15R1.1147 COc1ccccc1CC(C)C(C)CO Amb33748707 [0,1,0,0,0,0|2,0,0]=3 301 B15R1.1147 COc1ccccc1CC(C)[C@@H](C)CN Amb33727837 [0,1,0,0,0,0|3,0,0]=4 302 B15R1.1147 COc1ccccc1CC(C)[C@@H](C)CO Amb33746879 [0,1,0,0,0,0|2,0,0]=3 303 B15R1.1147 COc1ccccc1CC(C)[C@H](C)CN Amb33726988 [0,1,0,0,0,0|3,0,0]=4 304 B15R1.1147 COc1ccccc1CC(C)[C@H](C)CO Amb33730880 [0,1,0,0,0,0|2,0,0]=3 305 B15R1.4545 COc1ccccc1CNC(C)(C)CO Amb6455810 [0,1,0,0,0,0|3,0,0]=4 306 B15R1.4545 COc1ccccc1NCC(C)(C)CO Amb18933284 [0,1,0,0,0,0|2,0,0]=3 307 B15R1.4545 COc1ccccc1OCC(C)(C)C#N Amb17238403 [0,1,0,0,0,0|2,0,1]=4 308 B15R1.12623 COc1ccccc1C(=O)NC(C)CO Amb9275922 [0,1,0,0,0,0|3,0,0]=4 309 B15R1.12623 COc1ccccc1C(C)NC(C)CO Amb9359802 [0,1,0,0,0,0|3,0,0]=4 310 B15R1.12847 CCC(C)CNc1cc(C)ccc1OC Amb6611954 [0,1,0,0,0,0|3,0,0]=4 311 B15R1.12847 COc1ccc(Br)cc1CNC(C)CO Amb9359570 [0,1,0,0,0,0|3,0,0]=4 312 B15R1.13065 COc1cc(C)ccc1OCC(C)C#N Amb8868646 [0,1,0,0,0,0|2,0,1]=4 313 B15R1.13065 COc1cc(C)ccc1OCC(N)C#N Amb17076597 [0,1,0,0,0,0|2,0,1]=4 314 B15R2.4 CC(CBr)CC1COc2ccccc21 Amb27873120 [0,0,0,1,0,0|3,0,0]=4 315 B15R2.4 CC(CN)CC1COc2ccccc21 Amb27402299 [0,0,0,1,0,0|3,0,0]=4 316 B15R2.4 CC(CO)CC1CCc2ccccc21 Amb33745867 [0,0,0,1,0,0|3,0,0]=4 317 B15R2.4 CC(CO)CC1COc2ccccc21 Amb27488022 [0,0,0,1,0,0|2,0,0]=3 318 B15R2.4 CC(CO)CC1CSc2ccccc21 Amb27966622 [0,0,0,1,0,0|2,1,0]=4 319 B15R2.4 CC(CO)Cc1coc2ccccc12 Amb35704264 [0,0,0,1,0,0|2,0,1]=4 320 B15R2.4 CCC(O)CC1CNc2ccccc21 Amb35624752 [0,0,0,1,0,0|3,0,0]=4 321 B15R2.4 C[C@@H](CO)CC1CCc2ccccc21 Amb33747163 [0,0,0,1,0,0|3,0,0]=4 322 B15R2.4 C[C@H](CO)CC1CCc2ccccc21 Amb33744412 [0,0,0,1,0,0|3,0,0]=4 323 B15R2.4 NC(CO)CC1CCc2ccccc21 Amb33145749 [0,0,0,1,0,0|3,0,0]=4 324 B15R2.4 NCC(O)CC1CCc2ccccc21 Amb33145081 [0,0,0,1,0,0|3,0,0]=4 325 B15R2.4 NCC(O)CN1CCc2ccccc21 Amb1134116 [0,0,0,1,0,0|3,0,0]=4 326 B15R2.4 NC[C@H](O)CN1CCc2ccccc21 Amb28363847 [0,0,0,1,0,0|3,0,0]=4 327 B15R2.4 OC(CCl)CN1CCc2ccccc21 Amb27172813 [0,0,0,1,0,0|3,0,0]=4 328 B15R2.4 OC(CCl)Cc1coc2ccccc12 Amb35704122 [0,0,0,1,0,0|2,0,1]=4 329 B15R2.4 OCC(O)CN1CCc2ccccc21 Amb754827 [0,0,0,1,0,0|2,0,0]=3 330 B15R2.4 OCC(O)Cn1ccc2ccccc21 Amb17594991 [0,0,0,1,0,0|2,0,1]=4 331 B15R2.128 O=C1OC(CO)COc2ccccc21 Amb28192337 [0,0,0,1,0,0|2,0,0]=3 332 B15R2.1158 O[C@H]1COc2ccccc2OC[C@H]1O Amb27757377 [0,0,0,1,0,0|0,0,0]=1 333 B15R2.1592 CCC(O)C1Cc2ccccc2C1C Amb35629752 [0,0,0,1,0,0|3,0,0]=4 334 B15R2.1592 Cc1c(C(N)CO)oc2ccccc12 Amb24671227 [0,0,0,1,0,0|2,0,1]=4 335 B15R2.1592 Cc1c(C(O)CBr)oc2ccccc12 Amb33336035 [0,0,0,1,0,0|2,0,1]=4 336 B15R2.1592 Cc1c(C(O)CCl)oc2ccccc12 Amb24521397 [0,0,0,1,0,0|2,0,1]=4 337 B15R2.1592 Cc1c(C(O)CF)oc2ccccc12 Amb33373359 [0,0,0,1,0,0|2,0,1]=4 338 B15R2.1592 Cc1c(C(O)CN)oc2ccccc12 Amb33424927 [0,0,0,1,0,0|2,0,1]=4 339 B15R2.1592 Cc1c(C(O)CO)oc2ccccc12 Amb33373361 [0,0,0,1,0,0|1,0,1]=3 340 B15R2.1592 Cc1c([C@@H](N)CO)oc2ccccc12 Amb28184168 [0,0,0,1,0,0|2,0,1]=4 341 B15R2.1592 Cc1c([C@@H](O)CN)oc2ccccc12 Amb33373664 [0,0,0,1,0,0|2,0,1]=4 342 B15R2.1592 Cc1c([C@H](N)CO)oc2ccccc12 Amb25878122 [0,0,0,1,0,0|2,0,1]=4 343 B15R2.1592 Cc1c([C@H](O)CCl)oc2ccccc12 Amb27387634 [0,0,0,1,0,0|2,0,1]=4 344 B15R2.1592 Cc1c([C@H](O)CN)oc2ccccc12 Amb33225540 [0,0,0,1,0,0|2,0,1]=4 345 B15R2.1592 Cn1c(C(O)CO)cc2ccccc21 Amb22900984 [0,0,0,1,0,0|2,0,1]=4 346 B15R2.1601 C#CC(C)C1COc2ccccc2O1 Amb33320850 [0,0,0,1,0,0|2,0,1]=4 347 B15R2.1601 C#CC(O)C1CNc2ccccc2O1 Amb29875612 [0,0,0,1,0,0|2,0,1]=4 348 B15R2.1601 C#CC(O)C1COc2ccccc2O1 Amb27452114 [0,0,0,1,0,0|1,0,1]=3 349 B15R2.1601 C#C[C@@H](O)C1COc2ccccc2C1 Amb28073680 [0,0,0,1,0,0|2,0,1]=4 350 B15R2.1601 C#C[C@@H](O)C1COc2ccccc2O1 Amb28067593 [0,0,0,1,0,0|1,0,1]=3 351 B15R2.1601 C#C[C@H](O)C1COc2ccccc2C1 Amb28430325 [0,0,0,1,0,0|2,0,1]=4 352 B15R2.1601 C=C(CBr)C1COc2ccccc2O1 Amb33434165 [0,0,0,1,0,0|2,0,1]=4 353 B15R2.1601 C=C(CN)C1COc2ccccc2O1 Amb33320843 [0,0,0,1,0,0|2,0,1]=4 354 B15R2.1601 C=CC(O)C1CNc2ccccc2O1 Amb29875527 [0,0,0,1,0,0|2,0,1]=4 355 B15R2.1601 C=CC(O)C1COc2ccccc2C1 Amb24699870 [0,0,0,1,0,0|2,0,1]=4 356 B15R2.1601 C=CC(O)C1COc2ccccc2O1 Amb26534596 [0,0,0,1,0,0|1,0,1]=3 357 B15R2.1601 CC(C#N)C1COc2ccccc2O1 Amb33321681 [0,0,0,1,0,0|2,0,1]=4 358 B15R2.1601 CC(C=O)C1COc2ccccc2O1 Amb33320846 [0,0,0,1,0,0|1,0,2]=4 359 B15R2.1601 CC(CBr)C1COc2ccccc2C1 Amb33431629 [0,0,0,1,0,0|3,0,0]=4 360 B15R2.1601 CC(CBr)C1COc2ccccc2O1 Amb33434180 [0,0,0,1,0,0|2,0,0]=3 361 B15R2.1601 CC(CN)C1COc2ccccc2C1 Amb33424070 [0,0,0,1,0,0|3,0,0]=4 362 B15R2.1601 CC(CN)C1COc2ccccc2O1 Amb33321687 [0,0,0,1,0,0|2,0,0]=3 363 B15R2.1601 CC(CO)C1C=Cc2ccccc2O1 Amb28318478 [0,0,0,1,0,0|2,0,1]=4 364 B15R2.1601 CC(CO)C1CCc2ccccc2C1 Amb33748706 [0,0,0,1,0,0|3,0,0]=4 365 B15R2.1601 CC(CO)C1COc2ccccc2O1 Amb33749205 [0,0,0,1,0,0|1,0,0]=2 366 B15R2.1601 CC(CO)N1COc2ccccc2C1 Amb27857592 [0,0,0,1,0,0|3,0,0]=4 367 B15R2.1601 CC(ON)C1COc2ccccc2O1 Amb33321159 [0,0,0,1,0,0|3,0,0]=4 368 B15R2.1601 CCC(=O)C1COc2ccccc2O1 Amb27624373 [0,0,0,1,0,0|1,0,2]=4 369 B15R2.1601 CCC(Cl)C1COc2ccccc2C1 Amb27847379 [0,0,0,1,0,0|3,0,0]=4 370 B15R2.1601 CCC(O)C1CCc2ccccc2C1 Amb28184178 [0,0,0,1,0,0|3,0,0]=4 371 B15R2.1601 CCC(O)C1CNc2ccccc2O1 Amb29875568 [0,0,0,1,0,0|2,0,0]=3 372 B15R2.1601 CCC(O)C1CSc2ccccc2O1 Amb27226228 [0,0,0,1,0,0|1,1,0]=3 373 B15R2.1601 CC[C@@H](O)C1CCc2ccccc2C1 Amb27612789 [0,0,0,1,0,0|3,0,0]=4 374 B15R2.1601 CC[C@@H](O)C1COc2ccccc2C1 Amb27585766 [0,0,0,1,0,0|2,0,0]=3 375 B15R2.1601 CC[C@@H](O)C1COc2ccccc2O1 Amb27585765 [0,0,0,1,0,0|1,0,0]=2 376 B15R2.1601 CC[C@H](N)C1COc2ccccc2O1 Amb28199453 [0,0,0,1,0,0|2,0,0]=3 377 B15R2.1601 CNC(C)C1COc2ccccc2O1 Amb10608540 [0,0,0,1,0,0|3,0,0]=4 378 B15R2.1601 C[C@@H](CN)C1COc2ccccc2O1 Amb33728843 [0,0,0,1,0,0|2,0,0]=3 379 B15R2.1601 C[C@@H](CO)C1CCc2ccccc2C1 Amb33746884 [0,0,0,1,0,0|3,0,0]=4 380 B15R2.1601 C[C@@H](CO)C1COc2ccccc2O1 Amb33742937 [0,0,0,1,0,0|1,0,0]=2 381 B15R2.1601 C[C@@H](CO)[C@H]1C=Cc2ccccc2O1 Amb27198044 [0,0,0,1,0,0|2,0,1]=4 382 B15R2.1601 C[C@H](CN)C1COc2ccccc2O1 Amb33730079 [0,0,0,1,0,0|2,0,0]=3 383 B15R2.1601 C[C@H](CO)C1CCc2ccccc2C1 Amb33743119 [0,0,0,1,0,0|3,0,0]=4 384 B15R2.1601 C[C@H](CO)C1COc2ccccc2O1 Amb33739787 [0,0,0,1,0,0|1,0,0]=2 385 B15R2.1601 C\C(=N\O)C1COc2ccccc2O1 Amb27953760 [0,0,0,1,0,0|2,0,1]=4 386 B15R2.1601 N#CC(O)C1CCc2ccccc2O1 Amb28400915 [0,0,0,1,0,0|2,0,1]=4 387 B15R2.1601 N=C(NO)C1COc2ccccc2O1 Amb22274884 [0,0,0,1,0,0|2,0,1]=4 388 B15R2.1601 NC(CO)C1COc2ccccc2C1 Amb33424077 [0,0,0,1,0,0|2,0,0]=3 389 B15R2.1601 NCC(=O)C1COc2ccccc2O1 Amb33322028 [0,0,0,1,0,0|1,0,2]=4 390 B15R2.1601 NCC(F)C1COc2ccccc2C1 Amb33423299 [0,0,0,1,0,0|3,0,0]=4 391 B15R2.1601 NCC(F)C1COc2ccccc2O1 Amb33321167 [0,0,0,1,0,0|2,0,0]=3 392 B15R2.1601 NCC(O)C1COc2ccccc2C1 Amb33424078 [0,0,0,1,0,0|2,0,0]=3 393 B15R2.1601 NCC(O)C1COc2ccccc2O1 Amb24348060 [0,0,0,1,0,0|1,0,0]=2 394 B15R2.1601 NC[C@@H](O)C1=Cc2ccccc2OC1 Amb27753062 [0,0,0,1,0,0|2,0,1]=4 395 B15R2.1601 NC[C@@H](O)C1COc2ccccc2C1 Amb33423544 [0,0,0,1,0,0|2,0,0]=3 396 B15R2.1601 NC[C@@H](O)C1COc2ccccc2O1 Amb33321166 [0,0,0,1,0,0|1,0,0]=2 397 B15R2.1601 NC[C@H](O)C1COc2ccccc2C1 Amb33423545 [0,0,0,1,0,0|2,0,0]=3 398 B15R2.1601 NC[C@H](O)C1COc2ccccc2O1 Amb26845593 [0,0,0,1,0,0|1,0,0]=2 399 B15R2.1601 N[C@@H](CO)C1COc2ccccc2C1 Amb33423194 [0,0,0,1,0,0|2,0,0]=3 400 B15R2.1601 N[C@@H](CO)C1COc2ccccc2O1 Amb33321284 [0,0,0,1,0,0|1,0,0]=2 401 B15R2.1601 N[C@H](CO)C1COc2ccccc2C1 Amb33423543 [0,0,0,1,0,0|2,0,0]=3 402 B15R2.1601 N[C@H](CO)C1COc2ccccc2O1 Amb33321285 [0,0,0,1,0,0|1,0,0]=2 403 B15R2.1601 N\C(=N/O)C1COc2ccccc2O1 Amb2637501 [0,0,0,1,0,0|2,0,1]=4 404 B15R2.1601 N\C(=N\O)[C@@H]1COc2ccccc2O1 Amb28347090 [0,0,0,1,0,0|2,0,1]=4 405 B15R2.1601 O=C(CBr)C1COc2ccccc2O1 Amb24081186 [0,0,0,1,0,0|1,0,2]=4 406 B15R2.1601 O=C(CCl)C1COc2ccccc2O1 Amb22395329 [0,0,0,1,0,0|1,0,2]=4 407 B15R2.1601 OC(CBr)C1COc2ccccc2C1 Amb33431633 [0,0,0,1,0,0|2,0,0]=3 408 B15R2.1601 OC(CBr)C1COc2ccccc2O1 Amb27481397 [0,0,0,1,0,0|1,0,0]=2 409 B15R2.1601 OC(CCl)C1COc2ccccc2O1 Amb27607787 [0,0,0,1,0,0|1,0,0]=2 410 B15R2.1601 OC(CF)C1COc2ccccc2C1 Amb33226123 [0,0,0,1,0,0|2,0,0]=3 411 B15R2.1601 OC(CF)C1COc2ccccc2O1 Amb33320845 [0,0,0,1,0,0|1,0,0]=2 412 B15R2.1601 OCC(O)C1COc2ccccc2C1 Amb33448274 [0,0,0,1,0,0|1,0,0]=2 413 B15R2.1601 OCC(O)C1COc2ccccc2O1 Amb27452073 [0,0,0,1,0,0|0,0,0]=1 414 B15R2.1601 OC[C@@H](O)[C@@H]1CCc2ccccc2O1 Amb27970836 [0,0,0,1,0,0|1,0,0]=2 415 B15R2.1601 [C-]#[N+]C(C)C1COc2ccccc2O1 Amb33321174 [0,0,0,1,0,0|3,0,0]=4 416 B15R2.1775 CCc1cccc2c1OCC(C)CN2 Amb17570603 [0,0,0,1,0,0|3,0,0]=4 417 B15R2.1775 COc1cccc2c1CCC(F)CN2 Amb27636041 [0,0,0,1,0,0|3,0,0]=4 418 B15R2.1775 COc1cccc2c1OCC(=O)CO2 Amb27668902 [0,0,0,1,0,0|0,0,2]=3 419 B15R2.1919 COc1ccccc1NC2CCC2O Amb31199758 [0,0,0,1,0,0|2,0,0]=3 420 B15R2.1922 CCc1ccccc1CCC2(O)CC2 Amb33079650 [0,0,0,1,0,0|3,0,0]=4 421 B15R2.1922 COc1ccccc1C#CC2(O)CC2 Amb29887961 [0,0,0,1,0,0|2,0,1]=4 422 B15R2.1922 COc1ccccc1CCC2(N)CC2 Amb33475119 [0,0,0,1,0,0|3,0,0]=4 423 B15R2.1922 COc1ccccc1CCC2(O)CC2 Amb33359324 [0,0,0,1,0,0|2,0,0]=3 424 B15R2.1922 COc1cccnc1CCC2(O)CC2 Amb33271571 [0,0,0,1,0,0|3,0,0]=4 425 B15R2.1922 COc1ncccc1CCC2(O)CC2 Amb33378536 [0,0,0,1,0,0|3,0,0]=4 426 B15R2.1922 CSc1ccccc1CCC2(O)CC2 Amb32876715 [0,0,0,1,0,0|2,1,0]=4 427 B15R2.2189 CCc1ccccc1C2CC(N)CO2 Amb35700218 [0,0,0,1,0,0|3,0,0]=4 428 B15R2.2189 CCc1ccccc1C2CC(O)CO2 Amb35700482 [0,0,0,1,0,0|2,0,0]=3 429 B15R2.2189 COc1ccccc1C2=CC(O)CC2 Amb27170237 [0,0,0,1,0,0|2,0,1]=4 430 B15R2.2189 COc1ccccc1C2CC(=O)CO2 Amb35721884 [0,0,0,1,0,0|1,0,2]=4 431 B15R2.2189 COc1ccccc1C2CC(N)CO2 Amb29861294 [0,0,0,1,0,0|2,0,0]=3 432 B15R2.2189 COc1ccccc1C2CC(O)CO2 Amb35700385 [0,0,0,1,0,0|1,0,0]=2 433 B15R2.2189 COc1ccccc1C2CCC(Br)C2 Amb27795627 [0,0,0,1,0,0|3,0,0]=4 434 B15R2.2189 COc1ccccc1N2CCC(N)C2 Amb8010456 [0,0,0,1,0,0|3,0,0]=4 435 B15R2.2189 COc1ccccc1[C@@H]2C[C@H](C)CN2 Amb18818123 [0,0,0,1,0,0|3,0,0]=4 436 B15R2.2189 COc1ccccc1[C@H]2CC[C@@H](N)C2 Amb27852497 [0,0,0,1,0,0|3,0,0]=4 437 B15R2.2189 COc1ccncc1C2CCC(O)C2 Amb28041326 [0,0,0,1,0,0|3,0,0]=4 438 B15R2.2300 COc1ccccc1OCC2CC2N Amb32428746 [0,0,0,1,0,0|2,0,0]=3 439 B15R2.2310 CCC1CNc2c(OC)cccc2O1 Amb33351735 [0,0,0,1,0,0|2,0,0]=3 440 B15R2.2310 CCC1CNc2c(OC)cccc2S1 Amb27872084 [0,0,0,1,0,0|2,1,0]=4 441 B15R2.2310 CCC1CNc2c(cccc2OC)C1 Amb5746030 [0,0,0,1,0,0|3,0,0]=4 442 B15R2.2310 CCc1cccc2c1NCC(CO)C2 Amb5745023 [0,0,0,1,0,0|3,0,0]=4 443 B15R2.2310 CNC1COc2c(cccc2OC)C1 Amb28325040 [0,0,0,1,0,0|3,0,0]=4 444 B15R2.2310 COc1cccc2c1CCC(CN)C2 Amb26604581 [0,0,0,1,0,0|3,0,0]=4 445 B15R2.2310 COc1cccc2c1CCC(CN)O2 Amb26498981 [0,0,0,1,0,0|2,0,0]=3 446 B15R2.2310 COc1cccc2c1CCC(CO)C2 Amb27250782 [0,0,0,1,0,0|2,0,0]=3 447 B15R2.2310 COc1cccc2c1CN[C@@H](CO)C2 Amb28053930 [0,0,0,1,0,0|3,0,0]=4 448 B15R2.2310 COc1cccc2c1CN[C@H](CO)C2 Amb27273238 [0,0,0,1,0,0|3,0,0]=4 449 B15R2.2310 COc1cccc2c1NCC(CN)C2 Amb18817105 [0,0,0,1,0,0|3,0,0]=4 450 B15R2.2310 COc1cccc2c1NCC(CO)C2 Amb5745013 [0,0,0,1,0,0|2,0,0]=3 451 B15R2.2310 COc1cccc2c1OCC(CN)C2 Amb17606148 [0,0,0,1,0,0|2,0,0]=3 452 B15R2.2310 COc1cccc2c1OCC(CN)O2 Amb27746823 [0,0,0,1,0,0|1,0,0]=2 453 B15R2.2310 COc1cccc2c1OCC(CO)=C2 Amb27183672 [0,0,0,1,0,0|1,0,1]=3 454 B15R2.2310 COc1cccc2c1OCC(CO)O2 Amb28410487 [0,0,0,1,0,0|0,0,0]=1 455 B15R2.2310 COc1cccc2c1SCC(CN)C2 Amb18774848 [0,0,0,1,0,0|2,1,0]=4 456 B15R2.2310 CSc1cccc2c1CC[C@H](CO)N2 Amb27174476 [0,0,0,1,0,0|2,1,0]=4 457 B15R2.2310 N#Cc1cccc2c1OCC(CO)O2 Amb27389104 [0,0,0,1,0,0|2,0,0]=3 458 B15R2.4927 COc1ccccc1C2CC(N)C2C Amb27417926 [0,0,0,1,0,0|3,0,0]=4 459 B15R2.4929 COc1ccccc1C2CC(CN)C2 Amb24645244 [0,0,0,1,0,0|3,0,0]=4 460 B15R2.4929 COc1ccccc1C2CC(CO)C2 Amb25937356 [0,0,0,1,0,0|2,0,0]=3 461 B15R2.7343 CC1NCC(O)COc2ccccc21 Amb27791784 [0,0,0,1,0,0|2,0,0]=3 462 B15R2.20918 COc1cccc2c1CCC2(F)CN Amb27667231 [0,0,0,1,0,0|3,0,0]=4 463 B15R2.20918 COc1cccc2c1CCC2(N)CO Amb24441982 [0,0,0,1,0,0|2,0,0]=3 464 B15R2.20918 COc1cccc2c1CCC2(O)CN Amb17088086 [0,0,0,1,0,0|2,0,0]=3 465 B15R2.20918 COc1cccc2c1CC[C@]2(O)CO Amb27594750 [0,0,0,1,0,0|1,0,0]=2 466 B15R2.20926 COc1cccc2c1C=CC(C)C2O Amb28185160 [0,0,0,1,0,0|2,0,1]=4 467 B15R2.20926 COc1cccc2c1C=C[C@@H](C)[C@H]2O Amb28132338 [0,0,0,1,0,0|2,0,1]=4 468 B15R2.20926 COc1cccc2c1CCC(F)C2N Amb32658139 [0,0,0,1,0,0|3,0,0]=4 469 B15R2.20926 COc1cccc2c1CCC(N)C2C Amb18650920 [0,0,0,1,0,0|3,0,0]=4 470 B15R2.20926 COc1cccc2c1CCC(O)C2N Amb22585590 [0,0,0,1,0,0|2,0,0]=3 471 B15R2.20926 COc1cccc2c1CC[C@@H](F)[C@@H]2O Amb27420383 [0,0,0,1,0,0|2,0,0]=3 472 B15R2.20926 COc1cccc2c1CC[C@@H](N)[C@H]2C Amb27781070 [0,0,0,1,0,0|3,0,0]=4 473 B15R2.20926 COc1cccc2c1CC[C@@H](O)[C@H]2O Amb28206066 [0,0,0,1,0,0|1,0,0]=2 474 B15R2.20926 COc1cccc2c1CC[C@H](N)[C@H]2C Amb27206032 [0,0,0,1,0,0|3,0,0]=4 475 B15R2.20926 COc1cccc2c1CC[C@H](N)[C@H]2O Amb27650662 [0,0,0,1,0,0|2,0,0]=3 476 B15R2.20926 COc1cccc2c1NCC(O)C2N Amb26482843 [0,0,0,1,0,0|2,0,0]=3 477 B15R2.20926 COc1cccc2c1OCC(Br)C2=O Amb25098682 [0,0,0,1,0,0|1,0,2]=4 478 B15R2.20926 COc1cccc2c1OCC(C)C2=O Amb9400104 [0,0,0,1,0,0|1,0,2]=4 479 B15R2.20926 COc1cccc2c1OCC(N)C2=O Amb24079244 [0,0,0,1,0,0|1,0,2]=4 480 B15R2.20926 COc1cccc2c1OCC(N)C2=O Amb32653371 [0,0,0,1,0,0|1,0,2]=4 481 B15R2.20926 COc1cccc2c1OCC(O)C2N Amb25099413 [0,0,0,1,0,0|1,0,0]=2 482 B15R2.20926 COc1cccc2c1SCC(O)C2N Amb28350158 [0,0,0,1,0,0|1,1,0]=3 483 B15R2.26610 CC1(CO)COc2ccccc2C1=O Amb10783200 [0,0,0,1,0,0|3,0,0]=4 484 B15R2.26610 C[C@]1(CO)COc2ccccc2C1=O Amb28455565 [0,0,0,1,0,0|3,0,0]=4 485 B15R2.26610 C[C@]1(CO)COc2ccccc2[C@H]1N Amb27230456 [0,0,0,1,0,0|3,0,0]=4 486 B15R2.26653 NCC1(O)COc2ccccc2OC1 Amb22643038 [0,0,0,1,0,0|1,0,0]=2 487 B13R1.91 C#CC(N)Cc1ccccc1OC Amb28185392 [0,0,0,0,1,0|2,0,1]=4 488 B13R1.91 C#CC(O)Cc1ccccc1OC Amb27652110 [0,0,0,0,1,0|1,0,1]=3 489 B13R1.91 C#CC(O)Nc1ccccc1OC Amb27390024 [0,0,0,0,1,0|2,0,1]=4 490 B13R1.91 C#Cc1ccccc1CC(N)CO Amb27203036 [0,0,0,0,1,0|2,0,1]=4 491 B13R1.91 C#Cc1ccccc1CC(O)CN Amb33374203 [0,0,0,0,1,0|2,0,1]=4 492 B13R1.91 CC(CO)Oc1ccccc1C#N Amb27979843 [0,0,0,0,1,0|3,0,0]=4 493 B13R1.91 CCC(=O)Cc1ccccc1OC Amb17477454 [0,0,0,0,1,0|1,0,2]=4 494 B13R1.91 CCC(=O)Oc1ccccc1OC Amb24079979 [0,0,0,0,1,0|1,0,2]=4 495 B13R1.91 CCC(C)Nc1ccccc1OC Amb6688447 [0,0,0,0,1,0|3,0,0]=4 496 B13R1.91 CCc1ccccc1CC(N)CO Amb33200209 [0,0,0,0,1,0|2,0,0]=3 497 B13R1.91 CCc1ccccc1CC(O)CN Amb33198697 [0,0,0,0,1,0|2,0,0]=3 498 B13R1.91 CCc1ccccc1OC(C)CBr Amb17256449 [0,0,0,0,1,0|3,0,0]=4 499 B13R1.91 CCc1ccccc1OC(C)CCl Amb17236886 [0,0,0,0,1,0|3,0,0]=4 500 B13R1.91 CCc1ccccc1OC(C)CO Amb17233721 [0,0,0,0,1,0|2,0,0]=3 501 B13R1.91 CNC(C)Cc1ccccc1OC Amb3940073 [0,0,0,0,1,0|3,0,0]=4 502 B13R1.91 CNC(C)Cc1ccccc1OC Amb6366247 [0,0,0,0,1,0|3,0,0]=4 503 B13R1.91 COc1ccccc1CC(=O)CCl Amb17139726 [0,0,0,0,1,0|1,0,2]=4 504 B13R1.91 COc1ccccc1CC(=O)CO Amb18065904 [0,0,0,0,1,0|0,0,2]=3 505 B13R1.91 COc1ccccc1CC(=O)NO Amb8827858 [0,0,0,0,1,0|1,0,2]=4 506 B13R1.91 COc1ccccc1CC(C)CN Amb5743843 [0,0,0,0,1,0|2,0,0]=3 507 B13R1.91 COc1ccccc1CC(Cl)C#N Amb27484025 [0,0,0,0,1,0|2,0,1]=4 508 B13R1.91 COc1ccccc1CC(N)CO Amb17062691 [0,0,0,0,1,0|1,0,0]=2 509 B13R1.91 COc1ccccc1CC(O)CN Amb17233802 [0,0,0,0,1,0|1,0,0]=2 510 B13R1.91 COc1ccccc1C[C@@H](N)CO Amb30633920 [0,0,0,0,1,0|1,0,0]=2 511 B13R1.91 COc1ccccc1C\C(N)=N\O Amb4157161 [0,0,0,0,1,0|2,0,1]=4 512 B13R1.91 COc1ccccc1NC(=O)CO Amb1111431 [0,0,0,0,1,0|1,0,2]=4 513 B13R1.91 COc1ccccc1OC(=O)CN Amb19115310 [0,0,0,0,1,0|1,0,2]=4 514 B13R1.91 COc1ccccc1OC(C)C#N Amb5780991 [0,0,0,0,1,0|2,0,1]=4 515 B13R1.91 COc1ccccc1OC(C)CBr Amb17257498 [0,0,0,0,1,0|2,0,0]=3 516 B13R1.91 COc1ccccc1OC(C)CCl Amb17237195 [0,0,0,0,1,0|2,0,0]=3 517 B13R1.91 COc1ccccc1OC(C)CN Amb5781303 [0,0,0,0,1,0|2,0,0]=3 518 B13R1.91 COc1ccccc1OC(C)CO Amb17233898 [0,0,0,0,1,0|1,0,0]=2 519 B13R1.91 COc1cccnc1CC(N)CO Amb33267572 [0,0,0,0,1,0|2,0,0]=3 520 B13R1.91 COc1cccnc1CC(O)CN Amb33272166 [0,0,0,0,1,0|2,0,0]=3 521 B13R1.91 COc1ncccc1CC(N)CO Amb33473894 [0,0,0,0,1,0|2,0,0]=3 522 B13R1.91 COc1ncccc1CC(O)CN Amb33378597 [0,0,0,0,1,0|2,0,0]=3 523 B13R1.91 CSc1ccccc1CC(N)CO Amb33473017 [0,0,0,0,1,0|1,1,0]=3 524 B13R1.91 CSc1ccccc1CC(O)CN Amb33149071 [0,0,0,0,1,0|1,1,0]=3 525 B13R1.91 N#Cc1ccccc1CC(N)CO Amb27814940 [0,0,0,0,1,0|3,0,0]=4 526 B13R1.91 N#Cc1ccccc1CC(O)CN Amb33204283 [0,0,0,0,1,0|3,0,0]=4 527 B13R1.91 N#Cc1ccccc1OC(O)CN Amb27482632 [0,0,0,0,1,0|3,0,0]=4 528 B15R1.85 CCC(C)CNCc1ccccc1OC Amb6720131 [0,0,0,0,0,1|3,0,0]=4 529 B15R1.85 CCC(N)COCc1ccccc1OC Amb18631138 [0,0,0,0,0,1|2,0,0]=3 530 B15R1.85 COc1ccccc1CNC[C@@H](O)CO Amb33041851 [0,0,0,0,0,1|1,0,0]=2 531 B12R1.121 C#CCCc1ccccc1OC Amb18636005 [2,0,0,0,0,0|1,0,1]=4 532 B12R1.121 C#CCOc1ccccc1OC Amb18183490 [2,0,0,0,0,0|0,0,2]=4 533 B12R1.121 C#Cc1ccccc1CCCO Amb27978387 [2,0,0,0,0,0|1,0,1]=4 534 B12R1.121 C#Cc1ccccc1OCCC Amb27457126 [2,0,0,0,0,0|1,0,1]=4 535 B12R1.121 C=CCCc1ccccc1OC Amb6299112 [2,0,0,0,0,0|1,0,1]=4 536 B12R1.121 CCC#Cc1ccccc1OC Amb26871828 [2,0,0,0,0,0|1,0,1]=4 537 B12R1.121 CCCNc1ccccc1CC Amb6698992 [2,0,0,0,0,0|2,0,0]=4 538 B12R1.121 CCCNc1ccccc1OC Amb6688440 [2,0,0,0,0,0|1,0,0]=3 539 B12R1.121 CCCNc1cccnc1OC Amb9587834 [2,0,0,0,0,0|2,0,0]=4 540 B12R1.121 CCCNc1ncccc1OC Amb27834220 [2,0,0,0,0,0|2,0,0]=4 541 B12R1.121 CCCOc1ccccc1C=O Amb1033069 [2,0,0,0,0,0|2,0,0]=4 542 B12R1.121 CCCOc1ccccc1CCl Amb6622493 [2,0,0,0,0,0|2,0,0]=4 543 B12R1.121 CCCOc1ccccc1CN Amb1141875 [2,0,0,0,0,0|2,0,0]=4 544 B12R1.121 CCCOc1ccccc1CO Amb3542437 [2,0,0,0,0,0|2,0,0]=4 545 B12R1.121 CCCOc1ccccc1NC Amb18316381 [2,0,0,0,0,0|1,0,0]=3 546 B12R1.121 CCNCc1ccccc1OC Amb6864718 [2,0,0,0,0,0|2,0,0]=4 547 B12R1.121 CCNCc1ccccc1OC Amb837659 [2,0,0,0,0,0|2,0,0]=4 548 B12R1.121 CCc1ccccc1CCCBr Amb33451547 [2,0,0,0,0,0|2,0,0]=4 549 B12R1.121 CCc1ccccc1CCCN Amb18310623 [2,0,0,0,0,0|2,0,0]=4 550 B12R1.121 CCc1ccccc1CCCO Amb32950119 [2,0,0,0,0,0|1,0,0]=3 551 B12R1.121 CCc1ccccc1CCCS Amb33198664 [2,0,0,0,0,0|1,1,0]=4 552 B12R1.121 CCc1ccccc1NCCO Amb4016393 [2,0,0,0,0,0|2,0,0]=4 553 B12R1.121 CCc1ccccc1OCCBr Amb9024911 [2,0,0,0,0,0|2,0,0]=4 554 B12R1.121 CCc1ccccc1OCCCl Amb8867419 [2,0,0,0,0,0|2,0,0]=4 555 B12R1.121 CCc1ccccc1OCCN Amb5781212 [2,0,0,0,0,0|2,0,0]=4 556 B12R1.121 CCc1ccccc1OCCO Amb9370573 [2,0,0,0,0,0|1,0,0]=3 557 B12R1.121 CCc1ccccc1OCCS Amb17233941 [2,0,0,0,0,0|1,1,0]=4 558 B12R1.121 CNCCc1ccccc1OC Amb33544252 [2,0,0,0,0,0|2,0,0]=4 559 B12R1.121 CNc1ccccc1CCCO Amb26445075 [2,0,0,0,0,0|1,0,0]=3 560 B12R1.121 COCNc1ccccc1OC Amb27238667 [2,0,0,0,0,0|2,0,0]=4 561 B12R1.121 COc1ccccc1C#CCO Amb18180050 [2,0,0,0,0,0|0,0,2]=4 562 B12R1.121 COc1ccccc1CCC#N Amb17508974 [2,0,0,0,0,0|1,0,1]=4 563 B12R1.121 COc1ccccc1CCC=O Amb17081677 [2,0,0,0,0,0|0,0,2]=4 564 B12R1.121 COc1ccccc1CCCBr Amb7089047 [2,0,0,0,0,0|1,0,0]=3 565 B12R1.121 COc1ccccc1CCCCl Amb17104531 [2,0,0,0,0,0|1,0,0]=3 566 B12R1.121 COc1ccccc1CCCN Amb2721871 [2,0,0,0,0,0|1,0,0]=3 567 B12R1.121 COc1ccccc1CCCO Amb4019180 [2,0,0,0,0,0|0,0,0]=2 568 B12R1.121 COc1ccccc1CCCS Amb17400949 [2,0,0,0,0,0|0,1,0]=3 569 B12R1.121 COc1ccccc1CCNN Amb8828049 [2,0,0,0,0,0|2,0,0]=4 570 B12R1.121 COc1ccccc1CCON Amb22896636 [2,0,0,0,0,0|2,0,0]=4 571 B12R1.121 COc1ccccc1CC[Zn]Br Amb6300304 [2,0,0,0,0,0|2,0,0]=4 572 B12R1.121 COc1ccccc1NCCCl Amb17335806 [2,0,0,0,0,0|2,0,0]=4 573 B12R1.121 COc1ccccc1NCCN Amb17057753 [2,0,0,0,0,0|2,0,0]=4 574 B12R1.121 COc1ccccc1NCCO Amb6708268 [2,0,0,0,0,0|1,0,0]=3 575 B12R1.121 COc1ccccc1OCC#N Amb2504984 [2,0,0,0,0,0|1,0,1]=4 576 B12R1.121 COc1ccccc1OCC=O Amb5731832 [2,0,0,0,0,0|0,0,2]=4 577 B12R1.121 COc1ccccc1OCCBr Amb836244 [2,0,0,0,0,0|1,0,0]=3 578 B12R1.121 COc1ccccc1OCCCl Amb8828437 [2,0,0,0,0,0|1,0,0]=3 579 B12R1.121 COc1ccccc1OCCN Amb1210085 [2,0,0,0,0,0|1,0,0]=3 580 B12R1.121 COc1ccccc1OCCN Amb20241252 [2,0,0,0,0,0|1,0,0]=3 581 B12R1.121 COc1ccccc1OCCN Amb6296355 [2,0,0,0,0,0|1,0,0]=3 582 B12R1.121 COc1ccccc1OCCO Amb2209353 [2,0,0,0,0,0|0,0,0]=2 583 B12R1.121 COc1ccccc1OCCS Amb17234095 [2,0,0,0,0,0|0,1,0]=3 584 B12R1.121 COc1ccccc1OCC[NH3+] Amb33513060 [2,0,0,0,0,0|1,0,0]=3 585 B12R1.121 COc1ccccc1SCCN Amb19024665 [2,0,0,0,0,0|1,1,0]=4 586 B12R1.121 COc1ccccc1SCCO Amb2689268 [2,0,0,0,0,0|0,1,0]=3 587 B12R1.121 COc1ccccc1\C=C\CO Amb1110152 [2,0,0,0,0,0|0,0,2]=4 588 B12R1.121 COc1cccnc1CCCBr Amb33451057 [2,0,0,0,0,0|2,0,0]=4 589 B12R1.121 COc1cccnc1CCCN Amb33448425 [2,0,0,0,0,0|2,0,0]=4 590 B12R1.121 COc1cccnc1CCCO Amb33080428 [2,0,0,0,0,0|1,0,0]=3 591 B12R1.121 COc1cccnc1CCCS Amb33271553 [2,0,0,0,0,0|1,1,0]=4 592 B12R1.121 COc1cccnc1OCCN Amb33474262 [2,0,0,0,0,0|2,0,0]=4 593 B12R1.121 COc1ncccc1CCCBr Amb33240833 [2,0,0,0,0,0|2,0,0]=4 594 B12R1.121 COc1ncccc1CCCN Amb33448900 [2,0,0,0,0,0|2,0,0]=4 595 B12R1.121 COc1ncccc1CCCO Amb33079281 [2,0,0,0,0,0|1,0,0]=3 596 B12R1.121 COc1ncccc1CCCS Amb33378282 [2,0,0,0,0,0|1,1,0]=4 597 B12R1.121 COc1ncccc1OCCN Amb33378290 [2,0,0,0,0,0|2,0,0]=4 598 B12R1.121 CSc1ccccc1CCCBr Amb33240777 [2,0,0,0,0,0|1,1,0]=4 599 B12R1.121 CSc1ccccc1CCCN Amb33079267 [2,0,0,0,0,0|1,1,0]=4 600 B12R1.121 CSc1ccccc1CCCO Amb33079338 [2,0,0,0,0,0|0,1,0]=3 601 B12R1.121 CSc1ccccc1CCCS Amb32876734 [2,0,0,0,0,0|0,2,0]=4 602 B12R1.121 CSc1ccccc1OCCN Amb22523348 [2,0,0,0,0,0|1,1,0]=4 603 B12R1.121 CSc1ncccc1OCCO Amb24105861 [2,0,0,0,0,0|1,1,0]=4 604 B12R1.121 N#Cc1ccccc1CCCO Amb28437188 [2,0,0,0,0,0|2,0,0]=4 605 B12R1.121 N#Cc1ccccc1OCCO Amb6256841 [2,0,0,0,0,0|2,0,0]=4 606 B12R1.121 NCc1ccccc1OCCO Amb33527040 [2,0,0,0,0,0|2,0,0]=4 607 B12R1.121 NCc1ccccc1OCCO Amb6702373 [2,0,0,0,0,0|2,0,0]=4 608 B12R1.121 O=Cc1ccccc1OCCO Amb857545 [2,0,0,0,0,0|2,0,0]=4 609 B12R1.121 [C-]#[N+]CCc1ccccc1OC Amb3973126 [2,0,0,0,0,0|2,0,0]=4 610 B12R1.267 BrCCCOc1ccccc1Br Amb8517103 [2,0,0,0,0,0|2,0,0]=4 611 B12R1.267 C#CCCOc1ccccc1C Amb27397416 [2,0,0,0,0,0|1,0,1]=4 612 B12R1.267 CCCCNc1ccccc1C Amb4016420 [2,0,0,0,0,0|2,0,0]=4 613 B12R1.267 CCCCNc1ccccc1O Amb18646353 [2,0,0,0,0,0|2,0,0]=4 614 B12R1.267 CCCCOc1ccccc1Br Amb6272446 [2,0,0,0,0,0|2,0,0]=4 615 B12R1.267 CCCCOc1ccccc1N Amb1033054 [2,0,0,0,0,0|2,0,0]=4 616 B12R1.267 CCCCOc1ccccc1O Amb8837327 [2,0,0,0,0,0|1,0,0]=3 617 B12R1.267 CNCCOc1ccccc1C Amb1222745 [2,0,0,0,0,0|2,0,0]=4 618 B12R1.267 CNCCOc1ccccc1C Amb2140560 [2,0,0,0,0,0|2,0,0]=4 619 B12R1.267 COCCOc1ccccc1O Amb8837338 [2,0,0,0,0,0|2,0,0]=4 620 B12R1.267 Cc1ccccc1CCCCBr Amb34914032 [2,0,0,0,0,0|2,0,0]=4 621 B12R1.267 Cc1ccccc1CCCCN Amb17991254 [2,0,0,0,0,0|2,0,0]=4 622 B12R1.267 Cc1ccccc1CCCCN Amb5735492 [2,0,0,0,0,0|2,0,0]=4 623 B12R1.267 Cc1ccccc1CCCCO Amb34913207 [2,0,0,0,0,0|1,0,0]=3 624 B12R1.267 Cc1ccccc1CCCCS Amb18564154 [2,0,0,0,0,0|1,1,0]=4 625 B12R1.267 Cc1ccccc1CNCCO Amb6865192 [2,0,0,0,0,0|2,0,0]=4 626 B12R1.267 Cc1ccccc1CNCCO Amb7757032 [2,0,0,0,0,0|2,0,0]=4 627 B12R1.267 Cc1ccccc1NCCCF Amb27757671 [2,0,0,0,0,0|2,0,0]=4 628 B12R1.267 Cc1ccccc1NCCCN Amb17057721 [2,0,0,0,0,0|2,0,0]=4 629 B12R1.267 Cc1ccccc1NCCCO Amb17306598 [2,0,0,0,0,0|1,0,0]=3 630 B12R1.267 Cc1ccccc1OCCC#N Amb1635755 [2,0,0,0,0,0|1,0,1]=4 631 B12R1.267 Cc1ccccc1OCCC=O Amb5731759 [2,0,0,0,0,0|0,0,2]=4 632 B12R1.267 Cc1ccccc1OCCCBr Amb2795769 [2,0,0,0,0,0|1,0,0]=3 633 B12R1.267 Cc1ccccc1OCCCCl Amb1141955 [2,0,0,0,0,0|1,0,0]=3 634 B12R1.267 Cc1ccccc1OCCCN Amb1136099 [2,0,0,0,0,0|1,0,0]=3 635 B12R1.267 Cc1ccccc1OCCCO Amb9370674 [2,0,0,0,0,0|0,0,0]=2 636 B12R1.267 Cc1ccccc1OCCCS Amb17233940 [2,0,0,0,0,0|0,1,0]=3 637 B12R1.267 Cc1ccccc1OCCNN Amb2282444 [2,0,0,0,0,0|2,0,0]=4 638 B12R1.267 Cc1ccccc1OCCNN Amb2370790 [2,0,0,0,0,0|2,0,0]=4 639 B12R1.267 Cc1ccccc1OCCNO Amb17088414 [2,0,0,0,0,0|1,0,0]=3 640 B12R1.267 Cc1ccccc1OCCON Amb17088288 [2,0,0,0,0,0|2,0,0]=4 641 B12R1.267 Cc1ccccc1\C=C\CCO Amb27978430 [2,0,0,0,0,0|1,0,1]=4 642 B12R1.267 Cc1cccnc1OCCCN Amb18308492 [2,0,0,0,0,0|2,0,0]=4 643 B12R1.267 Cc1ccncc1OCCCN Amb33377410 [2,0,0,0,0,0|2,0,0]=4 644 B12R1.267 Cc1cnccc1NCCCO Amb27426567 [2,0,0,0,0,0|2,0,0]=4 645 B12R1.267 Cc1cnccc1OCCCN Amb33429247 [2,0,0,0,0,0|2,0,0]=4 646 B12R1.267 Cc1ncccc1OCCCN Amb33358632 [2,0,0,0,0,0|2,0,0]=4 647 B12R1.267 ClCCCOc1ccccc1Br Amb6260781 [2,0,0,0,0,0|2,0,0]=4 648 B12R1.267 ClCCCOc1ccccc1Cl Amb1135755 [2,0,0,0,0,0|2,0,0]=4 649 B12R1.267 Clc1ccccc1OCCCBr Amb8517138 [2,0,0,0,0,0|2,0,0]=4 650 B12R1.267 Fc1ccccc1OCCCBr Amb7089048 [2,0,0,0,0,0|2,0,0]=4 651 B12R1.267 Fc1ccccc1OCCCCl Amb1131839 [2,0,0,0,0,0|2,0,0]=4 652 B12R1.267 Fc1ccccc1OCCCS Amb17234296 [2,0,0,0,0,0|1,1,0]=4 653 B12R1.267 NCCCCc1ccccc1O Amb18828230 [2,0,0,0,0,0|2,0,0]=4 654 B12R1.267 NCCCOc1ccccc1Br Amb6267751 [2,0,0,0,0,0|2,0,0]=4 655 B12R1.267 NCCCOc1ccccc1Cl Amb5731731 [2,0,0,0,0,0|2,0,0]=4 656 B12R1.267 NCCCOc1ccccc1F Amb1107911 [2,0,0,0,0,0|2,0,0]=4 657 B12R1.267 NCCCOc1ccccc1F Amb1221365 [2,0,0,0,0,0|2,0,0]=4 658 B12R1.267 NCCCOc1ccccc1O Amb33226613 [2,0,0,0,0,0|1,0,0]=3 659 B12R1.267 Nc1ccccc1NCCCO Amb8997320 [2,0,0,0,0,0|2,0,0]=4 660 B12R1.267 Nc1ccccc1OCCCF Amb23539407 [2,0,0,0,0,0|2,0,0]=4 661 B12R1.267 Nc1ccccc1OCCCO Amb8842578 [2,0,0,0,0,0|1,0,0]=3 662 B12R1.267 Nc1cccnc1OCCCO Amb8842581 [2,0,0,0,0,0|2,0,0]=4 663 B12R1.267 Nc1ccncc1OCCCO Amb33035572 [2,0,0,0,0,0|2,0,0]=4 664 B12R1.267 Nc1cnccc1OCCCO Amb8842572 [2,0,0,0,0,0|2,0,0]=4 665 B12R1.267 Nc1ncccc1OCCCO Amb17206812 [2,0,0,0,0,0|2,0,0]=4 666 B12R1.267 OCCCCc1ccccc1Br Amb34003425 [2,0,0,0,0,0|2,0,0]=4 667 B12R1.267 OCCCCc1ccccc1Cl Amb4037443 [2,0,0,0,0,0|2,0,0]=4 668 B12R1.267 OCCCCc1ccccc1F Amb34913201 [2,0,0,0,0,0|2,0,0]=4 669 B12R1.267 OCCCNc1cccc[n+]1O Amb17308217 [2,0,0,0,0,0|2,0,0]=4 670 B12R1.267 OCCCNc1ccccc1Br Amb17306220 [2,0,0,0,0,0|2,0,0]=4 671 B12R1.267 OCCCNc1ccccc1Cl Amb17306039 [2,0,0,0,0,0|2,0,0]=4 672 B12R1.267 OCCCNc1ccccc1F Amb17306155 [2,0,0,0,0,0|2,0,0]=4 673 B12R1.267 OCCCNc1ccccc1I Amb27395286 [2,0,0,0,0,0|2,0,0]=4 674 B12R1.267 OCCCOc1ccccc1Br Amb9247656 [2,0,0,0,0,0|1,0,0]=3 675 B12R1.267 OCCCOc1ccccc1Cl Amb9247633 [2,0,0,0,0,0|1,0,0]=3 676 B12R1.267 OCCCOc1ccccc1F Amb9370652 [2,0,0,0,0,0|1,0,0]=3 677 B12R1.267 OCC\N=C/c1ccccc1O Amb28122440 [2,0,0,0,0,0|2,0,0]=4 678 B12R1.267 ONCCOc1ccccc1Br Amb17088423 [2,0,0,0,0,0|2,0,0]=4 679 B12R1.267 ONCCOc1ccccc1Cl Amb17088420 [2,0,0,0,0,0|2,0,0]=4 680 B12R1.267 ONCCOc1ccccc1F Amb17088417 [2,0,0,0,0,0|2,0,0]=4 681 B12R1.267 SCCCOc1ccccc1Br Amb17258957 [2,0,0,0,0,0|1,1,0]=4 682 B12R1.267 SCCCOc1ccccc1Cl Amb17237588 [2,0,0,0,0,0|1,1,0]=4 683 B12R1.267 [C-]#[N+]CCOc1ccccc1C Amb28435228 [2,0,0,0,0,0|2,0,0]=4 684 B12R1.267 [C-]#[N+]CCOc1ccccc1O Amb27429201 [2,0,0,0,0,0|2,0,0]=4 685 B12R1.125 C=C(C)COc1ccccc1O Amb8837378 [2,0,0,0,0,0|1,0,1]=4 686 B12R1.125 CC(C)CCc1ccccc1O Amb27972959 [2,0,0,0,0,0|2,0,0]=4 687 B12R1.125 CC(C)COc1ccccc1Br Amb6271437 [2,0,0,0,0,0|2,0,0]=4 688 B12R1.125 CC(C)COc1ccccc1Cl Amb24632680 [2,0,0,0,0,0|2,0,0]=4 689 B12R1.125 CC(C)COc1ccccc1N Amb1137660 [2,0,0,0,0,0|2,0,0]=4 690 B12R1.125 CC(C)COc1ccccc1N Amb2140563 [2,0,0,0,0,0|2,0,0]=4 691 B12R1.125 CC(C)COc1ccccc1O Amb1016836 [2,0,0,0,0,0|1,0,0]=3 692 B12R1.125 CC(C)COc1ccccc1S Amb25844615 [2,0,0,0,0,0|1,1,0]=4 693 B12R1.125 CC(C)COc1ncccc1O Amb26061907 [2,0,0,0,0,0|2,0,0]=4 694 B12R1.125 CC(F)CCc1ccccc1O Amb27958749 [2,0,0,0,0,0|2,0,0]=4 695 B12R1.125 CC(F)COc1ccccc1O Amb27958799 [2,0,0,0,0,0|1,0,0]=3 696 B12R1.125 CC(F)CSc1ccccc1O Amb27958812 [2,0,0,0,0,0|1,1,0]=4 697 B12R1.125 CC(N)CCc1ccccc1O Amb17507315 [2,0,0,0,0,0|2,0,0]=4 698 B12R1.125 CC(N)COc1ccccc1Br Amb17062516 [2,0,0,0,0,0|2,0,0]=4 699 B12R1.125 CC(N)COc1ccccc1Cl Amb9756354 [2,0,0,0,0,0|2,0,0]=4 700 B12R1.125 CC(N)COc1ccccc1F Amb1134402 [2,0,0,0,0,0|2,0,0]=4 701 B12R1.125 CC(N)COc1ccccc1O Amb27814458 [2,0,0,0,0,0|1,0,0]=3 702 B12R1.125 CC(O)CCc1ccccc1Br Amb25763352 [2,0,0,0,0,0|2,0,0]=4 703 B12R1.125 CC(O)CCc1ccccc1Cl Amb19075162 [2,0,0,0,0,0|2,0,0]=4 704 B12R1.125 CC(O)CCc1ccccc1F Amb18805845 [2,0,0,0,0,0|2,0,0]=4 705 B12R1.125 CC(O)CCc1ccccc1O Amb17507249 [2,0,0,0,0,0|1,0,0]=3 706 B12R1.125 CC(O)CNc1ccccc1Br Amb17142610 [2,0,0,0,0,0|2,0,0]=4 707 B12R1.125 CC(O)CNc1ccccc1Cl Amb17139125 [2,0,0,0,0,0|2,0,0]=4 708 B12R1.125 CC(O)CNc1ccccc1F Amb17138650 [2,0,0,0,0,0|2,0,0]=4 709 B12R1.125 CC(O)CNc1ccccc1I Amb28410519 [2,0,0,0,0,0|2,0,0]=4 710 B12R1.125 CC(O)CNc1ccccc1N Amb9359006 [2,0,0,0,0,0|2,0,0]=4 711 B12R1.125 CC(O)COc1ccccc1Cl Amb25337460 [2,0,0,0,0,0|1,0,0]=3 712 B12R1.125 CC(O)COc1ccccc1F Amb18806458 [2,0,0,0,0,0|1,0,0]=3 713 B12R1.125 CC(O)COc1ccccc1N Amb18971553 [2,0,0,0,0,0|1,0,0]=3 714 B12R1.125 CC(O)COc1cccnc1Br Amb28241064 [2,0,0,0,0,0|2,0,0]=4 715 B12R1.125 CC(O)COc1cccnc1F Amb27814862 [2,0,0,0,0,0|2,0,0]=4 716 B12R1.125 CC(O)CSc1ccccc1Cl Amb27477548 [2,0,0,0,0,0|1,1,0]=4 717 B12R1.125 CC(O)CSc1ncccc1O Amb18649167 [2,0,0,0,0,0|1,1,0]=4 718 B12R1.125 C[C@@H](N)CCc1ccccc1O Amb27830642 [2,0,0,0,0,0|2,0,0]=4 719 B12R1.125 C[C@@H](N)COc1ccccc1Br Amb18036081 [2,0,0,0,0,0|2,0,0]=4 720 B12R1.125 C[C@@H](N)COc1ccccc1Cl Amb18538518 [2,0,0,0,0,0|2,0,0]=4 721 B12R1.125 C[C@@H](N)COc1ccccc1F Amb18538499 [2,0,0,0,0,0|2,0,0]=4 722 B12R1.125 C[C@@H](N)COc1ccccc1I Amb29850634 [2,0,0,0,0,0|2,0,0]=4 723 B12R1.125 C[C@@H](O)CCc1ccccc1Br Amb33387630 [2,0,0,0,0,0|2,0,0]=4 724 B12R1.125 C[C@@H](O)CCc1ccccc1Cl Amb33052597 [2,0,0,0,0,0|2,0,0]=4 725 B12R1.125 C[C@@H](O)CCc1ccccc1F Amb33361481 [2,0,0,0,0,0|2,0,0]=4 726 B12R1.125 C[C@@H](O)CCc1ccccc1O Amb33196173 [2,0,0,0,0,0|1,0,0]=3 727 B12R1.125 C[C@@H](O)CNc1ccccc1Cl Amb27848418 [2,0,0,0,0,0|2,0,0]=4 728 B12R1.125 C[C@@H](O)COc1ccccc1F Amb27754541 [2,0,0,0,0,0|1,0,0]=3 729 B12R1.125 C[C@@H](O)COc1ccccc1I Amb35687744 [2,0,0,0,0,0|1,0,0]=3 730 B12R1.125 C[C@@H](O)CSc1ccccc1O Amb27466695 [2,0,0,0,0,0|0,1,0]=3 731 B12R1.125 C[C@H](N)CCc1ccccc1O Amb25149919 [2,0,0,0,0,0|2,0,0]=4 732 B12R1.125 C[C@H](N)COc1ccccc1I Amb29850633 [2,0,0,0,0,0|2,0,0]=4 733 B12R1.125 C[C@H](O)CCc1ccccc1Br Amb33387628 [2,0,0,0,0,0|2,0,0]=4 734 B12R1.125 C[C@H](O)CCc1ccccc1Cl Amb33052594 [2,0,0,0,0,0|2,0,0]=4 735 B12R1.125 C[C@H](O)CCc1ccccc1F Amb33361482 [2,0,0,0,0,0|2,0,0]=4 736 B12R1.125 C[C@H](O)CCc1ccccc1O Amb33196408 [2,0,0,0,0,0|1,0,0]=3 737 B12R1.125 C[C@H](O)CNc1ccccc1Br Amb27213619 [2,0,0,0,0,0|2,0,0]=4 738 B12R1.125 C[C@H](O)CNc1ccccc1Cl Amb28244269 [2,0,0,0,0,0|2,0,0]=4 739 B12R1.125 C[C@H](O)COc1ccccc1Br Amb28244310 [2,0,0,0,0,0|1,0,0]=3 740 B12R1.125 C[C@H](O)COc1ccccc1I Amb35687743 [2,0,0,0,0,0|1,0,0]=3 741 B12R1.125 Cc1ccccc1CCC(C)Br Amb27647242 [2,0,0,0,0,0|2,0,0]=4 742 B12R1.125 Cc1ccccc1CCC(C)C Amb8394140 [2,0,0,0,0,0|2,0,0]=4 743 B12R1.125 Cc1ccccc1CCC(C)N Amb9031759 [2,0,0,0,0,0|2,0,0]=4 744 B12R1.125 Cc1ccccc1CCC(C)O Amb18800836 [2,0,0,0,0,0|1,0,0]=3 745 B12R1.125 Cc1ccccc1CC[C@@H](C)N Amb33225585 [2,0,0,0,0,0|2,0,0]=4 746 B12R1.125 Cc1ccccc1CC[C@@H](C)O Amb33360566 [2,0,0,0,0,0|1,0,0]=3 747 B12R1.125 Cc1ccccc1CC[C@H](C)N Amb26611454 [2,0,0,0,0,0|2,0,0]=4 748 B12R1.125 Cc1ccccc1CC[C@H](C)O Amb33360567 [2,0,0,0,0,0|1,0,0]=3 749 B12R1.125 Cc1ccccc1NCC(C)C Amb6701131 [2,0,0,0,0,0|2,0,0]=4 750 B12R1.125 Cc1ccccc1NCC(C)N Amb25913696 [2,0,0,0,0,0|2,0,0]=4 751 B12R1.125 Cc1ccccc1NCC(C)O Amb17138592 [2,0,0,0,0,0|1,0,0]=3 752 B12R1.125 Cc1ccccc1NCC(C)S Amb27658986 [2,0,0,0,0,0|1,1,0]=4 753 B12R1.125 Cc1ccccc1OCC(=O)O Amb1215022 [2,0,0,0,0,0|0,0,2]=4 754 B12R1.125 Cc1ccccc1OCC(C)N Amb9756347 [2,0,0,0,0,0|1,0,0]=3 755 B12R1.125 Cc1ccccc1OCC(C)O Amb18182639 [2,0,0,0,0,0|0,0,0]=2 756 B12R1.125 Cc1ccccc1OC[C@@H](C)N Amb18538491 [2,0,0,0,0,0|1,0,0]=3 757 B12R1.125 Cc1ccccc1OC[C@@H](C)O Amb27225582 [2,0,0,0,0,0|0,0,0]=2 758 B12R1.125 Cc1ccccc1SCC(C)C Amb25730826 [2,0,0,0,0,0|1,1,0]=4 759 B12R1.125 Cc1ccccc1SC[C@@H](C)N Amb27879389 [2,0,0,0,0,0|1,1,0]=4 760 B12R1.125 Cc1ccccc1SC[C@H](C)O Amb28075850 [2,0,0,0,0,0|0,1,0]=3 761 B12R1.125 Cc1ccccc1\C=C\C(C)O Amb27748478 [2,0,0,0,0,0|1,0,1]=4 762 B12R1.125 Cc1cccnc1CCC(C)O Amb27663089 [2,0,0,0,0,0|2,0,0]=4 763 B12R1.125 Cc1cccnc1CC[C@@H](C)O Amb33428756 [2,0,0,0,0,0|2,0,0]=4 764 B12R1.125 Cc1cccnc1CC[C@H](C)O Amb33428790 [2,0,0,0,0,0|2,0,0]=4 765 B12R1.125 Cc1cccnc1OCC(C)N Amb35727579 [2,0,0,0,0,0|2,0,0]=4 766 B12R1.125 Cc1cccnc1SC[C@@H](C)O Amb35678706 [2,0,0,0,0,0|1,1,0]=4 767 B12R1.125 Cc1cccnc1SC[C@H](C)O Amb35678705 [2,0,0,0,0,0|1,1,0]=4 768 B12R1.125 Cc1ccncc1CCC(C)O Amb27149348 [2,0,0,0,0,0|2,0,0]=4 769 B12R1.125 Cc1ccncc1CC[C@@H](C)O Amb33376701 [2,0,0,0,0,0|2,0,0]=4 770 B12R1.125 Cc1ccncc1CC[C@H](C)O Amb33377430 [2,0,0,0,0,0|2,0,0]=4 771 B12R1.125 Cc1cnccc1CCC(C)O Amb25986351 [2,0,0,0,0,0|2,0,0]=4 772 B12R1.125 Cc1cnccc1CC[C@@H](C)O Amb33414171 [2,0,0,0,0,0|2,0,0]=4 773 B12R1.125 Cc1cnccc1CC[C@H](C)O Amb33414328 [2,0,0,0,0,0|2,0,0]=4 774 B12R1.125 Cc1cnccc1NCC(C)O Amb27776003 [2,0,0,0,0,0|2,0,0]=4 775 B12R1.125 Cc1cnccc1OCC(C)N Amb35727439 [2,0,0,0,0,0|2,0,0]=4 776 B12R1.125 Cc1ncccc1CCC(C)O Amb26342122 [2,0,0,0,0,0|2,0,0]=4 777 B12R1.125 Cc1ncccc1CC[C@@H](C)O Amb32878985 [2,0,0,0,0,0|2,0,0]=4 778 B12R1.125 Cc1ncccc1CC[C@H](C)O Amb32878987 [2,0,0,0,0,0|2,0,0]=4 779 B12R1.125 O=C(O)COc1ccccc1O Amb1030005 [2,0,0,0,0,0|0,0,2]=4 780 B12R1.125 Oc1ccccc1OCC(F)F Amb18795191 [2,0,0,0,0,0|2,0,0]=4 781 B12R1.27 C#C[C@H](O)COc1ccccc1 Amb27394834 [2,0,0,0,0,0|1,0,1]=4 782 B12R1.27 CC(CN)COc1ccccc1 Amb9029321 [2,0,0,0,0,0|2,0,0]=4 783 B12R1.27 CC(CO)CCc1ccccc1 Amb32413001 [2,0,0,0,0,0|2,0,0]=4 784 B12R1.27 CC(CO)COc1ccccc1 Amb17232599 [2,0,0,0,0,0|1,0,0]=3 785 B12R1.27 CCC(N)COc1ccccc1 Amb19029691 [2,0,0,0,0,0|2,0,0]=4 786 B12R1.27 CCC(O)CCc1ccccc1 Amb17138574 [2,0,0,0,0,0|2,0,0]=4 787 B12R1.27 CCC(O)CNc1ccccc1 Amb13952005 [2,0,0,0,0,0|2,0,0]=4 788 B12R1.27 CC[C@@H](O)CNc1ccccc1 Amb27793988 [2,0,0,0,0,0|2,0,0]=4 789 B12R1.27 CC[C@H](O)CNc1ccccc1 Amb28071833 [2,0,0,0,0,0|2,0,0]=4 790 B12R1.27 N#C[C@@H](O)COc1ccccc1 Amb24474239 [2,0,0,0,0,0|1,0,1]=4 791 B12R1.27 N#C[C@H](O)COc1ccccc1 Amb28461129 [2,0,0,0,0,0|1,0,1]=4 792 B12R1.27 NC(CO)CCc1ccccc1 Amb18315307 [2,0,0,0,0,0|2,0,0]=4 793 B12R1.27 NC(CO)CCc1ccccc1 Amb32753518 [2,0,0,0,0,0|2,0,0]=4 794 B12R1.27 NC(CO)COc1ccccc1 Amb18563798 [2,0,0,0,0,0|1,0,0]=3 795 B12R1.27 NCC(O)CCc1ccccc1 Amb18315280 [2,0,0,0,0,0|2,0,0]=4 796 B12R1.27 NCC(O)CNc1ccccc1 Amb17138613 [2,0,0,0,0,0|2,0,0]=4 797 B12R1.27 NCC(O)COc1ccccc1 Amb6365926 [2,0,0,0,0,0|1,0,0]=3 798 B12R1.27 NCC(O)COc1ccccc1 Amb9710900 [2,0,0,0,0,0|1,0,0]=3 799 B12R1.27 NCC(O)CSc1ccccc1 Amb6678669 [2,0,0,0,0,0|1,1,0]=4 800 B12R1.27 NC[C@@H](O)CCc1ccccc1 Amb32952383 [2,0,0,0,0,0|2,0,0]=4 801 B12R1.27 NC[C@@H](O)COc1ccccc1 Amb22747719 [2,0,0,0,0,0|1,0,0]=3 802 B12R1.27 NC[C@H](O)CCc1ccccc1 Amb33081741 [2,0,0,0,0,0|2,0,0]=4 803 B12R1.27 N[C@@H](CO)CCc1ccccc1 Amb32683468 [2,0,0,0,0,0|2,0,0]=4 804 B12R1.27 N[C@@H](CO)CCc1ccccc1 Amb6308799 [2,0,0,0,0,0|2,0,0]=4 805 B12R1.27 N[C@@H](CO)CNc1ccccc1 Amb27233028 [2,0,0,0,0,0|2,0,0]=4 806 B12R1.27 N[C@H](CO)CCc1ccccc1 Amb32683465 [2,0,0,0,0,0|2,0,0]=4 807 B12R1.27 N[C@H](CO)CCc1ccccc1 Amb32683466 [2,0,0,0,0,0|2,0,0]=4 808 B12R1.27 O=C(CO)COc1ccccc1 Amb18563713 [2,0,0,0,0,0|0,0,2]=4 809 B12R1.27 OC(CBr)CCc1ccccc1 Amb32951853 [2,0,0,0,0,0|2,0,0]=4 810 B12R1.27 OC(CCl)CCc1ccccc1 Amb32954413 [2,0,0,0,0,0|2,0,0]=4 811 B12R1.27 OC(CCl)CNc1ccccc1 Amb10565986 [2,0,0,0,0,0|2,0,0]=4 812 B12R1.27 OC(CCl)COc1ccccc1 Amb9787566 [2,0,0,0,0,0|1,0,0]=3 813 B12R1.27 OC(CCl)CSc1ccccc1 Amb32421552 [2,0,0,0,0,0|1,1,0]=4 814 B12R1.27 OC(CF)CCc1ccccc1 Amb32954420 [2,0,0,0,0,0|2,0,0]=4 815 B12R1.27 OC(CF)CNc1ccccc1 Amb26517065 [2,0,0,0,0,0|2,0,0]=4 816 B12R1.27 OC(CF)COc1ccccc1 Amb32661710 [2,0,0,0,0,0|1,0,0]=3 817 B12R1.27 OCC(F)COc1ccccc1 Amb32661700 [2,0,0,0,0,0|1,0,0]=3 818 B12R1.27 OCC(O)CCc1ccccc1 Amb17508778 [2,0,0,0,0,0|1,0,0]=3 819 B12R1.27 OCC(O)CNc1ccccn1 Amb27265848 [2,0,0,0,0,0|2,0,0]=4 820 B12R1.27 OCC(O)COc1ccccc1 Amb532993 [2,0,0,0,0,0|0,0,0]=2 821 B12R1.27 OCC(O)\C=C\c1ccccc1 Amb32953203 [2,0,0,0,0,0|1,0,1]=4 822 B12R1.27 OC[C@@H](O)COc1ccccc1 Amb30621933 [2,0,0,0,0,0|0,0,0]=2 823 B12R1.27 OC[C@@H](O)OCc1ccccc1 Amb28065346 [2,0,0,0,0,0|2,0,0]=4 824 B12R1.27 OC[C@H](O)CNc1ccccc1 Amb27238799 [2,0,0,0,0,0|1,0,0]=3 825 B12R1.27 OC[C@H](O)COc1ccccc1 Amb10982588 [2,0,0,0,0,0|0,0,0]=2 826 B12R1.27 OC[C@H](O)\C=C\c1ccccc1 Amb28410835 [2,0,0,0,0,0|1,0,1]=4 827 B14R1.96 CCc1ccccc1OCCC(=O)O Amb5762036 [1,1,0,0,0,0|1,0,1]=4 828 B14R1.96 COc1ccccc1CCCC(=O)O Amb3932875 [1,1,0,0,0,0|1,0,1]=4 829 B14R1.96 COc1ccccc1CNCC(C)O Amb838103 [1,1,0,0,0,0|2,0,0]=4 830 B14R1.96 COc1ccccc1NCCC(=O)O Amb1107141 [1,1,0,0,0,0|1,0,1]=4 831 B14R1.96 COc1ccccc1NCCC(C)C Amb6688346 [1,1,0,0,0,0|2,0,0]=4 832 B14R1.96 COc1ccccc1OCCC(=O)O Amb1203517 [1,1,0,0,0,0|0,0,1]=3 833 B14R1.96 COc1ccccc1OCCC(N)=S Amb6273804 [1,1,0,0,0,0|0,1,1]=4 834 B14R1.461 CCCCOc1ncc(Br)cc1OC Amb22276715 [1,1,0,0,0,0|2,0,0]=4 835 B14R1.461 CNCCOc1ccc(Br)cc1OC Amb17100015 [1,1,0,0,0,0|2,0,0]=4 836 B14R1.461 CNCCOc1ccc(C)cc1OC Amb2150775 [1,1,0,0,0,0|2,0,0]=4 837 B14R1.461 CNCCOc1ccc(C)cc1OC Amb857219 [1,1,0,0,0,0|2,0,0]=4 838 B14R1.461 COc1cc(Br)ccc1CCCCN Amb33005399 [1,1,0,0,0,0|2,0,0]=4 839 B14R1.461 COc1cc(Br)ccc1OCCC=O Amb17100002 [1,1,0,0,0,0|0,0,2]=4 840 B14R1.461 COc1cc(Br)ccc1OCCCN Amb33005068 [1,1,0,0,0,0|1,0,0]=3 841 B14R1.461 COc1cc(C)ccc1C#CCCO Amb35600301 [1,1,0,0,0,0|1,0,1]=4 842 B14R1.461 COc1cc(C)ccc1CCCCN Amb18815804 [1,1,0,0,0,0|2,0,0]=4 843 B14R1.461 COc1cc(C)ccc1OCCC#N Amb6262825 [1,1,0,0,0,0|1,0,1]=4 844 B14R1.461 COc1cc(C)ccc1OCCCBr Amb9209729 [1,1,0,0,0,0|1,0,0]=3 845 B14R1.461 COc1cc(C)ccc1OCCCN Amb6243911 [1,1,0,0,0,0|1,0,0]=3 846 B14R1.461 COc1cc(C)ccc1OCCCO Amb9370740 [1,1,0,0,0,0|0,0,0]=2 847 B14R1.461 COc1cc(Cl)ccc1C#CCCO Amb28075355 [1,1,0,0,0,0|1,0,1]=4 848 B14R1.461 COc1cc(Cl)ccc1CCCCN Amb33052278 [1,1,0,0,0,0|2,0,0]=4 849 B14R1.461 COc1cc(Cl)ccc1OCCCN Amb33053165 [1,1,0,0,0,0|1,0,0]=3 850 B14R1.461 COc1cc(F)ccc1CCCCN Amb33310689 [1,1,0,0,0,0|2,0,0]=4 851 B14R1.461 COc1cc(F)ccc1OCCCN Amb33310657 [1,1,0,0,0,0|1,0,0]=3 852 B14R1.461 COc1cc(O)ccc1CCCCN Amb33312390 [1,1,0,0,0,0|2,0,0]=4 853 B14R1.461 COc1cc(O)ccc1OCCCN Amb33311941 [1,1,0,0,0,0|1,0,0]=3 854 B14R1.461 COc1nc(Cl)ccc1OCCCN Amb33221166 [1,1,0,0,0,0|2,0,0]=4 855 B14R1.476 CCCCCNc1ccccc1OC Amb6708228 [1,1,0,0,0,0|2,0,0]=4 856 B14R1.476 CCCCNCc1ccccc1OC Amb20673533 [1,1,0,0,0,0|2,0,0]=4 857 B14R1.476 CCCCNCc1ccccc1OC Amb838829 [1,1,0,0,0,0|2,0,0]=4 858 B14R1.476 CCNCCOc1ccccc1CC Amb22588093 [1,1,0,0,0,0|2,0,0]=4 859 B14R1.476 CCNCCOc1ccccc1OC Amb28556256 [1,1,0,0,0,0|1,0,0]=3 860 B14R1.476 CCNCCOc1ccccc1OC Amb7761493 [1,1,0,0,0,0|1,0,0]=3 861 B14R1.476 CCc1ccccc1C#CCCCO Amb27196491 [1,1,0,0,0,0|2,0,0]=4 862 B14R1.476 CCc1ccccc1OCCCC#N Amb9024014 [1,1,0,0,0,0|2,0,0]=4 863 B14R1.476 CCc1ccccc1OCCCNC Amb8867443 [1,1,0,0,0,0|2,0,0]=4 864 B14R1.476 CNCCCOc1ccccc1OC Amb22588110 [1,1,0,0,0,0|1,0,0]=3 865 B14R1.476 CNCCCOc1ccccc1OC Amb2722013 [1,1,0,0,0,0|1,0,0]=3 866 B14R1.476 COCCCOc1ccccc1C=O Amb841931 [1,1,0,0,0,0|2,0,0]=4 867 B14R1.476 COCCCOc1cccnc1OC Amb33715588 [1,1,0,0,0,0|1,0,0]=3 868 B14R1.476 COCCNCc1ccccc1OC Amb13949023 [1,1,0,0,0,0|2,0,0]=4 869 B14R1.476 COCCNCc1ccccc1OC Amb1835726 [1,1,0,0,0,0|2,0,0]=4 870 B14R1.476 COc1ccccc1C#CCCCN Amb27776384 [1,1,0,0,0,0|2,0,0]=4 871 B14R1.476 COc1ccccc1CCCCC=O Amb18050050 [1,1,0,0,0,0|1,0,1]=4 872 B14R1.476 COc1ccccc1CCNCCN Amb17091034 [1,1,0,0,0,0|2,0,0]=4 873 B14R1.476 COc1ccccc1CCNCCO Amb17402027 [1,1,0,0,0,0|1,0,0]=3 874 B14R1.476 COc1ccccc1CNCCCN Amb17315284 [1,1,0,0,0,0|2,0,0]=4 875 B14R1.476 COc1ccccc1CNCCCO Amb53547 [1,1,0,0,0,0|1,0,0]=3 876 B14R1.476 COc1ccccc1CNCCCO Amb837786 [1,1,0,0,0,0|1,0,0]=3 877 B14R1.476 COc1ccccc1NCCCCO Amb17336990 [1,1,0,0,0,0|1,0,0]=3 878 B14R1.476 COc1ccccc1OCC#CCN Amb27749292 [1,1,0,0,0,0|1,0,1]=4 879 B14R1.476 COc1ccccc1OCC#CCN Amb33611512 [1,1,0,0,0,0|1,0,1]=4 880 B14R1.476 COc1ccccc1OCCCC#N Amb6267472 [1,1,0,0,0,0|1,0,0]=3 881 B14R1.476 COc1ccccc1OCCCCBr Amb2231591 [1,1,0,0,0,0|1,0,0]=3 882 B14R1.476 COc1ccccc1OCCCCN Amb6243889 [1,1,0,0,0,0|1,0,0]=3 883 B14R1.476 COc1ccccc1OCCN=C=S Amb839666 [1,1,0,0,0,0|0,1,1]=4 884 B14R1.476 COc1ccccc1OC\C=C\CN Amb32428744 [1,1,0,0,0,0|1,0,1]=4 885 B14R1.476 COc1ncccc1C#CCCCO Amb27824563 [1,1,0,0,0,0|2,0,0]=4 886 B14R1.476 O=Cc1ccccc1OCCCCO Amb19042463 [1,1,0,0,0,0|2,0,0]=4 887 B14R1.883 CCCCNc1cc(C)ccc1OC Amb6693800 [1,1,0,0,0,0|2,0,0]=4 888 B14R1.883 CCCCNc1cc(Cl)ccc1OC Amb6693593 [1,1,0,0,0,0|2,0,0]=4 889 B14R1.883 CCCCOc1cc(Br)cnc1OC Amb24083354 [1,1,0,0,0,0|2,0,0]=4 890 B14R1.883 COCCOc1cc(Br)ccc1OC Amb22229665 [1,1,0,0,0,0|2,0,0]=4 891 B14R1.883 COCCOc1cc(N)ccc1OC Amb6248613 [1,1,0,0,0,0|2,0,0]=4 892 B14R1.883 COc1ccc(Br)cc1CCCCN Amb17196875 [1,1,0,0,0,0|2,0,0]=4 893 B14R1.883 COc1ccc(Br)cc1CNCCO Amb6857166 [1,1,0,0,0,0|2,0,0]=4 894 B14R1.883 COc1ccc(Br)cc1OCCCN Amb18246903 [1,1,0,0,0,0|1,0,0]=3 895 B14R1.883 COc1ccc(C)cc1CCCCN Amb17194702 [1,1,0,0,0,0|2,0,0]=4 896 B14R1.883 COc1ccc(C)cc1OCCCN Amb18894505 [1,1,0,0,0,0|1,0,0]=3 897 B14R1.883 COc1ccc(Cl)cc1CCCCN Amb17195173 [1,1,0,0,0,0|2,0,0]=4 898 B14R1.883 COc1ccc(Cl)cc1CNCCO Amb1929138 [1,1,0,0,0,0|2,0,0]=4 899 B14R1.883 COc1ccc(Cl)cc1NCCCO Amb17306849 [1,1,0,0,0,0|1,0,0]=3 900 B14R1.883 COc1ccc(Cl)cc1OCCCN Amb18244279 [1,1,0,0,0,0|1,0,0]=3 901 B14R1.883 COc1ccc(F)cc1CCCCN Amb17194764 [1,1,0,0,0,0|2,0,0]=4 902 B14R1.883 COc1ccc(F)cc1NCCCO Amb18933504 [1,1,0,0,0,0|1,0,0]=3 903 B14R1.883 COc1ccc(F)cc1OCCCN Amb18894617 [1,1,0,0,0,0|1,0,0]=3 904 B14R1.883 COc1ncc(Br)cc1OCCCN Amb33006994 [1,1,0,0,0,0|2,0,0]=4 905 B14R1.903 CC(C)c1ccccc1OCCCN Amb1132640 [1,1,0,0,0,0|2,0,0]=4 906 B14R1.903 CCCCOc1ccccc1C(C)=O Amb6265364 [1,1,0,0,0,0|2,0,0]=4 907 B14R1.903 CCCCOc1ccccc1C(C)O Amb9364317 [1,1,0,0,0,0|2,0,0]=4 908 B14R1.903 CN(C)c1ccccc1NCCCO Amb18270492 [1,1,0,0,0,0|2,0,0]=4 909 B14R1.903 CN(C)c1ccccc1OCCCN Amb32878929 [1,1,0,0,0,0|2,0,0]=4 910 B14R1.904 CCCCNc1ccccc1OCC Amb6689332 [1,1,0,0,0,0|2,0,0]=4 911 B14R1.904 CCCCOc1ccccc1CNC Amb8906205 [1,1,0,0,0,0|2,0,0]=4 912 B14R1.904 CCCCOc1cccnc1OCC Amb19959458 [1,1,0,0,0,0|2,0,0]=4 913 B14R1.904 CCOc1ccccc1CCCCN Amb5735506 [1,1,0,0,0,0|2,0,0]=4 914 B14R1.904 CCOc1ccccc1CNCCO Amb22588099 [1,1,0,0,0,0|2,0,0]=4 915 B14R1.904 CCOc1ccccc1CNCCO Amb6857167 [1,1,0,0,0,0|2,0,0]=4 916 B14R1.904 CCOc1ccccc1NCCCO Amb17306390 [1,1,0,0,0,0|1,0,0]=3 917 B14R1.904 CCOc1ccccc1OCCC=O Amb5731787 [1,1,0,0,0,0|0,0,2]=4 918 B14R1.904 CCOc1ccccc1OCCCN Amb1108814 [1,1,0,0,0,0|1,0,0]=3 919 B14R1.904 CCOc1ccccc1OCCNC Amb7798427 [1,1,0,0,0,0|2,0,0]=4 920 B14R1.939 CCCCC(N)c1ccccc1OC Amb19062057 [1,1,0,0,0,0|2,0,0]=4 921 B14R1.939 CCCCC(N)c1ccccc1OC Amb35745519 [1,1,0,0,0,0|2,0,0]=4 922 B14R1.939 COc1ccccc1C(=O)NCCO Amb2620568 [1,1,0,0,0,0|2,0,0]=4 923 B14R1.939 COc1ccccc1C(C)NCCO Amb7809210 [1,1,0,0,0,0|2,0,0]=4 924 B14R1.939 COc1ccccc1N(C)CCCN Amb9209921 [1,1,0,0,0,0|2,0,0]=4 925 B14R1.965 CCCC(=O)Oc1ccccc1OC Amb2661927 [1,1,0,0,0,0|1,0,1]=4 926 B14R1.965 CCCC(Br)Cc1ccccc1OC Amb18548974 [1,1,0,0,0,0|2,0,0]=4 927 B14R1.965 CCCC(C)Nc1ccccc1OC Amb6688452 [1,1,0,0,0,0|2,0,0]=4 928 B14R1.965 COc1ccccc1CC(C)CCN Amb17235720 [1,1,0,0,0,0|2,0,0]=4 929 B14R1.965 COc1ccccc1CN(C)CCO Amb17337004 [1,1,0,0,0,0|2,0,0]=4 930 B14R1.965 COc1ccccc1NC(=O)CCO Amb9421426 [1,1,0,0,0,0|1,0,1]=4 931 B14R1.965 COc1ccccc1OC(C)CC#N Amb17235075 [1,1,0,0,0,0|1,0,1]=4 932 B14R1.3381 COCCOc1c(F)cccc1OC Amb33829956 [1,1,0,0,0,0|2,0,0]=4 933 B14R1.3381 COc1cccc(Br)c1CCCCN Amb33005137 [1,1,0,0,0,0|2,0,0]=4 934 B14R1.3381 COc1cccc(Br)c1OCCCN Amb33005053 [1,1,0,0,0,0|1,0,0]=3 935 B14R1.3381 COc1cccc(C)c1CCCCN Amb33423624 [1,1,0,0,0,0|2,0,0]=4 936 B14R1.3381 COc1cccc(C)c1OCCCN Amb33446376 [1,1,0,0,0,0|1,0,0]=3 937 B14R1.3381 COc1cccc(Cl)c1CCCCN Amb33052511 [1,1,0,0,0,0|2,0,0]=4 938 B14R1.3381 COc1cccc(Cl)c1OCCCN Amb33257403 [1,1,0,0,0,0|1,0,0]=3 939 B14R1.3381 COc1cccc(F)c1CCCCN Amb33201302 [1,1,0,0,0,0|2,0,0]=4 940 B14R1.3381 COc1cccc(F)c1OCCCN Amb33358462 [1,1,0,0,0,0|1,0,0]=3 941 B14R1.3381 COc1cncc(Br)c1OCCCN Amb33005438 [1,1,0,0,0,0|2,0,0]=4 942 B14R1.3381 COc1nccc(Cl)c1OCCCN Amb33052384 [1,1,0,0,0,0|2,0,0]=4 943 B14R1.3619 COc1c(Br)cccc1CCCCN Amb33007042 [1,1,0,0,0,0|2,0,0]=4 944 B14R1.3619 COc1c(Br)cccc1OCCCN Amb33485656 [1,1,0,0,0,0|1,0,0]=3 945 B14R1.3619 COc1c(C)cccc1CCCCN Amb18815785 [1,1,0,0,0,0|2,0,0]=4 946 B14R1.3619 COc1c(C)cccc1OCCCN Amb33322781 [1,1,0,0,0,0|1,0,0]=3 947 B14R1.3619 COc1c(Cl)cccc1CCCCN Amb33390594 [1,1,0,0,0,0|2,0,0]=4 948 B14R1.3619 COc1c(Cl)cccc1OCCCN Amb33262104 [1,1,0,0,0,0|1,0,0]=3 949 B14R1.3619 COc1c(F)cccc1CCCCN Amb18812273 [1,1,0,0,0,0|2,0,0]=4 950 B14R1.3619 COc1c(F)cccc1OCCCN Amb33375973 [1,1,0,0,0,0|1,0,0]=3 951 B14R1.93 CC(C)(O)COc1ccccc1C#N Amb19050112 [1,1,0,0,0,0|2,0,0]=4 952 B14R1.93 CC(C)(O)COc1ccccc1CN Amb18304086 [1,1,0,0,0,0|2,0,0]=4 953 B14R1.93 CCc1ccccc1NCC(C)(C)O Amb17139432 [1,1,0,0,0,0|2,0,0]=4 954 B14R1.93 CCc1ccccc1OCC(C)(C)N Amb17074748 [1,1,0,0,0,0|2,0,0]=4 955 B14R1.93 COc1ccccc1CCC(C)(C)N Amb17336714 [1,1,0,0,0,0|2,0,0]=4 956 B14R1.93 COc1ccccc1CCC(C)(C)O Amb17336854 [1,1,0,0,0,0|1,0,0]=3 957 B14R1.93 COc1ccccc1NCC(C)(C)C Amb17235700 [1,1,0,0,0,0|2,0,0]=4 958 B14R1.93 COc1ccccc1NCC(C)(C)N Amb27256928 [1,1,0,0,0,0|2,0,0]=4 959 B14R1.93 COc1ccccc1NCC(C)(C)O Amb17139571 [1,1,0,0,0,0|1,0,0]=3 960 B14R1.93 COc1ccccc1OCC(C)(C)N Amb17074745 [1,1,0,0,0,0|1,0,0]=3 961 B14R1.118 CC(O)COc1cccc(F)c1C#N Amb27168954 [1,1,0,0,0,0|2,0,0]=4 962 B14R1.118 COc1c(Br)cccc1CCC(C)N Amb33430241 [1,1,0,0,0,0|2,0,0]=4 963 B14R1.118 COc1c(Br)cccc1CCC(C)O Amb33007433 [1,1,0,0,0,0|1,0,0]=3 964 B14R1.118 COc1c(Br)cccc1CC[C@@H](C)N Amb33242624 [1,1,0,0,0,0|2,0,0]=4 965 B14R1.118 COc1c(Br)cccc1CC[C@@H](C)O Amb33007439 [1,1,0,0,0,0|1,0,0]=3 966 B14R1.118 COc1c(Br)cccc1CC[C@H](C)N Amb33451339 [1,1,0,0,0,0|2,0,0]=4 967 B14R1.118 COc1c(Br)cccc1CC[C@H](C)O Amb33007436 [1,1,0,0,0,0|1,0,0]=3 968 B14R1.118 COc1c(Br)cccc1OCC(=O)O Amb33007682 [1,1,0,0,0,0|0,0,2]=4 969 B14R1.118 COc1c(C)cccc1CCC(C)N Amb33474591 [1,1,0,0,0,0|2,0,0]=4 970 B14R1.118 COc1c(C)cccc1CCC(C)O Amb33323051 [1,1,0,0,0,0|1,0,0]=3 971 B14R1.118 COc1c(C)cccc1CC[C@@H](C)N Amb33475318 [1,1,0,0,0,0|2,0,0]=4 972 B14R1.118 COc1c(C)cccc1CC[C@@H](C)O Amb33323046 [1,1,0,0,0,0|1,0,0]=3 973 B14R1.118 COc1c(C)cccc1CC[C@H](C)N Amb32953507 [1,1,0,0,0,0|2,0,0]=4 974 B14R1.118 COc1c(C)cccc1CC[C@H](C)O Amb33323047 [1,1,0,0,0,0|1,0,0]=3 975 B14R1.118 COc1c(C)cccc1OCC(=O)O Amb33322789 [1,1,0,0,0,0|0,0,2]=4 976 B14R1.118 COc1c(Cl)cccc1CCC(C)N Amb33406674 [1,1,0,0,0,0|2,0,0]=4 977 B14R1.118 COc1c(Cl)cccc1CCC(C)O Amb33262048 [1,1,0,0,0,0|1,0,0]=3 978 B14R1.118 COc1c(Cl)cccc1CC[C@@H](C)N Amb33052290 [1,1,0,0,0,0|2,0,0]=4 979 B14R1.118 COc1c(Cl)cccc1CC[C@@H](C)O Amb33262060 [1,1,0,0,0,0|1,0,0]=3 980 B14R1.118 COc1c(Cl)cccc1CC[C@H](C)N Amb33052705 [1,1,0,0,0,0|2,0,0]=4 981 B14R1.118 COc1c(Cl)cccc1CC[C@H](C)O Amb33262054 [1,1,0,0,0,0|1,0,0]=3 982 B14R1.118 COc1c(Cl)cccc1OCC(=O)O Amb33262200 [1,1,0,0,0,0|0,0,2]=4 983 B14R1.118 COc1c(F)cccc1CCC(C)N Amb18812283 [1,1,0,0,0,0|2,0,0]=4 984 B14R1.118 COc1c(F)cccc1CCC(C)O Amb33197414 [1,1,0,0,0,0|1,0,0]=3 985 B14R1.118 COc1c(F)cccc1CC[C@@H](C)N Amb33448526 [1,1,0,0,0,0|2,0,0]=4 986 B14R1.118 COc1c(F)cccc1CC[C@@H](C)O Amb33197412 [1,1,0,0,0,0|1,0,0]=3 987 B14R1.118 COc1c(F)cccc1CC[C@H](C)N Amb33358382 [1,1,0,0,0,0|2,0,0]=4 988 B14R1.118 COc1c(F)cccc1CC[C@H](C)O Amb33197413 [1,1,0,0,0,0|1,0,0]=3 989 B14R1.118 COc1c(F)cccc1OCC(=O)O Amb33375978 [1,1,0,0,0,0|0,0,2]=4 990 B14R1.118 C[C@H](O)COc1cccc(F)c1C#N Amb27656911 [1,1,0,0,0,0|2,0,0]=4 991 B14R1.482 CCOc1ccccc1CCC(C)N Amb17507333 [1,1,0,0,0,0|2,0,0]=4 992 B14R1.482 CCOc1ccccc1CCC(C)O Amb17507269 [1,1,0,0,0,0|1,0,0]=3 993 B14R1.482 CCOc1ccccc1CC[C@@H](C)N Amb33171920 [1,1,0,0,0,0|2,0,0]=4 994 B14R1.482 CCOc1ccccc1CC[C@@H](C)O Amb33419107 [1,1,0,0,0,0|1,0,0]=3 995 B14R1.482 CCOc1ccccc1CC[C@H](C)N Amb33080382 [1,1,0,0,0,0|2,0,0]=4 996 B14R1.482 CCOc1ccccc1CC[C@H](C)O Amb33419108 [1,1,0,0,0,0|1,0,0]=3 997 B14R1.482 CCOc1ccccc1NCC(C)C Amb6689260 [1,1,0,0,0,0|2,0,0]=4 998 B14R1.482 CCOc1ccccc1OCC(=O)O Amb1102813 [1,1,0,0,0,0|0,0,2]=4 999 B14R1.482 CCOc1ncccc1OCC(C)C Amb19959793 [1,1,0,0,0,0|2,0,0]=4 1000 B14R1.482 CNCc1ccccc1OCC(C)C Amb22588091 [1,1,0,0,0,0|2,0,0]=4 1001 B14R1.482 CNCc1ccccc1OCC(C)C Amb8906201 [1,1,0,0,0,0|2,0,0]=4 1002 B14R1.840 COc1ccccc1C(=O)CC(C)C Amb17139355 [1,1,0,0,0,0|2,0,0]=4 1003 B14R1.840 COc1ccccc1C(N)CC(C)C Amb17139414 [1,1,0,0,0,0|2,0,0]=4 1004 B14R1.840 COc1ccccc1C(O)CC(C)C Amb17139482 [1,1,0,0,0,0|2,0,0]=4 1005 B14R1.840 COc1ccccc1N(C)CC(C)N Amb17059707 [1,1,0,0,0,0|2,0,0]=4 1006 B14R1.840 COc1ccccc1N(C)CC(C)O Amb17337007 [1,1,0,0,0,0|1,0,0]=3 1007 B14R1.1600 CC(O)COc1ccc(Br)cc1C#N Amb27872027 [1,1,0,0,0,0|2,0,0]=4 1008 B14R1.1600 CC(O)COc1ccc(N)cc1C#N Amb27812376 [1,1,0,0,0,0|2,0,0]=4 1009 B14R1.1600 COc1cc(Br)ccc1CCC(C)N Amb33240213 [1,1,0,0,0,0|2,0,0]=4 1010 B14R1.1600 COc1cc(Br)ccc1CCC(C)O Amb33477356 [1,1,0,0,0,0|1,0,0]=3 1011 B14R1.1600 COc1cc(Br)ccc1CC[C@@H](C)N Amb33430060 [1,1,0,0,0,0|2,0,0]=4 1012 B14R1.1600 COc1cc(Br)ccc1CC[C@@H](C)O Amb33477032 [1,1,0,0,0,0|1,0,0]=3 1013 B14R1.1600 COc1cc(Br)ccc1CC[C@H](C)N Amb33452121 [1,1,0,0,0,0|2,0,0]=4 1014 B14R1.1600 COc1cc(Br)ccc1CC[C@H](C)O Amb33477357 [1,1,0,0,0,0|1,0,0]=3 1015 B14R1.1600 COc1cc(Br)ccc1OCC(=O)O Amb5770878 [1,1,0,0,0,0|0,0,2]=4 1016 B14R1.1600 COc1cc(C)ccc1CCC(C)N Amb33080150 [1,1,0,0,0,0|2,0,0]=4 1017 B14R1.1600 COc1cc(C)ccc1CCC(C)O Amb33142626 [1,1,0,0,0,0|1,0,0]=3 1018 B14R1.1600 COc1cc(C)ccc1CC[C@@H](C)N Amb33172282 [1,1,0,0,0,0|2,0,0]=4 1019 B14R1.1600 COc1cc(C)ccc1CC[C@@H](C)O Amb33142624 [1,1,0,0,0,0|1,0,0]=3 1020 B14R1.1600 COc1cc(C)ccc1CC[C@H](C)N Amb33171764 [1,1,0,0,0,0|2,0,0]=4 1021 B14R1.1600 COc1cc(C)ccc1CC[C@H](C)O Amb33142625 [1,1,0,0,0,0|1,0,0]=3 1022 B14R1.1600 COc1cc(C)ccc1OCC(=O)O Amb6356152 [1,1,0,0,0,0|0,0,2]=4 1023 B14R1.1600 COc1cc(C)ccc1OC[C@@H](C)N Amb18538562 [1,1,0,0,0,0|1,0,0]=3 1024 B14R1.1600 COc1cc(Cl)ccc1CCC(C)N Amb32750181 [1,1,0,0,0,0|2,0,0]=4 1025 B14R1.1600 COc1cc(Cl)ccc1CCC(C)O Amb33052214 [1,1,0,0,0,0|1,0,0]=3 1026 B14R1.1600 COc1cc(Cl)ccc1CC[C@@H](C)N Amb33261612 [1,1,0,0,0,0|2,0,0]=4 1027 B14R1.1600 COc1cc(Cl)ccc1CC[C@@H](C)O Amb33052220 [1,1,0,0,0,0|1,0,0]=3 1028 B14R1.1600 COc1cc(Cl)ccc1CC[C@H](C)N Amb32750147 [1,1,0,0,0,0|2,0,0]=4 1029 B14R1.1600 COc1cc(Cl)ccc1CC[C@H](C)O Amb33052217 [1,1,0,0,0,0|1,0,0]=3 1030 B14R1.1600 COc1cc(Cl)ccc1OCC(=O)O Amb4574106 [1,1,0,0,0,0|0,0,2]=4 1031 B14R1.1600 COc1cc(F)ccc1CCC(C)N Amb33172498 [1,1,0,0,0,0|2,0,0]=4 1032 B14R1.1600 COc1cc(F)ccc1CCC(C)O Amb33313269 [1,1,0,0,0,0|1,0,0]=3 1033 B14R1.1600 COc1cc(F)ccc1CC[C@@H](C)N Amb33474822 [1,1,0,0,0,0|2,0,0]=4 1034 B14R1.1600 COc1cc(F)ccc1CC[C@@H](C)O Amb33313267 [1,1,0,0,0,0|1,0,0]=3 1035 B14R1.1600 COc1cc(F)ccc1CC[C@H](C)N Amb33449324 [1,1,0,0,0,0|2,0,0]=4 1036 B14R1.1600 COc1cc(F)ccc1CC[C@H](C)O Amb33313268 [1,1,0,0,0,0|1,0,0]=3 1037 B14R1.1600 COc1cc(F)ccc1NCC(C)C Amb19054301 [1,1,0,0,0,0|2,0,0]=4 1038 B14R1.1600 COc1cc(F)ccc1OCC(=O)O Amb33080009 [1,1,0,0,0,0|0,0,2]=4 1039 B14R1.1600 COc1cc(N)ccc1OCC(C)C Amb2792649 [1,1,0,0,0,0|1,0,0]=3 1040 B14R1.1600 COc1cc(N)ccc1OCC(F)F Amb20619569 [1,1,0,0,0,0|2,0,0]=4 1041 B14R1.1600 COc1cc(N)ccc1OCC(F)F Amb22279454 [1,1,0,0,0,0|2,0,0]=4 1042 B14R1.1600 COc1cc(O)ccc1CCC(C)N Amb33474089 [1,1,0,0,0,0|2,0,0]=4 1043 B14R1.1600 COc1cc(O)ccc1CCC(C)O Amb33312475 [1,1,0,0,0,0|1,0,0]=3 1044 B14R1.1600 COc1cc(O)ccc1CC[C@@H](C)N Amb33358867 [1,1,0,0,0,0|2,0,0]=4 1045 B14R1.1600 COc1cc(O)ccc1CC[C@@H](C)O Amb33312473 [1,1,0,0,0,0|1,0,0]=3 1046 B14R1.1600 COc1cc(O)ccc1CC[C@H](C)N Amb33359002 [1,1,0,0,0,0|2,0,0]=4 1047 B14R1.1600 COc1cc(O)ccc1CC[C@H](C)O Amb33312474 [1,1,0,0,0,0|1,0,0]=3 1048 B14R1.1600 COc1cc(O)ccc1OCC(=O)O Amb33474695 [1,1,0,0,0,0|0,0,2]=4 1049 B14R1.1600 COc1nc(Cl)ccc1CCC(C)O Amb33222066 [1,1,0,0,0,0|2,0,0]=4 1050 B14R1.1600 COc1nc(Cl)ccc1CC[C@@H](C)O Amb33222071 [1,1,0,0,0,0|2,0,0]=4 1051 B14R1.1600 COc1nc(Cl)ccc1CC[C@H](C)O Amb33222069 [1,1,0,0,0,0|2,0,0]=4 1052 B14R1.1600 C[C@H](O)COc1ccc(Br)cc1C#N Amb28245672 [1,1,0,0,0,0|2,0,0]=4 1053 B14R1.1865 COc1ccc(Br)cc1CCC(C)N Amb18228429 [1,1,0,0,0,0|2,0,0]=4 1054 B14R1.1865 COc1ccc(Br)cc1CCC(C)O Amb33451133 [1,1,0,0,0,0|1,0,0]=3 1055 B14R1.1865 COc1ccc(Br)cc1CC[C@@H](C)N Amb33241439 [1,1,0,0,0,0|2,0,0]=4 1056 B14R1.1865 COc1ccc(Br)cc1CC[C@@H](C)O Amb33331991 [1,1,0,0,0,0|1,0,0]=3 1057 B14R1.1865 COc1ccc(Br)cc1CC[C@H](C)N Amb33451333 [1,1,0,0,0,0|2,0,0]=4 1058 B14R1.1865 COc1ccc(Br)cc1CC[C@H](C)O Amb33331989 [1,1,0,0,0,0|1,0,0]=3 1059 B14R1.1865 COc1ccc(Br)cc1OCC(=O)O Amb18668301 [1,1,0,0,0,0|0,0,2]=4 1060 B14R1.1865 COc1ccc(C)cc1CCC(C)N Amb5740116 [1,1,0,0,0,0|2,0,0]=4 1061 B14R1.1865 COc1ccc(C)cc1CCC(C)O Amb19051738 [1,1,0,0,0,0|1,0,0]=3 1062 B14R1.1865 COc1ccc(C)cc1CC[C@@H](C)N Amb33429852 [1,1,0,0,0,0|2,0,0]=4 1063 B14R1.1865 COc1ccc(C)cc1CC[C@@H](C)O Amb33312091 [1,1,0,0,0,0|1,0,0]=3 1064 B14R1.1865 COc1ccc(C)cc1CC[C@H](C)N Amb33359271 [1,1,0,0,0,0|2,0,0]=4 1065 B14R1.1865 COc1ccc(C)cc1CC[C@H](C)O Amb33312092 [1,1,0,0,0,0|1,0,0]=3 1066 B14R1.1865 COc1ccc(C)cc1NCC(C)C Amb6693724 [1,1,0,0,0,0|2,0,0]=4 1067 B14R1.1865 COc1ccc(C)cc1NCC(C)O Amb17139570 [1,1,0,0,0,0|1,0,0]=3 1068 B14R1.1865 COc1ccc(C)cc1NC[C@H](C)O Amb27219299 [1,1,0,0,0,0|1,0,0]=3 1069 B14R1.1865 COc1ccc(C)cc1OCC(=O)O Amb33200181 [1,1,0,0,0,0|0,0,2]=4 1070 B14R1.1865 COc1ccc(C)cc1SCC(C)N Amb18569354 [1,1,0,0,0,0|1,1,0]=4 1071 B14R1.1865 COc1ccc(C)cc1\C=C\C(C)O Amb24593245 [1,1,0,0,0,0|1,0,1]=4 1072 B14R1.1865 COc1ccc(Cl)cc1CCC(C)N Amb9511561 [1,1,0,0,0,0|2,0,0]=4 1073 B14R1.1865 COc1ccc(Cl)cc1CCC(C)O Amb33262151 [1,1,0,0,0,0|1,0,0]=3 1074 B14R1.1865 COc1ccc(Cl)cc1CC[C@@H](C)N Amb33052093 [1,1,0,0,0,0|2,0,0]=4 1075 B14R1.1865 COc1ccc(Cl)cc1CC[C@@H](C)O Amb33413880 [1,1,0,0,0,0|1,0,0]=3 1076 B14R1.1865 COc1ccc(Cl)cc1CC[C@H](C)N Amb33261285 [1,1,0,0,0,0|2,0,0]=4 1077 B14R1.1865 COc1ccc(Cl)cc1CC[C@H](C)O Amb33413879 [1,1,0,0,0,0|1,0,0]=3 1078 B14R1.1865 COc1ccc(Cl)cc1NCC(C)C Amb6693554 [1,1,0,0,0,0|2,0,0]=4 1079 B14R1.1865 COc1ccc(Cl)cc1NCC(C)O Amb17140949 [1,1,0,0,0,0|1,0,0]=3 1080 B14R1.1865 COc1ccc(Cl)cc1NC[C@@H](C)O Amb28348819 [1,1,0,0,0,0|1,0,0]=3 1081 B14R1.1865 COc1ccc(Cl)cc1NC[C@H](C)O Amb27495311 [1,1,0,0,0,0|1,0,0]=3 1082 B14R1.1865 COc1ccc(Cl)cc1OCC(=O)O Amb33262594 [1,1,0,0,0,0|0,0,2]=4 1083 B14R1.1865 COc1ccc(Cl)cc1SCC(C)N Amb18070624 [1,1,0,0,0,0|1,1,0]=4 1084 B14R1.1865 COc1ccc(Cl)cc1\C=C\C(C)O Amb25283023 [1,1,0,0,0,0|1,0,1]=4 1085 B14R1.1865 COc1ccc(F)cc1CCC(C)N Amb18812294 [1,1,0,0,0,0|2,0,0]=4 1086 B14R1.1865 COc1ccc(F)cc1CCC(C)O Amb33361060 [1,1,0,0,0,0|1,0,0]=3 1087 B14R1.1865 COc1ccc(F)cc1CC[C@@H](C)N Amb33171506 [1,1,0,0,0,0|2,0,0]=4 1088 B14R1.1865 COc1ccc(F)cc1CC[C@@H](C)O Amb33270507 [1,1,0,0,0,0|1,0,0]=3 1089 B14R1.1865 COc1ccc(F)cc1CC[C@H](C)N Amb33079523 [1,1,0,0,0,0|2,0,0]=4 1090 B14R1.1865 COc1ccc(F)cc1CC[C@H](C)O Amb33270508 [1,1,0,0,0,0|1,0,0]=3 1091 B14R1.1865 COc1ccc(F)cc1NCC(C)C Amb28144621 [1,1,0,0,0,0|2,0,0]=4 1092 B14R1.1865 COc1ccc(F)cc1NCC(C)O Amb18933525 [1,1,0,0,0,0|1,0,0]=3 1093 B14R1.1865 COc1ccc(F)cc1OCC(=O)O Amb32953268 [1,1,0,0,0,0|0,0,2]=4 1094 B14R1.1865 COc1ccc(F)cc1\C=C\C(C)O Amb25279979 [1,1,0,0,0,0|1,0,1]=4 1095 B14R1.1865 COc1ccc(N)cc1OCC(F)F Amb20619503 [1,1,0,0,0,0|2,0,0]=4 1096 B14R1.1865 COc1ncc(Br)cc1CCC(C)O Amb33432097 [1,1,0,0,0,0|2,0,0]=4 1097 B14R1.1865 COc1ncc(Br)cc1CC[C@@H](C)O Amb33432105 [1,1,0,0,0,0|2,0,0]=4 1098 B14R1.1865 COc1ncc(Br)cc1CC[C@H](C)O Amb33432102 [1,1,0,0,0,0|2,0,0]=4 1099 B14R1.1865 C[C@@H](O)COc1cc(Br)ccc1C#N Amb27392439 [1,1,0,0,0,0|2,0,0]=4 1100 B14R1.1865 C[C@@H](O)COc1cc(Cl)ccc1C#N Amb27404228 [1,1,0,0,0,0|2,0,0]=4 1101 B14R1.2172 CCc1cccc(C)c1NCC(C)O Amb17139418 [1,1,0,0,0,0|2,0,0]=4 1102 B14R1.2172 COc1cccc(Br)c1CCC(C)N Amb33243002 [1,1,0,0,0,0|2,0,0]=4 1103 B14R1.2172 COc1cccc(Br)c1CCC(C)O Amb33451745 [1,1,0,0,0,0|1,0,0]=3 1104 B14R1.2172 COc1cccc(Br)c1CC[C@@H](C)N Amb33451327 [1,1,0,0,0,0|2,0,0]=4 1105 B14R1.2172 COc1cccc(Br)c1CC[C@@H](C)O Amb33451752 [1,1,0,0,0,0|1,0,0]=3 1106 B14R1.2172 COc1cccc(Br)c1CC[C@H](C)N Amb33263064 [1,1,0,0,0,0|2,0,0]=4 1107 B14R1.2172 COc1cccc(Br)c1CC[C@H](C)O Amb33451750 [1,1,0,0,0,0|1,0,0]=3 1108 B14R1.2172 COc1cccc(Br)c1OCC(=O)O Amb32946308 [1,1,0,0,0,0|0,0,2]=4 1109 B14R1.2172 COc1cccc(C)c1CCC(C)N Amb33447285 [1,1,0,0,0,0|2,0,0]=4 1110 B14R1.2172 COc1cccc(C)c1CCC(C)O Amb33447284 [1,1,0,0,0,0|1,0,0]=3 1111 B14R1.2172 COc1cccc(C)c1CC[C@@H](C)N Amb33447281 [1,1,0,0,0,0|2,0,0]=4 1112 B14R1.2172 COc1cccc(C)c1CC[C@@H](C)O Amb33447282 [1,1,0,0,0,0|1,0,0]=3 1113 B14R1.2172 COc1cccc(C)c1CC[C@H](C)N Amb33447280 [1,1,0,0,0,0|2,0,0]=4 1114 B14R1.2172 COc1cccc(C)c1CC[C@H](C)O Amb33447283 [1,1,0,0,0,0|1,0,0]=3 1115 B14R1.2172 COc1cccc(C)c1OCC(=O)O Amb33079783 [1,1,0,0,0,0|0,0,2]=4 1116 B14R1.2172 COc1cccc(Cl)c1CCC(C)N Amb33256730 [1,1,0,0,0,0|2,0,0]=4 1117 B14R1.2172 COc1cccc(Cl)c1CCC(C)O Amb33258789 [1,1,0,0,0,0|1,0,0]=3 1118 B14R1.2172 COc1cccc(Cl)c1CC[C@@H](C)N Amb33257037 [1,1,0,0,0,0|2,0,0]=4 1119 B14R1.2172 COc1cccc(Cl)c1CC[C@@H](C)O Amb33257033 [1,1,0,0,0,0|1,0,0]=3 1120 B14R1.2172 COc1cccc(Cl)c1CC[C@H](C)N Amb33257042 [1,1,0,0,0,0|2,0,0]=4 1121 B14R1.2172 COc1cccc(Cl)c1CC[C@H](C)O Amb33256736 [1,1,0,0,0,0|1,0,0]=3 1122 B14R1.2172 COc1cccc(Cl)c1OCC(=O)O Amb33052096 [1,1,0,0,0,0|0,0,2]=4 1123 B14R1.2172 COc1cccc(F)c1CCC(C)N Amb33474685 [1,1,0,0,0,0|2,0,0]=4 1124 B14R1.2172 COc1cccc(F)c1CCC(C)O Amb33201614 [1,1,0,0,0,0|1,0,0]=3 1125 B14R1.2172 COc1cccc(F)c1CC[C@@H](C)N Amb32953894 [1,1,0,0,0,0|2,0,0]=4 1126 B14R1.2172 COc1cccc(F)c1CC[C@@H](C)O Amb33201612 [1,1,0,0,0,0|1,0,0]=3 1127 B14R1.2172 COc1cccc(F)c1CC[C@H](C)N Amb33172010 [1,1,0,0,0,0|2,0,0]=4 1128 B14R1.2172 COc1cccc(F)c1CC[C@H](C)O Amb33201613 [1,1,0,0,0,0|1,0,0]=3 1129 B14R1.2172 COc1cccc(F)c1OCC(=O)O Amb24100460 [1,1,0,0,0,0|0,0,2]=4 1130 B14R1.2172 COc1cncc(Br)c1CCC(C)O Amb33389313 [1,1,0,0,0,0|2,0,0]=4 1131 B14R1.2172 COc1cncc(Br)c1CC[C@@H](C)O Amb33476785 [1,1,0,0,0,0|2,0,0]=4 1132 B14R1.2172 COc1cncc(Br)c1CC[C@H](C)O Amb33389316 [1,1,0,0,0,0|2,0,0]=4 1133 B14R1.2172 COc1nccc(Cl)c1CCC(C)O Amb33052177 [1,1,0,0,0,0|2,0,0]=4 1134 B14R1.2172 COc1nccc(Cl)c1CC[C@@H](C)O Amb33052182 [1,1,0,0,0,0|2,0,0]=4 1135 B14R1.2172 COc1nccc(Cl)c1CC[C@H](C)O Amb33484769 [1,1,0,0,0,0|2,0,0]=4 1136 B14R1.3135 CC(Oc1ccccc1C#N)[C@@H](C)O Amb35695651 [1,1,0,0,0,0|2,0,0]=4 1137 B14R1.3135 CC(Oc1ccccc1C#N)[C@H](C)O Amb35695652 [1,1,0,0,0,0|2,0,0]=4 1138 B14R1.3135 CCc1ccccc1NC(C)C(C)O Amb27833196 [1,1,0,0,0,0|2,0,0]=4 1139 B14R1.3135 COc1ccccc1CC(Br)C(C)C Amb18049524 [1,1,0,0,0,0|2,0,0]=4 1140 B14R1.3135 COc1ccccc1CC(C)C(C)N Amb17235719 [1,1,0,0,0,0|2,0,0]=4 1141 B14R1.3135 COc1ccccc1CC(C)[C@@H](C)N Amb33731283 [1,1,0,0,0,0|2,0,0]=4 1142 B14R1.3135 COc1ccccc1CC(C)[C@H](C)N Amb33729327 [1,1,0,0,0,0|2,0,0]=4 1143 B14R1.3135 COc1ccccc1CC(N)C(C)C Amb19009247 [1,1,0,0,0,0|2,0,0]=4 1144 B14R1.3135 COc1ccccc1NC(=O)C(C)O Amb11209042 [1,1,0,0,0,0|1,0,1]=4 1145 B14R1.3135 COc1ccccc1NC(=O)[C@H](C)O Amb27957789 [1,1,0,0,0,0|1,0,1]=4 1146 B14R1.3135 COc1ccccc1NC(C)C(C)C Amb6688390 [1,1,0,0,0,0|2,0,0]=4 1147 B14R1.3135 COc1ccccc1N[C@@H](C)[C@@H](C)O Amb27411846 [1,1,0,0,0,0|1,0,0]=3 1148 B14R1.3135 COc1ccccc1N[C@H](C)[C@@H](C)O Amb28251292 [1,1,0,0,0,0|1,0,0]=3 1149 B14R1.3135 COc1ccccc1OC(=O)C(C)N Amb17336946 [1,1,0,0,0,0|1,0,1]=4 1150 B14R1.3135 COc1ccccc1OC(C)C(=O)O Amb6335883 [1,1,0,0,0,0|0,0,2]=4 1151 B14R1.3135 CSc1ccccc1NC(C)C(C)O Amb27661833 [1,1,0,0,0,0|1,1,0]=4 1152 B14R1.4522 CC(=O)c1ccccc1OCC(C)C Amb6264663 [1,1,0,0,0,0|2,0,0]=4 1153 B14R1.4522 CC(C)COc1ccccc1C(C)N Amb1136748 [1,1,0,0,0,0|2,0,0]=4 1154 B14R1.4522 CC(C)COc1ccccc1C(C)O Amb9364313 [1,1,0,0,0,0|2,0,0]=4 1155 B14R1.4522 CC(C)c1ccccc1CC[C@@H](C)O Amb33273792 [1,1,0,0,0,0|2,0,0]=4 1156 B14R1.4522 CC(C)c1ccccc1CC[C@H](C)O Amb33273793 [1,1,0,0,0,0|2,0,0]=4 1157 B14R1.4522 CC(C)c1ccccc1NC[C@@H](C)O Amb27475761 [1,1,0,0,0,0|2,0,0]=4 1158 B14R1.4522 CC(C)c1ccccc1NC[C@H](C)O Amb27983408 [1,1,0,0,0,0|2,0,0]=4 1159 B14R1.4522 CC(C)c1ccccc1OC[C@@H](C)N Amb18538545 [1,1,0,0,0,0|2,0,0]=4 1160 B14R1.4522 CC(N)COc1ccccc1C(C)C Amb1128580 [1,1,0,0,0,0|2,0,0]=4 1161 B14R1.4522 CC(O)CCc1ccccc1C(C)C Amb33172685 [1,1,0,0,0,0|2,0,0]=4 1162 B14R1.4522 CC(O)CCc1ccccc1N(C)C Amb32880103 [1,1,0,0,0,0|2,0,0]=4 1163 B14R1.4522 CC(O)CNc1ccccc1C(C)C Amb17139419 [1,1,0,0,0,0|2,0,0]=4 1164 B14R1.4522 CC(O)CNc1ccccc1N(C)C Amb18933529 [1,1,0,0,0,0|2,0,0]=4 1165 B14R1.4522 C[C@@H](O)CCc1ccccc1N(C)C Amb32880101 [1,1,0,0,0,0|2,0,0]=4 1166 B14R1.4522 C[C@H](O)CCc1ccccc1N(C)C Amb32880102 [1,1,0,0,0,0|2,0,0]=4 1167 B14R1.15 CC(CO)COc1cccc(Cl)c1Cl Amb17251984 [1,1,0,0,0,0|2,0,0]=4 1168 B14R1.15 CC[C@H](O)CNc1cccc(Br)c1C Amb28291313 [1,1,0,0,0,0|2,0,0]=4 1169 B14R1.15 CC[C@H](O)CNc1cccc(F)c1C Amb28183616 [1,1,0,0,0,0|2,0,0]=4 1170 B14R1.15 CC[C@H](O)CNc1cccc(I)c1C Amb27396184 [1,1,0,0,0,0|2,0,0]=4 1171 B14R1.15 Cc1c(Cl)cccc1NCC(C)CO Amb28189653 [1,1,0,0,0,0|2,0,0]=4 1172 B14R1.15 Cc1c(Cl)cccc1NCC(O)CN Amb17140906 [1,1,0,0,0,0|2,0,0]=4 1173 B14R1.15 Cc1c(Cl)cccc1NCC(O)CO Amb17340464 [1,1,0,0,0,0|1,0,0]=3 1174 B14R1.15 Cc1c(Cl)cncc1NCC(O)CO Amb29864716 [1,1,0,0,0,0|2,0,0]=4 1175 B14R1.15 Cc1c(Cl)cncc1NC[C@H](O)CO Amb35706771 [1,1,0,0,0,0|2,0,0]=4 1176 B14R1.15 Cc1c(I)cccc1NC[C@H](O)CO Amb28121553 [1,1,0,0,0,0|1,0,0]=3 1177 B14R1.15 Cc1cccc(CCC(O)CN)c1C Amb18565422 [1,1,0,0,0,0|2,0,0]=4 1178 B14R1.15 Cc1cccc(NCC(C)CO)c1C Amb28387864 [1,1,0,0,0,0|2,0,0]=4 1179 B14R1.15 Cc1cccc(NCC(O)CN)c1C Amb17139520 [1,1,0,0,0,0|2,0,0]=4 1180 B14R1.15 Cc1cccc(NCC(O)CO)c1C Amb17336984 [1,1,0,0,0,0|1,0,0]=3 1181 B14R1.15 Cc1cccc(NCC(O)CO)c1Cl Amb27758360 [1,1,0,0,0,0|2,0,0]=4 1182 B14R1.15 Cc1cccc(OCC(=O)CO)c1C Amb18565502 [1,1,0,0,0,0|0,0,2]=4 1183 B14R1.15 Cc1cccc(OCC(C)CN)c1C Amb8868857 [1,1,0,0,0,0|2,0,0]=4 1184 B14R1.15 Cc1cccc(OCC(C)CO)c1C Amb17236045 [1,1,0,0,0,0|1,0,0]=3 1185 B14R1.15 Cc1cccc(OCC(N)CO)c1C Amb18565769 [1,1,0,0,0,0|1,0,0]=3 1186 B14R1.15 Cc1cccc(OCC(O)CN)c1C Amb9708678 [1,1,0,0,0,0|1,0,0]=3 1187 B14R1.15 NC(CO)COc1cccc(Cl)c1Cl Amb18070962 [1,1,0,0,0,0|2,0,0]=4 1188 B14R1.15 NCC(O)COc1cccc(Cl)c1Cl Amb6280295 [1,1,0,0,0,0|2,0,0]=4 1189 B14R1.15 Nc1c(Cl)cccc1NCC(O)CO Amb28077412 [1,1,0,0,0,0|2,0,0]=4 1190 B14R1.15 OCC(O)CNc1cccc(Br)c1Cl Amb35721439 [1,1,0,0,0,0|2,0,0]=4 1191 B14R1.15 OCC(O)CNc1cccc(Br)c1F Amb30030722 [1,1,0,0,0,0|2,0,0]=4 1192 B14R1.15 OCC(O)CNc1cccc(Cl)c1Cl Amb17346786 [1,1,0,0,0,0|2,0,0]=4 1193 B14R1.15 OCC(O)CNc1cccc(F)c1Cl Amb30016080 [1,1,0,0,0,0|2,0,0]=4 1194 B14R1.15 OC[C@@H](O)CNc1cccc(Br)c1Cl Amb35721440 [1,1,0,0,0,0|2,0,0]=4 1195 B14R1.15 OC[C@@H](O)CNc1cccc(Br)c1F Amb30030723 [1,1,0,0,0,0|2,0,0]=4 1196 B14R1.15 OC[C@@H](O)CNc1cccc(Cl)c1F Amb27165524 [1,1,0,0,0,0|2,0,0]=4 1197 B14R1.15 OC[C@@H](O)CNc1cccc(F)c1Cl Amb30016081 [1,1,0,0,0,0|2,0,0]=4 1198 B14R1.15 OC[C@@H](O)CNc1cccc(F)c1I Amb27410768 [1,1,0,0,0,0|2,0,0]=4 1199 B14R1.161 Cc1ccccc1OCC(C)C(=O)O Amb9399549 [1,1,0,0,0,0|1,0,1]=4 1200 B14R1.161 Cc1ccccc1OCC(O)C(=O)O Amb6315901 [1,1,0,0,0,0|0,0,1]=3 1201 B14R1.161 Cc1ccccc1OC[C@@H](N)C(C)C Amb17235785 [1,1,0,0,0,0|2,0,0]=4 1202 B14R1.298 CC(C)(CO)COc1ccccc1Br Amb17266799 [1,1,0,0,0,0|2,0,0]=4 1203 B14R1.298 CC(C)(CO)COc1ccccc1Cl Amb17241817 [1,1,0,0,0,0|2,0,0]=4 1204 B14R1.298 CC(C)(CO)COc1ccccc1F Amb17236734 [1,1,0,0,0,0|2,0,0]=4 1205 B14R1.298 CC(O)(CN)COc1ccccc1Br Amb17077009 [1,1,0,0,0,0|2,0,0]=4 1206 B14R1.298 CC(O)(CN)COc1ccccc1Cl Amb17077006 [1,1,0,0,0,0|2,0,0]=4 1207 B14R1.298 CC(O)(CN)COc1ccccc1F Amb17077003 [1,1,0,0,0,0|2,0,0]=4 1208 B14R1.298 Cc1ccccc1OCC(C)(C)CN Amb17235781 [1,1,0,0,0,0|2,0,0]=4 1209 B14R1.298 Cc1ccccc1OCC(C)(C)CO Amb17236016 [1,1,0,0,0,0|1,0,0]=3 1210 B14R1.298 Cc1ccccc1OCC(C)(O)CN Amb17077000 [1,1,0,0,0,0|1,0,0]=3 1211 B14R1.298 Cc1ccccc1OCC(F)(F)CN Amb33169488 [1,1,0,0,0,0|2,0,0]=4 1212 B14R1.387 Cc1ccccc1CNC(CO)CO Amb33362930 [1,1,0,0,0,0|2,0,0]=4 1213 B14R1.387 OCC(CO)NCc1ccccc1O Amb33362973 [1,1,0,0,0,0|2,0,0]=4 1214 B14R1.587 Cc1ccccc1N(C)CC(O)CF Amb33220304 [1,1,0,0,0,0|2,0,0]=4 1215 B14R1.598 CNCC(O)COc1ccccc1Cl Amb6678589 [1,1,0,0,0,0|2,0,0]=4 1216 B14R1.598 Cc1ccccc1CCC(O)CC#N Amb17234675 [1,1,0,0,0,0|2,0,0]=4 1217 B14R1.598 Cc1ccccc1OCC(N)CC#N Amb17401431 [1,1,0,0,0,0|2,0,0]=4 1218 B14R1.598 Cc1ccccc1OCC(O)CC#N Amb17235072 [1,1,0,0,0,0|1,0,0]=3 1219 B14R1.598 N#CCC(O)COc1ccccc1Br Amb17264903 [1,1,0,0,0,0|2,0,0]=4 1220 B14R1.598 N#CCC(O)COc1ccccc1Cl Amb17241024 [1,1,0,0,0,0|2,0,0]=4 1221 B14R1.598 N#CCC(O)COc1ccccc1F Amb17236154 [1,1,0,0,0,0|2,0,0]=4 1222 B14R1.727 CC(CO)COc1ccc(Cl)cc1Cl Amb17251981 [1,1,0,0,0,0|2,0,0]=4 1223 B14R1.727 CC(CO)COc1ccc(F)cc1Cl Amb17243519 [1,1,0,0,0,0|2,0,0]=4 1224 B14R1.727 CC(CO)COc1ccc(F)cc1F Amb17237410 [1,1,0,0,0,0|2,0,0]=4 1225 B14R1.727 CCC(O)CNc1ccc(N)cc1C Amb28370120 [1,1,0,0,0,0|2,0,0]=4 1226 B14R1.727 CC[C@H](O)CNc1ccc(C)cc1C Amb27964455 [1,1,0,0,0,0|2,0,0]=4 1227 B14R1.727 Cc1cc(Br)ccc1NCC(O)CN Amb17163112 [1,1,0,0,0,0|2,0,0]=4 1228 B14R1.727 Cc1cc(Br)ccc1NCC(O)CO Amb17357391 [1,1,0,0,0,0|1,0,0]=3 1229 B14R1.727 Cc1cc(Cl)ccc1NCC(C)CO Amb27414032 [1,1,0,0,0,0|2,0,0]=4 1230 B14R1.727 Cc1cc(Cl)ccc1NCC(O)CN Amb17140908 [1,1,0,0,0,0|2,0,0]=4 1231 B14R1.727 Cc1cc(Cl)ccc1NCC(O)CO Amb17340466 [1,1,0,0,0,0|1,0,0]=3 1232 B14R1.727 Cc1cc(Cl)ccc1OCC(=O)CO Amb18569765 [1,1,0,0,0,0|0,0,2]=4 1233 B14R1.727 Cc1cc(Cl)ccc1OCC(C)CN Amb9392670 [1,1,0,0,0,0|2,0,0]=4 1234 B14R1.727 Cc1cc(Cl)ccc1OCC(C)CO Amb17241833 [1,1,0,0,0,0|1,0,0]=3 1235 B14R1.727 Cc1cc(Cl)ccc1OCC(N)CO Amb18569893 [1,1,0,0,0,0|1,0,0]=3 1236 B14R1.727 Cc1cc(Cl)ccc1OCC(O)CN Amb1137370 [1,1,0,0,0,0|1,0,0]=3 1237 B14R1.727 Cc1cc(Cl)cnc1NCC(O)CO Amb35676573 [1,1,0,0,0,0|2,0,0]=4 1238 B14R1.727 Cc1cc(F)ccc1NCC(C)CO Amb27393490 [1,1,0,0,0,0|2,0,0]=4 1239 B14R1.727 Cc1cc(F)ccc1NCC(O)CF Amb27191869 [1,1,0,0,0,0|2,0,0]=4 1240 B14R1.727 Cc1cc(F)ccc1NCC(O)CO Amb19006720 [1,1,0,0,0,0|1,0,0]=3 1241 B14R1.727 Cc1cc(F)ccc1SCC(O)CN Amb17083184 [1,1,0,0,0,0|1,1,0]=4 1242 B14R1.727 Cc1ccc(CCC(O)CN)c(C)c1 Amb18565420 [1,1,0,0,0,0|2,0,0]=4 1243 B14R1.727 Cc1ccc(NCC(O)CN)c(C)c1 Amb17139515 [1,1,0,0,0,0|2,0,0]=4 1244 B14R1.727 Cc1ccc(NCC(O)CO)c(Br)c1 Amb17307363 [1,1,0,0,0,0|2,0,0]=4 1245 B14R1.727 Cc1ccc(NCC(O)CO)c(Cl)c1 Amb18304484 [1,1,0,0,0,0|2,0,0]=4 1246 B14R1.727 Cc1ccc(OCC(=O)CO)c(C)c1 Amb18565501 [1,1,0,0,0,0|0,0,2]=4 1247 B14R1.727 Cc1ccc(OCC(C)CN)c(C)c1 Amb9029207 [1,1,0,0,0,0|2,0,0]=4 1248 B14R1.727 Cc1ccc(OCC(C)CO)c(C)c1 Amb17236042 [1,1,0,0,0,0|1,0,0]=3 1249 B14R1.727 Cc1ccc(OCC(N)CO)c(C)c1 Amb18565768 [1,1,0,0,0,0|1,0,0]=3 1250 B14R1.727 Cc1ccc(OCC(O)CN)c(C)c1 Amb1292227 [1,1,0,0,0,0|1,0,0]=3 1251 B14R1.727 Cc1ccc(OCC(O)CN)c(C)c1 Amb2581664 [1,1,0,0,0,0|1,0,0]=3 1252 B14R1.727 Cc1ccc(SCC(O)CN)c(C)c1 Amb6678695 [1,1,0,0,0,0|1,1,0]=4 1253 B14R1.727 Cc1cnc(NCC(O)CO)c(C)c1 Amb27208396 [1,1,0,0,0,0|2,0,0]=4 1254 B14R1.727 NC(CO)COc1ccc(Cl)cc1Cl Amb18071000 [1,1,0,0,0,0|2,0,0]=4 1255 B14R1.727 NC(CO)COc1ccc(F)cc1Cl Amb18067971 [1,1,0,0,0,0|2,0,0]=4 1256 B14R1.727 NC(CO)COc1ccc(F)cc1F Amb18566634 [1,1,0,0,0,0|2,0,0]=4 1257 B14R1.727 NCC(O)COc1ccc(Br)cc1Cl Amb9204563 [1,1,0,0,0,0|2,0,0]=4 1258 B14R1.727 NCC(O)COc1ccc(Br)cc1F Amb9207737 [1,1,0,0,0,0|2,0,0]=4 1259 B14R1.727 NCC(O)COc1ccc(Cl)cc1Cl Amb1132571 [1,1,0,0,0,0|2,0,0]=4 1260 B14R1.727 OCC(O)CNc1ccc(Cl)cc1Br Amb27396213 [1,1,0,0,0,0|2,0,0]=4 1261 B14R1.727 OCC(O)CNc1ccc(Cl)cc1I Amb27754802 [1,1,0,0,0,0|2,0,0]=4 1262 B14R1.727 OCC(O)CNc1ccc(F)cc1Br Amb27956232 [1,1,0,0,0,0|2,0,0]=4 1263 B14R1.727 OCC(O)CNc1ccc(F)cc1F Amb17307297 [1,1,0,0,0,0|2,0,0]=4 1264 B14R1.727 OCC(O)CNc1ccc(F)cc1I Amb27446906 [1,1,0,0,0,0|2,0,0]=4 1265 B14R1.727 OCC(O)CNc1ccc(I)cc1F Amb35596899 [1,1,0,0,0,0|2,0,0]=4 1266 B14R1.727 OC[C@@H](O)CNc1ccc(Br)cc1Cl Amb27791490 [1,1,0,0,0,0|2,0,0]=4 1267 B14R1.727 OC[C@@H](O)CNc1ccc(Cl)cc1Cl Amb28183844 [1,1,0,0,0,0|2,0,0]=4 1268 B14R1.727 OC[C@@H](O)CNc1ccc(F)cc1Br Amb27806779 [1,1,0,0,0,0|2,0,0]=4 1269 B14R1.727 OC[C@@H](O)CNc1ccc(I)cc1Br Amb28314424 [1,1,0,0,0,0|2,0,0]=4 1270 B14R1.727 OC[C@@H](O)CNc1ccc(I)cc1Cl Amb27857162 [1,1,0,0,0,0|2,0,0]=4 1271 B14R1.727 OC[C@@H](O)CNc1ccc(I)cc1F Amb35596900 [1,1,0,0,0,0|2,0,0]=4 1272 B14R1.820 CC(CO)COc1cc(Cl)ccc1Cl Amb17251978 [1,1,0,0,0,0|2,0,0]=4 1273 B14R1.820 CC[C@@H](O)CNc1cc(Cl)ccc1C Amb27873012 [1,1,0,0,0,0|2,0,0]=4 1274 B14R1.820 CC[C@@H](O)CNc1cc(I)ccc1C Amb28256127 [1,1,0,0,0,0|2,0,0]=4 1275 B14R1.820 CC[C@H](O)CNc1cc(C)ccc1C Amb28140039 [1,1,0,0,0,0|2,0,0]=4 1276 B14R1.820 Cc1ccc(Br)c(NC[C@H](O)CO)c1 Amb27418375 [1,1,0,0,0,0|2,0,0]=4 1277 B14R1.820 Cc1ccc(Br)cc1NCC(O)CO Amb28070164 [1,1,0,0,0,0|1,0,0]=3 1278 B14R1.820 Cc1ccc(Br)cc1NC[C@H](O)CO Amb27769816 [1,1,0,0,0,0|1,0,0]=3 1279 B14R1.820 Cc1ccc(C)c(CCC(O)CN)c1 Amb18565413 [1,1,0,0,0,0|2,0,0]=4 1280 B14R1.820 Cc1ccc(C)c(NCC(O)CN)c1 Amb17139516 [1,1,0,0,0,0|2,0,0]=4 1281 B14R1.820 Cc1ccc(C)c(NCC(O)CO)c1 Amb17336983 [1,1,0,0,0,0|1,0,0]=3 1282 B14R1.820 Cc1ccc(C)c(NC[C@H](O)CO)c1 Amb27669516 [1,1,0,0,0,0|1,0,0]=3 1283 B14R1.820 Cc1ccc(C)c(OCC(=O)CO)c1 Amb18565500 [1,1,0,0,0,0|0,0,2]=4 1284 B14R1.820 Cc1ccc(C)c(OCC(C)CN)c1 Amb9029295 [1,1,0,0,0,0|2,0,0]=4 1285 B14R1.820 Cc1ccc(C)c(OCC(C)CO)c1 Amb17236039 [1,1,0,0,0,0|1,0,0]=3 1286 B14R1.820 Cc1ccc(C)c(OCC(N)CO)c1 Amb18565767 [1,1,0,0,0,0|1,0,0]=3 1287 B14R1.820 Cc1ccc(C)c(OCC(O)CN)c1 Amb1138020 [1,1,0,0,0,0|1,0,0]=3 1288 B14R1.820 Cc1ccc(C)c(SCC(O)CN)c1 Amb6678733 [1,1,0,0,0,0|1,1,0]=4 1289 B14R1.820 Cc1ccc(Cl)c(NCC(O)CO)c1 Amb27599595 [1,1,0,0,0,0|2,0,0]=4 1290 B14R1.820 Cc1ccc(Cl)c(NC[C@H](O)CO)c1 Amb27403389 [1,1,0,0,0,0|2,0,0]=4 1291 B14R1.820 Cc1ccc(Cl)c(OCC(C)CO)c1 Amb17241839 [1,1,0,0,0,0|2,0,0]=4 1292 B14R1.820 Cc1ccc(Cl)c(OCC(N)CO)c1 Amb18569895 [1,1,0,0,0,0|2,0,0]=4 1293 B14R1.820 Cc1ccc(Cl)cc1NCC(O)CN Amb17140907 [1,1,0,0,0,0|2,0,0]=4 1294 B14R1.820 Cc1ccc(Cl)cc1NCC(O)CO Amb17340465 [1,1,0,0,0,0|1,0,0]=3 1295 B14R1.820 Cc1ccc(F)c(NC[C@H](O)CO)c1 Amb28183845 [1,1,0,0,0,0|2,0,0]=4 1296 B14R1.820 Cc1ccc(F)cc1NCC(O)CF Amb27250493 [1,1,0,0,0,0|2,0,0]=4 1297 B14R1.820 Cc1ccc(F)cc1NCC(O)CO Amb19006716 [1,1,0,0,0,0|1,0,0]=3 1298 B14R1.820 Cc1ccc(F)cc1NC[C@H](O)CO Amb27208843 [1,1,0,0,0,0|1,0,0]=3 1299 B14R1.820 Cc1ccc(I)cc1NCC(O)CO Amb27407322 [1,1,0,0,0,0|1,0,0]=3 1300 B14R1.820 NC(CO)COc1cc(Cl)ccc1Cl Amb18070997 [1,1,0,0,0,0|2,0,0]=4 1301 B14R1.820 Nc1ccc(Br)cc1NCC(O)CO Amb27235814 [1,1,0,0,0,0|2,0,0]=4 1302 B14R1.820 Nc1ccc(Cl)cc1NCC(O)CO Amb27227392 [1,1,0,0,0,0|2,0,0]=4 1303 B14R1.820 OCC(O)CNc1cc(Br)ccc1Br Amb27189155 [1,1,0,0,0,0|2,0,0]=4 1304 B14R1.820 OCC(O)CNc1cc(Br)ccc1Cl Amb27604854 [1,1,0,0,0,0|2,0,0]=4 1305 B14R1.820 OCC(O)CNc1cc(Br)ccc1I Amb27234485 [1,1,0,0,0,0|2,0,0]=4 1306 B14R1.820 OCC(O)CNc1cc(Cl)ccc1Br Amb27478259 [1,1,0,0,0,0|2,0,0]=4 1307 B14R1.820 OCC(O)CNc1cc(Cl)ccc1Cl Amb17306518 [1,1,0,0,0,0|2,0,0]=4 1308 B14R1.820 OCC(O)CNc1cc(Cl)ccc1I Amb35706258 [1,1,0,0,0,0|2,0,0]=4 1309 B14R1.820 OC[C@@H](O)CNc1cc(Br)ccc1I Amb27780967 [1,1,0,0,0,0|2,0,0]=4 1310 B14R1.820 OC[C@@H](O)CNc1cc(Cl)ccc1I Amb35706259 [1,1,0,0,0,0|2,0,0]=4 1311 B14R1.820 OC[C@@H](O)CNc1cc(F)ccc1Br Amb27810555 [1,1,0,0,0,0|2,0,0]=4 1312 B14R1.820 OC[C@@H](O)CNc1cc(I)ccc1Cl Amb27958210 [1,1,0,0,0,0|2,0,0]=4 1313 B14R1.1007 CC(Nc1ccccc1N)C(O)CO Amb35666280 [1,1,0,0,0,0|2,0,0]=4 1314 B14R1.1007 Cc1cccnc1NC(C)C(O)CO Amb35663041 [1,1,0,0,0,0|2,0,0]=4 1315 B14R1.1007 Cc1cnccc1NC(C)C(O)CO Amb35664626 [1,1,0,0,0,0|2,0,0]=4 1316 B14R1.19598 CC(CO)COc1c(Cl)cccc1Cl Amb17251975 [1,1,0,0,0,0|2,0,0]=4 1317 B14R1.19598 CCC(O)CNc1c(C)cccc1Br Amb35717846 [1,1,0,0,0,0|2,0,0]=4 1318 B14R1.19598 CCC(O)CNc1c(C)cccc1N Amb27249034 [1,1,0,0,0,0|2,0,0]=4 1319 B14R1.19598 CC[C@@H](O)CNc1c(C)cccc1Br Amb35717847 [1,1,0,0,0,0|2,0,0]=4 1320 B14R1.19598 CC[C@H](O)CNc1c(C)cccc1Br Amb35717844 [1,1,0,0,0,0|2,0,0]=4 1321 B14R1.19598 Cc1cccc(Br)c1NCC(C)CO Amb35721365 [1,1,0,0,0,0|2,0,0]=4 1322 B14R1.19598 Cc1cccc(Br)c1NCC(O)CF Amb35725753 [1,1,0,0,0,0|2,0,0]=4 1323 B14R1.19598 Cc1cccc(Br)c1NCC(O)CO Amb35717850 [1,1,0,0,0,0|1,0,0]=3 1324 B14R1.19598 Cc1cccc(Br)c1NC[C@H](O)CO Amb35717851 [1,1,0,0,0,0|1,0,0]=3 1325 B14R1.19598 Cc1cccc(C)c1NCC(O)CN Amb17139519 [1,1,0,0,0,0|2,0,0]=4 1326 B14R1.19598 Cc1cccc(C)c1OCC(=O)CO Amb18565499 [1,1,0,0,0,0|0,0,2]=4 1327 B14R1.19598 Cc1cccc(C)c1OCC(C)CN Amb8868836 [1,1,0,0,0,0|2,0,0]=4 1328 B14R1.19598 Cc1cccc(C)c1OCC(C)CO Amb17236036 [1,1,0,0,0,0|1,0,0]=3 1329 B14R1.19598 Cc1cccc(C)c1OCC(N)CO Amb18565766 [1,1,0,0,0,0|1,0,0]=3 1330 B14R1.19598 Cc1cccc(C)c1OCC(O)CN Amb1130426 [1,1,0,0,0,0|1,0,0]=3 1331 B14R1.19598 Cc1cccc(Cl)c1NCC(C)CO Amb27798225 [1,1,0,0,0,0|2,0,0]=4 1332 B14R1.19598 Cc1cccc(Cl)c1NCC(O)CF Amb28195267 [1,1,0,0,0,0|2,0,0]=4 1333 B14R1.19598 Cc1cccc(N)c1NCC(O)CO Amb27455641 [1,1,0,0,0,0|1,0,0]=3 1334 B14R1.19598 NC(CO)COc1c(Cl)cccc1Cl Amb18070994 [1,1,0,0,0,0|2,0,0]=4 1335 B14R1.19598 Nc1cccc(Br)c1NCC(O)CO Amb35645940 [1,1,0,0,0,0|2,0,0]=4 1336 B14R1.19598 Nc1cccc(Cl)c1NCC(O)CO Amb28075691 [1,1,0,0,0,0|2,0,0]=4 1337 B14R1.19598 OCC(O)CNc1c(F)cccc1Cl Amb27864663 [1,1,0,0,0,0|2,0,0]=4 1338 B14R1.95 COc1ccccc1C(C)C(C)CN Amb33746113 [0,1,0,0,1,0|2,0,0]=4 1339 B14R1.95 COc1ccccc1C(C)C(C)CO Amb33732866 [0,1,0,0,1,0|1,0,0]=3 1340 B14R1.95 COc1ccccc1C(C)[C@@H](C)CN Amb33727852 [0,1,0,0,1,0|2,0,0]=4 1341 B14R1.95 COc1ccccc1C(C)[C@@H](C)CO Amb33746687 [0,1,0,0,1,0|1,0,0]=3 1342 B14R1.95 COc1ccccc1C(C)[C@H](C)CN Amb33740287 [0,1,0,0,1,0|2,0,0]=4 1343 B14R1.95 COc1ccccc1C(C)[C@H](C)CO Amb33730409 [0,1,0,0,1,0|1,0,0]=3 1344 B14R1.483 CCOc1ccccc1CC(Br)CC Amb18548946 [0,1,0,0,1,0|2,0,0]=4 1345 B14R1.483 CCOc1ccccc1CC(N)CO Amb17062697 [0,1,0,0,1,0|1,0,0]=3 1346 B14R1.483 CCOc1ccccc1CC(O)CN Amb17236207 [0,1,0,0,1,0|1,0,0]=3 1347 B14R1.2000 CCc1ccccc1CC(C)(C)CO Amb33200227 [0,1,0,0,1,0|2,0,0]=4 1348 B14R1.2000 CCc1ccccc1CC(C)(N)CO Amb33198977 [0,1,0,0,1,0|2,0,0]=4 1349 B14R1.2000 CCc1ccccc1OC(C)(C)CO Amb17236022 [0,1,0,0,1,0|2,0,0]=4 1350 B14R1.2000 COc1ccccc1CC(C)(C)CBr Amb33242289 [0,1,0,0,1,0|2,0,0]=4 1351 B14R1.2000 COc1ccccc1CC(C)(C)CN Amb17333864 [0,1,0,0,1,0|2,0,0]=4 1352 B14R1.2000 COc1ccccc1CC(C)(C)CN Amb19515181 [0,1,0,0,1,0|2,0,0]=4 1353 B14R1.2000 COc1ccccc1CC(C)(C)CO Amb17336853 [0,1,0,0,1,0|1,0,0]=3 1354 B14R1.2000 COc1ccccc1CC(C)(N)CO Amb19009217 [0,1,0,0,1,0|1,0,0]=3 1355 B14R1.2000 COc1ccccc1CC(C)(N)CO Amb32663437 [0,1,0,0,1,0|1,0,0]=3 1356 B14R1.2000 COc1ccccc1CC(C)(O)C#N Amb19050116 [0,1,0,0,1,0|1,0,1]=4 1357 B14R1.2000 COc1ccccc1CC(C)(O)CN Amb17082138 [0,1,0,0,1,0|1,0,0]=3 1358 B14R1.2000 COc1ccccc1CC(F)(F)CN Amb32811897 [0,1,0,0,1,0|2,0,0]=4 1359 B14R1.2000 COc1ccccc1OC(C)(C)CBr Amb17266805 [0,1,0,0,1,0|2,0,0]=4 1360 B14R1.2000 COc1ccccc1OC(C)(C)CCl Amb17241823 [0,1,0,0,1,0|2,0,0]=4 1361 B14R1.2000 COc1ccccc1OC(C)(C)CN Amb17074810 [0,1,0,0,1,0|2,0,0]=4 1362 B14R1.2000 COc1ccccc1OC(C)(C)CO Amb17236399 [0,1,0,0,1,0|1,0,0]=3 1363 B14R1.2000 COc1cccnc1CC(C)(C)CO Amb33271575 [0,1,0,0,1,0|2,0,0]=4 1364 B14R1.2000 COc1cccnc1CC(C)(N)CO Amb33272186 [0,1,0,0,1,0|2,0,0]=4 1365 B14R1.2000 COc1ncccc1CC(C)(C)CO Amb33378542 [0,1,0,0,1,0|2,0,0]=4 1366 B14R1.2000 COc1ncccc1CC(C)(N)CO Amb33224252 [0,1,0,0,1,0|2,0,0]=4 1367 B14R1.2000 CSc1ccccc1CC(C)(C)CO Amb33224384 [0,1,0,0,1,0|1,1,0]=4 1368 B14R1.2000 CSc1ccccc1CC(C)(N)CO Amb33465818 [0,1,0,0,1,0|1,1,0]=4 1369 B14R1.2178 COc1cccc(Br)c1CC(N)CO Amb33451712 [0,1,0,0,1,0|1,0,0]=3 1370 B14R1.2178 COc1cccc(Br)c1CC(O)CN Amb33451840 [0,1,0,0,1,0|1,0,0]=3 1371 B14R1.2178 COc1cccc(C)c1CC(N)CO Amb33447346 [0,1,0,0,1,0|1,0,0]=3 1372 B14R1.2178 COc1cccc(C)c1CC(O)CN Amb33446714 [0,1,0,0,1,0|1,0,0]=3 1373 B14R1.2178 COc1cccc(Cl)c1CC(N)CO Amb33263106 [0,1,0,0,1,0|1,0,0]=3 1374 B14R1.2178 COc1cccc(Cl)c1CC(O)CN Amb33257077 [0,1,0,0,1,0|1,0,0]=3 1375 B14R1.2178 COc1cccc(F)c1CC(N)CO Amb33201907 [0,1,0,0,1,0|1,0,0]=3 1376 B14R1.2178 COc1cccc(F)c1CC(O)CN Amb33359388 [0,1,0,0,1,0|1,0,0]=3 1377 B14R1.2178 COc1cncc(Br)c1CC(N)CO Amb33389286 [0,1,0,0,1,0|2,0,0]=4 1378 B14R1.2178 COc1cncc(Br)c1CC(O)CN Amb33476821 [0,1,0,0,1,0|2,0,0]=4 1379 B14R1.2178 COc1nccc(Cl)c1CC(N)CO Amb33052176 [0,1,0,0,1,0|2,0,0]=4 1380 B14R1.2178 COc1nccc(Cl)c1CC(O)CN Amb33052372 [0,1,0,0,1,0|2,0,0]=4 1381 B14R1.3136 COc1ccccc1CC(CN)CO Amb5744196 [0,1,0,0,1,0|1,0,0]=3 1382 B14R1.3279 CCC(Br)Cc1cc(C)ccc1OC Amb18548933 [0,1,0,0,1,0|2,0,0]=4 1383 B14R1.3279 COc1ccc(Br)cc1CC(N)CO Amb33451138 [0,1,0,0,1,0|1,0,0]=3 1384 B14R1.3279 COc1ccc(Br)cc1CC(O)CN Amb33451301 [0,1,0,0,1,0|1,0,0]=3 1385 B14R1.3279 COc1ccc(C)cc1CC(=O)CO Amb18565476 [0,1,0,0,1,0|0,0,2]=4 1386 B14R1.3279 COc1ccc(C)cc1CC(N)CO Amb18565717 [0,1,0,0,1,0|1,0,0]=3 1387 B14R1.3279 COc1ccc(C)cc1CC(O)CN Amb17236221 [0,1,0,0,1,0|1,0,0]=3 1388 B14R1.3279 COc1ccc(C)cc1CC(O)CO Amb17595184 [0,1,0,0,1,0|0,0,0]=2 1389 B14R1.3279 COc1ccc(Cl)cc1CC(=O)CO Amb18066841 [0,1,0,0,1,0|0,0,2]=4 1390 B14R1.3279 COc1ccc(Cl)cc1CC(N)CO Amb18066975 [0,1,0,0,1,0|1,0,0]=3 1391 B14R1.3279 COc1ccc(Cl)cc1CC(O)CN Amb17242157 [0,1,0,0,1,0|1,0,0]=3 1392 B14R1.3279 COc1ccc(F)cc1CC(=O)CO Amb18566005 [0,1,0,0,1,0|0,0,2]=4 1393 B14R1.3279 COc1ccc(F)cc1CC(N)CO Amb18566114 [0,1,0,0,1,0|1,0,0]=3 1394 B14R1.3279 COc1ccc(F)cc1CC(O)CN Amb17236908 [0,1,0,0,1,0|1,0,0]=3 1395 B14R1.3279 COc1ncc(Br)cc1CC(N)CO Amb33431761 [0,1,0,0,1,0|2,0,0]=4 1396 B14R1.3279 COc1ncc(Br)cc1CC(O)CN Amb33432135 [0,1,0,0,1,0|2,0,0]=4 1397 B14R1.3302 CC(C)c1ccccc1CC(N)CO Amb33274453 [0,1,0,0,1,0|2,0,0]=4 1398 B14R1.3302 CC(C)c1ccccc1CC(O)CN Amb33143416 [0,1,0,0,1,0|2,0,0]=4 1399 B14R1.3302 CC(CO)Oc1ccccc1C(C)C Amb17236031 [0,1,0,0,1,0|2,0,0]=4 1400 B14R1.3302 CN(C)c1ccccc1CC(N)CO Amb32880467 [0,1,0,0,1,0|2,0,0]=4 1401 B14R1.3302 CN(C)c1ccccc1CC(O)CN Amb32953704 [0,1,0,0,1,0|2,0,0]=4 1402 B14R1.3417 COc1cc(Br)ccc1CC(N)CO Amb33477007 [0,1,0,0,1,0|1,0,0]=3 1403 B14R1.3417 COc1cc(Br)ccc1CC(O)CN Amb33477373 [0,1,0,0,1,0|1,0,0]=3 1404 B14R1.3417 COc1cc(C)ccc1CC(N)CO Amb33342413 [0,1,0,0,1,0|1,0,0]=3 1405 B14R1.3417 COc1cc(C)ccc1CC(O)CN Amb18813853 [0,1,0,0,1,0|1,0,0]=3 1406 B14R1.3417 COc1cc(C)ccc1NC(C)CO Amb27660184 [0,1,0,0,1,0|2,0,0]=4 1407 B14R1.3417 COc1cc(C)ccc1OC(C)CBr Amb17266812 [0,1,0,0,1,0|2,0,0]=4 1408 B14R1.3417 COc1cc(C)ccc1OC(C)CCl Amb17241830 [0,1,0,0,1,0|2,0,0]=4 1409 B14R1.3417 COc1cc(C)ccc1OC(C)CO Amb17236411 [0,1,0,0,1,0|1,0,0]=3 1410 B14R1.3417 COc1cc(Cl)ccc1CC(N)CO Amb33052428 [0,1,0,0,1,0|1,0,0]=3 1411 B14R1.3417 COc1cc(Cl)ccc1CC(O)CN Amb33052234 [0,1,0,0,1,0|1,0,0]=3 1412 B14R1.3417 COc1cc(F)ccc1CC(N)CO Amb33195470 [0,1,0,0,1,0|1,0,0]=3 1413 B14R1.3417 COc1cc(F)ccc1CC(O)CN Amb33311352 [0,1,0,0,1,0|1,0,0]=3 1414 B14R1.3417 COc1cc(F)ccc1NC(C)CO Amb27777814 [0,1,0,0,1,0|2,0,0]=4 1415 B14R1.3417 COc1cc(O)ccc1CC(N)CO Amb33312795 [0,1,0,0,1,0|1,0,0]=3 1416 B14R1.3417 COc1cc(O)ccc1CC(O)CN Amb33312406 [0,1,0,0,1,0|1,0,0]=3 1417 B14R1.3417 COc1nc(Cl)ccc1CC(N)CO Amb33221670 [0,1,0,0,1,0|2,0,0]=4 1418 B14R1.3417 COc1nc(Cl)ccc1CC(O)CN Amb33058694 [0,1,0,0,1,0|2,0,0]=4 1419 B14R1.3995 COc1c(Br)cccc1CC(N)CO Amb33009032 [0,1,0,0,1,0|1,0,0]=3 1420 B14R1.3995 COc1c(Br)cccc1CC(O)CN Amb33007464 [0,1,0,0,1,0|1,0,0]=3 1421 B14R1.3995 COc1c(C)cccc1CC(N)CO Amb18813839 [0,1,0,0,1,0|1,0,0]=3 1422 B14R1.3995 COc1c(C)cccc1CC(O)CN Amb18813851 [0,1,0,0,1,0|1,0,0]=3 1423 B14R1.3995 COc1c(Cl)cccc1CC(N)CO Amb33262035 [0,1,0,0,1,0|1,0,0]=3 1424 B14R1.3995 COc1c(Cl)cccc1CC(O)CN Amb33262072 [0,1,0,0,1,0|1,0,0]=3 1425 B14R1.3995 COc1c(F)cccc1CC(N)CO Amb18811275 [0,1,0,0,1,0|1,0,0]=3 1426 B14R1.3995 COc1c(F)cccc1CC(O)CN Amb18811270 [0,1,0,0,1,0|1,0,0]=3 1427 B16R1.4324 CCC(N)COCc1cc(C)ccc1OC Amb18631143 [0,1,0,0,0,1|2,0,0]=4 1428 B16R1.4324 CCC(N)COCc1cc(Cl)ccc1OC Amb18631147 [0,1,0,0,0,1|2,0,0]=4 1429 B16R1.4324 CCC(N)COCc1cc(F)ccc1OC Amb18112249 [0,1,0,0,0,1|2,0,0]=4 1430 B16R1.4324 COc1ccc(Br)cc1CNC[C@@H](O)CO Amb33041858 [0,1,0,0,0,1|1,0,0]=3 1431 B16R1.4324 COc1ccc(C)cc1CNC[C@@H](O)CO Amb33041889 [0,1,0,0,0,1|1,0,0]=3 1432 B16R1.698 CCOc1ccccc1OCC(N)C(C)C Amb17110169 [0,2,0,0,0,0|2,0,0]=4 1433 B16R1.5566 COc1ccccc1C(=O)CC(O)C(=O)O Amb18134487 [0,2,0,0,0,0|1,0,1]=4 1434 B16R1.694 CCOc1ccccc1OCC(O)CNC Amb9741088 [0,2,0,0,0,0|1,0,0]=3 1435 B16R1.1332 CCC(C)c1ccccc1OCC(O)CN Amb1124443 [0,2,0,0,0,0|2,0,0]=4 1436 B16R1.1332 CCC(C)c1ccccc1OCC(O)CN Amb3318758 [0,2,0,0,0,0|2,0,0]=4 1437 B16R1.1331 CC(C)(C)c1ccccc1OCC(O)CN Amb1132755 [0,2,0,0,0,0|2,0,0]=4 1438 B16R1.19790 COc1cccc(OC)c1OCC(O)CN Amb1126590 [0,2,0,0,0,0|1,0,0]=3 1439 B16R1.4300 COc1ccc(Cl)cc1NCC(C)(C)CO Amb18933272 [0,2,0,0,0,0|2,0,0]=4 1440 B14R2.3 OCCCC1CCc2ccccc21 Amb24353166 [1,0,0,1,0,0|2,0,0]=4 1441 B14R2.3 OCCCN1CCc2ccccc21 Amb9246658 [1,0,0,1,0,0|2,0,0]=4 1442 B14R2.3 OCCCc1coc2ccccc12 Amb25898468 [1,0,0,1,0,0|1,0,1]=4 1443 B14R2.44 Cc1c(CCO)oc2ccccc12 Amb33422882 [1,0,0,1,0,0|1,0,1]=4 1444 B14R2.92 CC1c2ccccc2CCC1CO Amb27972522 [1,0,0,1,0,0|2,0,0]=4 1445 B14R2.92 CN1c2ccccc2OCC1CN Amb25762846 [1,0,0,1,0,0|2,0,0]=4 1446 B14R2.92 N[C@H]1c2ccccc2OC[C@H]1CO Amb24512291 [1,0,0,1,0,0|2,0,0]=4 1447 B14R2.92 OCC1COc2ccccc2C1O Amb27220582 [1,0,0,1,0,0|2,0,0]=4 1448 B14R2.93 OCC1CCc2ccccc2CC1 Amb35751359 [1,0,0,1,0,0|2,0,0]=4 1449 B14R2.93 OCC1COc2ccccc2CN1 Amb27633209 [1,0,0,1,0,0|2,0,0]=4 1450 B14R2.93 OCC1COc2ccccc2OC1 Amb26038747 [1,0,0,1,0,0|0,0,0]=2 1451 B14R2.98 COc1ccccc1C2=NCCC2 Amb10606644 [1,0,0,1,0,0|2,0,0]=4 1452 B14R2.98 COc1ccccc1C2=NCCO2 Amb26507094 [1,0,0,1,0,0|2,0,0]=4 1453 B14R2.98 COc1ccccc1C2CCCN2 Amb17659141 [1,0,0,1,0,0|2,0,0]=4 1454 B14R2.98 COc1ccccc1C2CCCN2 Amb19887601 [1,0,0,1,0,0|2,0,0]=4 1455 B14R2.98 COc1ccccc1C2CCCO2 Amb17335233 [1,0,0,1,0,0|1,0,0]=3 1456 B14R2.98 COc1ccccc1C2CCCS2 Amb28348643 [1,0,0,1,0,0|1,1,0]=4 1457 B14R2.98 COc1ccccc1C2CNCO2 Amb18065827 [1,0,0,1,0,0|2,0,0]=4 1458 B14R2.98 COc1ccccc1C2NCCO2 Amb17335292 [1,0,0,1,0,0|2,0,0]=4 1459 B14R2.98 COc1ccccc1C2OCCO2 Amb17335396 [1,0,0,1,0,0|2,0,0]=4 1460 B14R2.98 COc1ccccc1N2CCCC2 Amb18269135 [1,0,0,1,0,0|2,0,0]=4 1461 B14R2.98 COc1ccccc1[C@@H]2CCCN2 Amb24080229 [1,0,0,1,0,0|2,0,0]=4 1462 B14R2.98 COc1ccccc1[C@H]2CCCN2 Amb24063888 [1,0,0,1,0,0|2,0,0]=4 1463 B14R2.112 BrCCC1COc2ccccc2C1 Amb33431666 [1,0,0,1,0,0|2,0,0]=4 1464 B14R2.112 BrCCC1COc2ccccc2O1 Amb33434171 [1,0,0,1,0,0|1,0,0]=3 1465 B14R2.112 C#CCC1COc2ccccc2O1 Amb33320851 [1,0,0,1,0,0|1,0,1]=4 1466 B14R2.112 CNCC1COc2ccccc2O1 Amb1152415 [1,0,0,1,0,0|2,0,0]=4 1467 B14R2.112 CNCC1COc2ccccc2O1 Amb6891836 [1,0,0,1,0,0|2,0,0]=4 1468 B14R2.112 N#CCC1COc2ccccc2O1 Amb18127383 [1,0,0,1,0,0|1,0,1]=4 1469 B14R2.112 NCCC1CCc2ccccc2O1 Amb26858330 [1,0,0,1,0,0|2,0,0]=4 1470 B14R2.112 NCCC1COc2ccccc2C1 Amb18195874 [1,0,0,1,0,0|2,0,0]=4 1471 B14R2.112 NCCC1COc2ccccc2N1 Amb27869939 [1,0,0,1,0,0|2,0,0]=4 1472 B14R2.112 NCCC1COc2ccccc2O1 Amb1085270 [1,0,0,1,0,0|1,0,0]=3 1473 B14R2.112 NCCC1COc2ccccc2O1 Amb22283857 [1,0,0,1,0,0|1,0,0]=3 1474 B14R2.112 NCCC1CSc2ccccc2O1 Amb24552717 [1,0,0,1,0,0|1,1,0]=4 1475 B14R2.112 NCCC1CSc2ccccc2O1 Amb28594199 [1,0,0,1,0,0|1,1,0]=4 1476 B14R2.112 NNCC1COc2ccccc2O1 Amb1117637 [1,0,0,1,0,0|2,0,0]=4 1477 B14R2.112 NNCC1COc2ccccc2O1 Amb32670885 [1,0,0,1,0,0|2,0,0]=4 1478 B14R2.112 NOCC1COc2ccccc2O1 Amb27250690 [1,0,0,1,0,0|2,0,0]=4 1479 B14R2.112 O=CCC1COc2ccccc2O1 Amb26077995 [1,0,0,1,0,0|0,0,2]=4 1480 B14R2.112 OCCC1CCc2ccccc2N1 Amb27482919 [1,0,0,1,0,0|2,0,0]=4 1481 B14R2.112 OCCC1CCc2ccccc2O1 Amb28292152 [1,0,0,1,0,0|1,0,0]=3 1482 B14R2.112 OCCC1CNc2ccccc2N1 Amb27859076 [1,0,0,1,0,0|2,0,0]=4 1483 B14R2.112 OCCC1COc2ccccc2C1 Amb25926217 [1,0,0,1,0,0|1,0,0]=3 1484 B14R2.112 OCCC1COc2ccccc2N1 Amb27667731 [1,0,0,1,0,0|1,0,0]=3 1485 B14R2.112 OCCC1COc2ccccc2O1 Amb10227655 [1,0,0,1,0,0|0,0,0]=2 1486 B14R2.112 ONCC1COc2ccccc2C1 Amb33273394 [1,0,0,1,0,0|2,0,0]=4 1487 B14R2.112 ONCC1COc2ccccc2O1 Amb27872575 [1,0,0,1,0,0|1,0,0]=3 1488 B14R2.112 SCCC1COc2ccccc2C1 Amb33447546 [1,0,0,1,0,0|1,1,0]=4 1489 B14R2.112 SCCC1COc2ccccc2O1 Amb33326065 [1,0,0,1,0,0|0,1,0]=3 1490 B14R2.112 [C-]#[N+]CC1COc2ccccc2O1 Amb33321176 [1,0,0,1,0,0|2,0,0]=4 1491 B14R2.148 CCc1ccccc1C2CCC2O Amb32950344 [1,0,0,1,0,0|2,0,0]=4 1492 B14R2.148 COc1ccccc1C2CCC2N Amb27609135 [1,0,0,1,0,0|2,0,0]=4 1493 B14R2.148 COc1ccccc1C2CCC2O Amb27852806 [1,0,0,1,0,0|1,0,0]=3 1494 B14R2.148 COc1cccnc1C2CCC2O Amb33213713 [1,0,0,1,0,0|2,0,0]=4 1495 B14R2.148 COc1ccncc1C2CCC2O Amb32945507 [1,0,0,1,0,0|2,0,0]=4 1496 B14R2.148 COc1ncccc1C2CCC2O Amb33213726 [1,0,0,1,0,0|2,0,0]=4 1497 B14R2.279 O[C@H]1CCOc2ccccc2[C@H]1O Amb28205961 [1,0,0,1,0,0|2,0,0]=4 1498 B14R2.1072 CCC1CNc2c(OC)cccc21 Amb18063419 [1,0,0,1,0,0|2,0,0]=4 1499 B14R2.1072 CCc1cccc2c1NCC2CO Amb18561210 [1,0,0,1,0,0|2,0,0]=4 1500 B14R2.1072 COc1cccc2c(CO)noc12 Amb32681970 [1,0,0,1,0,0|1,0,1]=4 1501 B14R2.1072 COc1cccc2c1CCC2CN Amb17233298 [1,0,0,1,0,0|2,0,0]=4 1502 B14R2.1072 COc1cccc2c1CCC2CO Amb26319261 [1,0,0,1,0,0|1,0,0]=3 1503 B14R2.1072 COc1cccc2c1NCC2CN Amb18063055 [1,0,0,1,0,0|2,0,0]=4 1504 B14R2.1072 COc1cccc2c1NCC2CO Amb18063469 [1,0,0,1,0,0|1,0,0]=3 1505 B14R2.1072 COc1cccc2c1OCC2CN Amb26862277 [1,0,0,1,0,0|1,0,0]=3 1506 B14R2.1078 CCc1cccc2c1NCCC2O Amb18559757 [1,0,0,1,0,0|2,0,0]=4 1507 B14R2.1078 CCc1cccc2c1OCCC2Br Amb27876790 [1,0,0,1,0,0|2,0,0]=4 1508 B14R2.1078 CCc1cccc2c1OCCC2Cl Amb26891593 [1,0,0,1,0,0|2,0,0]=4 1509 B14R2.1078 CCc1cccc2c1OCCC2N Amb13952476 [1,0,0,1,0,0|2,0,0]=4 1510 B14R2.1078 CCc1cccc2c1OCCC2N Amb9024858 [1,0,0,1,0,0|2,0,0]=4 1511 B14R2.1078 CCc1cccc2c1OCCC2O Amb24415843 [1,0,0,1,0,0|1,0,0]=3 1512 B14R2.1078 CCc1cccc2c1OCCC2S Amb26456943 [1,0,0,1,0,0|1,1,0]=4 1513 B14R2.1078 CCc1cccc2c1SCCC2O Amb25951480 [1,0,0,1,0,0|1,1,0]=4 1514 B14R2.1078 COc1cccc2c1CCCC2F Amb27635989 [1,0,0,1,0,0|2,0,0]=4 1515 B14R2.1078 COc1cccc2c1CCCC2N Amb22002129 [1,0,0,1,0,0|2,0,0]=4 1516 B14R2.1078 COc1cccc2c1CCCC2N Amb2383250 [1,0,0,1,0,0|2,0,0]=4 1517 B14R2.1078 COc1cccc2c1CCCC2O Amb4034881 [1,0,0,1,0,0|1,0,0]=3 1518 B14R2.1078 COc1cccc2c1CCC[C@@H]2N Amb24428745 [1,0,0,1,0,0|2,0,0]=4 1519 B14R2.1078 COc1cccc2c1CCC[C@@H]2O Amb24636779 [1,0,0,1,0,0|1,0,0]=3 1520 B14R2.1078 COc1cccc2c1CSCC2O Amb27412817 [1,0,0,1,0,0|2,0,0]=4 1521 B14R2.1078 COc1cccc2c1CSC[C@H]2O Amb28197544 [1,0,0,1,0,0|2,0,0]=4 1522 B14R2.1078 COc1cccc2c1NCCC2Br Amb28207332 [1,0,0,1,0,0|2,0,0]=4 1523 B14R2.1078 COc1cccc2c1NCCC2C Amb9782722 [1,0,0,1,0,0|2,0,0]=4 1524 B14R2.1078 COc1cccc2c1NCCC2Cl Amb28053224 [1,0,0,1,0,0|2,0,0]=4 1525 B14R2.1078 COc1cccc2c1NCCC2N Amb18062262 [1,0,0,1,0,0|2,0,0]=4 1526 B14R2.1078 COc1cccc2c1NCCC2O Amb9783417 [1,0,0,1,0,0|1,0,0]=3 1527 B14R2.1078 COc1cccc2c1NCCC2S Amb28053222 [1,0,0,1,0,0|1,1,0]=4 1528 B14R2.1078 COc1cccc2c1OCCC2=O Amb8843608 [1,0,0,1,0,0|0,0,2]=4 1529 B14R2.1078 COc1cccc2c1OCCC2Cl Amb28242344 [1,0,0,1,0,0|1,0,0]=3 1530 B14R2.1078 COc1cccc2c1OCCC2I Amb28246070 [1,0,0,1,0,0|1,0,0]=3 1531 B14R2.1078 COc1cccc2c1OCCC2N Amb13952444 [1,0,0,1,0,0|1,0,0]=3 1532 B14R2.1078 COc1cccc2c1OCCC2N Amb2383374 [1,0,0,1,0,0|1,0,0]=3 1533 B14R2.1078 COc1cccc2c1OCCC2O Amb17107290 [1,0,0,1,0,0|0,0,0]=2 1534 B14R2.1078 COc1cccc2c1OCCC2S Amb27186681 [1,0,0,1,0,0|0,1,0]=3 1535 B14R2.1078 COc1cccc2c1OCC[C@@H]2N Amb24493856 [1,0,0,1,0,0|1,0,0]=3 1536 B14R2.1078 COc1cccc2c1OCC[C@H]2N Amb26046352 [1,0,0,1,0,0|1,0,0]=3 1537 B14R2.1078 COc1cccc2c1SCCC2Br Amb25687808 [1,0,0,1,0,0|1,1,0]=4 1538 B14R2.1078 COc1cccc2c1SCCC2Cl Amb27421847 [1,0,0,1,0,0|1,1,0]=4 1539 B14R2.1078 COc1cccc2c1SCCC2F Amb28071556 [1,0,0,1,0,0|1,1,0]=4 1540 B14R2.1078 COc1cccc2c1SCCC2I Amb27816828 [1,0,0,1,0,0|1,1,0]=4 1541 B14R2.1078 COc1cccc2c1SCCC2N Amb18944971 [1,0,0,1,0,0|1,1,0]=4 1542 B14R2.1078 COc1cccc2c1SCCC2O Amb28345438 [1,0,0,1,0,0|0,1,0]=3 1543 B14R2.1078 COc1cccc2c1SCCC2S Amb28071508 [1,0,0,1,0,0|0,2,0]=4 1544 B14R2.1078 COc1ccnc2c1CCCC2O Amb27637601 [1,0,0,1,0,0|2,0,0]=4 1545 B14R2.1078 N#Cc1cccc2c1OCC[C@@H]2O Amb28243700 [1,0,0,1,0,0|2,0,0]=4 1546 B14R2.1145 COc1ccccc1OC2CC2N Amb27803747 [1,0,0,1,0,0|1,0,0]=3 1547 B14R2.1914 COc1ccccc1NC2CCC2 Amb18293887 [1,0,0,1,0,0|2,0,0]=4 1548 B14R2.1914 COc1ccccc1OC2CNC2 Amb10607986 [1,0,0,1,0,0|2,0,0]=4 1549 B14R2.1914 COc1ccccc1OC2CNC2 Amb13949203 [1,0,0,1,0,0|2,0,0]=4 1550 B14R2.1914 COc1ccccc1SC2CCC2 Amb27753453 [1,0,0,1,0,0|1,1,0]=4 1551 B14R2.2839 c1ccc2c(c1)OCCNCCO2 Amb4011216 [1,0,0,1,0,0|2,0,0]=4 1552 B14R2.2839 c1ccc2c(c1)OCCOCCO2 Amb25676969 [1,0,0,1,0,0|2,0,0]=4 1553 B14R2.2966 COc1ccccc1C2CC2CN Amb17233272 [1,0,0,1,0,0|2,0,0]=4 1554 B14R2.2966 COc1ccccc1C2OC2CO Amb33298975 [1,0,0,1,0,0|2,0,0]=4 1555 B14R2.2966 COc1ccccc1[C@@H]2C[C@H]2CN Amb26437638 [1,0,0,1,0,0|2,0,0]=4 1556 B14R2.2966 COc1ccccc1[C@@H]2C[C@H]2CO Amb27268546 [1,0,0,1,0,0|1,0,0]=3 1557 B14R2.2966 COc1cccnc1C2CC2CO Amb27207837 [1,0,0,1,0,0|2,0,0]=4 1558 B14R2.7324 COc1cccc2c1CC2CCO Amb28344916 [1,0,0,1,0,0|1,0,0]=3 1559 B14R2.11625 CCc1ccccc1OCC2CO2 Amb9024907 [1,0,0,1,0,0|1,0,0]=3 1560 B14R2.11625 CNc1ccccc1OCC2CC2 Amb24631737 [1,0,0,1,0,0|2,0,0]=4 1561 B14R2.11625 COc1ccccc1NCC2CC2 Amb9423032 [1,0,0,1,0,0|2,0,0]=4 1562 B14R2.11625 COc1ccccc1OCC2CO2 Amb9703523 [1,0,0,1,0,0|0,0,0]=2 1563 B14R2.11625 CSc1ccccc1OCC2CO2 Amb32663431 [1,0,0,1,0,0|0,1,0]=3 1564 B14R2.11625 N#Cc1ccccc1OCC2CO2 Amb6245882 [1,0,0,1,0,0|2,0,0]=4 1565 B14R2.11625 N#Cc1ccccc1OC[C@@H]2CO2 Amb24496773 [1,0,0,1,0,0|2,0,0]=4 1566 B14R2.11625 N#Cc1ccccc1OC[C@H]2CO2 Amb27245397 [1,0,0,1,0,0|2,0,0]=4 1567 B14R2.11637 BrCc1cccc2c1OCCCO2 Amb2723000 [1,0,0,1,0,0|2,0,0]=4 1568 B14R2.11637 CCc1cccc2c1OCCCN2 Amb17570277 [1,0,0,1,0,0|2,0,0]=4 1569 B14R2.11637 COc1cccc2c1CCCCN2 Amb2383461 [1,0,0,1,0,0|2,0,0]=4 1570 B14R2.11637 COc1cccc2c1NCCCS2 Amb26515531 [1,0,0,1,0,0|1,1,0]=4 1571 B14R2.11637 COc1cccc2c1OCCNC2 Amb32835542 [1,0,0,1,0,0|2,0,0]=4 1572 B14R2.11637 COc1cccc2c1OCCNC2 Amb8010489 [1,0,0,1,0,0|2,0,0]=4 1573 B14R2.11637 NCc1cccc2c1OCCCO2 Amb2723002 [1,0,0,1,0,0|2,0,0]=4 1574 B14R2.11637 NCc1cccc2c1OCCCO2 Amb8517036 [1,0,0,1,0,0|2,0,0]=4 1575 B14R2.11637 NNc1cccc2c1OCCCO2 Amb27492750 [1,0,0,1,0,0|2,0,0]=4 1576 B14R2.11637 O=Cc1cccc2c1OCCCO2 Amb2722998 [1,0,0,1,0,0|2,0,0]=4 1577 B14R2.11637 OCc1cccc2c1OCCCO2 Amb2723001 [1,0,0,1,0,0|2,0,0]=4 1578 B14R2.11637 SCc1cccc2c1OCCCO2 Amb32788380 [1,0,0,1,0,0|2,0,0]=4 1579 B14R2.24101 CC1NCCCOc2ccccc21 Amb5750869 [1,0,0,1,0,0|2,0,0]=4 1580 B14R2.2 CC(O)CC1CCc2ccccc21 Amb33145769 [1,0,0,1,0,0|2,0,0]=4 1581 B14R2.2 CC(O)CC1CNc2ccccc21 Amb27433910 [1,0,0,1,0,0|2,0,0]=4 1582 B14R2.2 CC(O)CN1CCc2ccccc21 Amb17138823 [1,0,0,1,0,0|2,0,0]=4 1583 B14R2.2 CC(O)Cc1coc2ccccc12 Amb28061306 [1,0,0,1,0,0|1,0,1]=4 1584 B14R2.2 C[C@@H](O)CC1CCc2ccccc21 Amb33226439 [1,0,0,1,0,0|2,0,0]=4 1585 B14R2.2 C[C@@H](O)CN1CCc2ccccc21 Amb27483687 [1,0,0,1,0,0|2,0,0]=4 1586 B14R2.2 C[C@H](O)CC1CCc2ccccc21 Amb33145117 [1,0,0,1,0,0|2,0,0]=4 1587 B14R2.450 CC(N)C1Oc2ccccc2C1C Amb20667590 [1,0,0,1,0,0|2,0,0]=4 1588 B14R2.450 CC(N)C1Oc2ccccc2C1C Amb26454027 [1,0,0,1,0,0|2,0,0]=4 1589 B14R2.450 CC(O)C1Cc2ccccc2C1C Amb35629759 [1,0,0,1,0,0|2,0,0]=4 1590 B14R2.450 Cc1c(C(C)O)oc2ccccc12 Amb9619603 [1,0,0,1,0,0|1,0,1]=4 1591 B14R2.450 Cc1c([C@@H](C)O)oc2ccccc12 Amb28249870 [1,0,0,1,0,0|1,0,1]=4 1592 B14R2.450 Cc1c([C@H](C)O)oc2ccccc12 Amb26845319 [1,0,0,1,0,0|1,0,1]=4 1593 B14R2.781 CC(=O)C1COc2ccccc2O1 Amb9752738 [1,0,0,1,0,0|0,0,2]=4 1594 B14R2.781 CC(=O)[C@H]1COc2ccccc2O1 Amb27621290 [1,0,0,1,0,0|0,0,2]=4 1595 B14R2.781 CC(C)C1CNc2ccccc2O1 Amb17570282 [1,0,0,1,0,0|2,0,0]=4 1596 B14R2.781 CC(C)C1COc2ccccc2N1 Amb17570252 [1,0,0,1,0,0|2,0,0]=4 1597 B14R2.781 CC(N)C1COc2ccccc2C1 Amb28048610 [1,0,0,1,0,0|2,0,0]=4 1598 B14R2.781 CC(N)C1COc2ccccc2O1 Amb17622285 [1,0,0,1,0,0|1,0,0]=3 1599 B14R2.781 CC(N)C1COc2ccccc2O1 Amb706784 [1,0,0,1,0,0|1,0,0]=3 1600 B14R2.781 CC(N)C1CSc2ccccc2O1 Amb27817407 [1,0,0,1,0,0|1,1,0]=4 1601 B14R2.781 CC(O)C1=COc2ccccc2O1 Amb27661173 [1,0,0,1,0,0|0,0,2]=4 1602 B14R2.781 CC(O)C1=Cc2ccccc2OC1 Amb27242657 [1,0,0,1,0,0|1,0,1]=4 1603 B14R2.781 CC(O)C1CNc2ccccc2O1 Amb29875567 [1,0,0,1,0,0|1,0,0]=3 1604 B14R2.781 C[C@@H](N)C1COc2ccccc2C1 Amb27174998 [1,0,0,1,0,0|2,0,0]=4 1605 B14R2.781 C[C@@H](N)C1COc2ccccc2O1 Amb24727927 [1,0,0,1,0,0|1,0,0]=3 1606 B14R2.781 C[C@@H](N)[C@@H]1COc2ccccc2O1 Amb27780130 [1,0,0,1,0,0|1,0,0]=3 1607 B14R2.781 C[C@@H](O)C1COc2ccccc2C1 Amb26407847 [1,0,0,1,0,0|1,0,0]=3 1608 B14R2.781 C[C@@H](O)C1COc2ccccc2O1 Amb28387663 [1,0,0,1,0,0|0,0,0]=2 1609 B14R2.781 C[C@H](N)C1COc2ccccc2C1 Amb25885820 [1,0,0,1,0,0|2,0,0]=4 1610 B14R2.781 C[C@H](N)C1COc2ccccc2O1 Amb26869122 [1,0,0,1,0,0|1,0,0]=3 1611 B14R2.781 C[C@H](N)[C@@H]1COc2ccccc2O1 Amb27783340 [1,0,0,1,0,0|1,0,0]=3 1612 B14R2.781 C[C@H](O)C1CCc2ccccc2C1 Amb27978704 [1,0,0,1,0,0|2,0,0]=4 1613 B14R2.781 C[C@H](O)C1COc2ccccc2C1 Amb28349511 [1,0,0,1,0,0|1,0,0]=3 1614 B14R2.781 C[C@H](O)C1COc2ccccc2O1 Amb27765479 [1,0,0,1,0,0|0,0,0]=2 1615 B14R2.781 O=C(O)C1COc2ccccc2O1 Amb6336370 [1,0,0,1,0,0|0,0,2]=4 1616 B14R2.781 O=C(O)[C@@H]1COc2ccccc2O1 Amb3939819 [1,0,0,1,0,0|0,0,2]=4 1617 B14R2.781 O=C(O)[C@H]1COc2ccccc2O1 Amb19889734 [1,0,0,1,0,0|0,0,2]=4 1618 B14R2.1073 CCc1cccc2c1NCC(O)C2 Amb28131570 [1,0,0,1,0,0|2,0,0]=4 1619 B14R2.1073 CCc1cccc2c1OCC(C)N2 Amb17570268 [1,0,0,1,0,0|2,0,0]=4 1620 B14R2.1073 COc1cccc2c1CCC(Br)C2 Amb32658118 [1,0,0,1,0,0|2,0,0]=4 1621 B14R2.1073 COc1cccc2c1CCC(C)N2 Amb23412261 [1,0,0,1,0,0|2,0,0]=4 1622 B14R2.1073 COc1cccc2c1CCC(Cl)C2 Amb32658113 [1,0,0,1,0,0|2,0,0]=4 1623 B14R2.1073 COc1cccc2c1CCC(N)C2 Amb16231533 [1,0,0,1,0,0|2,0,0]=4 1624 B14R2.1073 COc1cccc2c1CCC(N)C2 Amb2383256 [1,0,0,1,0,0|2,0,0]=4 1625 B14R2.1073 COc1cccc2c1CCC(N)C2 Amb33716681 [1,0,0,1,0,0|2,0,0]=4 1626 B14R2.1073 COc1cccc2c1CCC(O)C2 Amb27609887 [1,0,0,1,0,0|1,0,0]=3 1627 B14R2.1073 COc1cccc2c1CC[C@@H](N)C2 Amb27413084 [1,0,0,1,0,0|2,0,0]=4 1628 B14R2.1073 COc1cccc2c1CC[C@@H](N)C2 Amb8627826 [1,0,0,1,0,0|2,0,0]=4 1629 B14R2.1073 COc1cccc2c1CC[C@H](N)C2 Amb20241361 [1,0,0,1,0,0|2,0,0]=4 1630 B14R2.1073 COc1cccc2c1CC[C@H](N)C2 Amb20242480 [1,0,0,1,0,0|2,0,0]=4 1631 B14R2.1073 COc1cccc2c1CC[C@H](N)C2 Amb8627822 [1,0,0,1,0,0|2,0,0]=4 1632 B14R2.1073 COc1cccc2c1CC[C@H](O)C2 Amb25037136 [1,0,0,1,0,0|1,0,0]=3 1633 B14R2.1073 COc1cccc2c1NCC(C)C2 Amb5745985 [1,0,0,1,0,0|2,0,0]=4 1634 B14R2.1073 COc1cccc2c1NCC(C)N2 Amb28042000 [1,0,0,1,0,0|2,0,0]=4 1635 B14R2.1073 COc1cccc2c1NCC(C)O2 Amb33351729 [1,0,0,1,0,0|1,0,0]=3 1636 B14R2.1073 COc1cccc2c1NCC(N)C2 Amb27974014 [1,0,0,1,0,0|2,0,0]=4 1637 B14R2.1073 COc1cccc2c1NCC(O)C2 Amb26916989 [1,0,0,1,0,0|1,0,0]=3 1638 B14R2.1073 COc1cccc2c1NC[C@@H](N)C2 Amb27450450 [1,0,0,1,0,0|2,0,0]=4 1639 B14R2.1073 COc1cccc2c1OCC(=O)C2 Amb15692718 [1,0,0,1,0,0|0,0,2]=4 1640 B14R2.1073 COc1cccc2c1OCC(N)C2 Amb20249358 [1,0,0,1,0,0|1,0,0]=3 1641 B14R2.1073 COc1cccc2c1OCC(N)C2 Amb2383397 [1,0,0,1,0,0|1,0,0]=3 1642 B14R2.1073 COc1cccc2c1SCC(N)C2 Amb22230185 [1,0,0,1,0,0|1,1,0]=4 1643 B14R2.2967 COc1ccccc1C2CC(N)C2 Amb19373541 [1,0,0,1,0,0|2,0,0]=4 1644 B14R2.2967 COc1ccccc1C2CC(N)C2 Amb9497079 [1,0,0,1,0,0|2,0,0]=4 1645 B14R2.2967 COc1ccccc1C2CC(S)C2 Amb32788047 [1,0,0,1,0,0|1,1,0]=4 1646 B14R2.2967 COc1ccccc1[C@H]2C[C@H](N)C2 Amb35751104 [1,0,0,1,0,0|2,0,0]=4 1647 B14R2.2967 COc1ccccc1[C@H]2C[C@H](N)C2 Amb35752334 [1,0,0,1,0,0|2,0,0]=4 1648 B14R2.5548 CC1(C)CNc2ccccc2OC1 Amb17570269 [1,0,0,1,0,0|2,0,0]=4 1649 B14R2.5548 CC1(O)COc2ccccc2OC1 Amb25749309 [1,0,0,1,0,0|0,0,0]=2 1650 B14R2.11677 COc1cccc2c1CCC2(C)N Amb25721271 [1,0,0,1,0,0|2,0,0]=4 1651 B14R2.11677 COc1cccc2c1NCC2(C)C Amb18063186 [1,0,0,1,0,0|2,0,0]=4 1652 B14R2.256 Cc1ccccc1C2CC(N)CO2 Amb29861300 [1,0,0,1,0,0|2,0,0]=4 1653 B14R2.256 Cc1ccccc1C2CC(O)CN2 Amb28290194 [1,0,0,1,0,0|2,0,0]=4 1654 B14R2.256 Cc1ccccc1C2CC(O)CO2 Amb35584937 [1,0,0,1,0,0|1,0,0]=3 1655 B14R2.256 Cc1ccccc1N2CCC(O)C2 Amb23441900 [1,0,0,1,0,0|2,0,0]=4 1656 B14R2.256 Cc1ccncc1C2CC(O)CO2 Amb35708144 [1,0,0,1,0,0|2,0,0]=4 1657 B14R2.256 Cc1cnccc1C2CC(O)CO2 Amb35708117 [1,0,0,1,0,0|2,0,0]=4 1658 B14R2.256 OC1COC(c2ccccc2Br)C1 Amb35584951 [1,0,0,1,0,0|2,0,0]=4 1659 B14R2.256 OC1COC(c2ccccc2Cl)C1 Amb29853390 [1,0,0,1,0,0|2,0,0]=4 1660 B14R2.256 OC1COC(c2ccccc2F)C1 Amb35700383 [1,0,0,1,0,0|2,0,0]=4 1661 B14R2.294 Cc1ccccc1OCC2CC2N Amb25707608 [1,0,0,1,0,0|2,0,0]=4 1662 B14R2.662 Cc1ccccc1CC2CCC2O Amb32945694 [1,0,0,1,0,0|2,0,0]=4 1663 B14R2.662 OC1CCC1Oc2ccccc2F Amb34931044 [1,0,0,1,0,0|2,0,0]=4 1664 B14R2.664 CC1(COc2ccccc2I)CO1 Amb27443374 [1,0,0,1,0,0|2,0,0]=4 1665 B14R2.664 Cc1ccccc1CCC2(O)CC2 Amb18184099 [1,0,0,1,0,0|2,0,0]=4 1666 B14R2.664 Oc1ccccc1CCC2(O)CC2 Amb26995051 [1,0,0,1,0,0|2,0,0]=4 1667 B14R2.741 CC1Cc2ccccc2CCC1O Amb27179596 [1,0,0,1,0,0|2,0,0]=4 1668 B14R2.741 CC1Oc2ccccc2SCC1O Amb27766603 [1,0,0,1,0,0|1,1,0]=4 1669 B14R2.741 C[C@H]1Cc2ccccc2CC[C@H]1O Amb28345273 [1,0,0,1,0,0|2,0,0]=4 1670 B14R2.741 NC1CCc2ccccc2CC1O Amb27392292 [1,0,0,1,0,0|2,0,0]=4 1671 B14R2.972 C#CC(O)C1Cc2ccccc2O1 Amb28453593 [1,0,0,1,0,0|1,0,1]=4 1672 B14R2.972 C=C(CO)C1Cc2ccccc2O1 Amb27969082 [1,0,0,1,0,0|1,0,1]=4 1673 B14R2.972 CC(CN)C1Cc2ccccc2O1 Amb33739692 [1,0,0,1,0,0|2,0,0]=4 1674 B14R2.972 CC(CO)C1Cc2ccccc2O1 Amb33749203 [1,0,0,1,0,0|1,0,0]=3 1675 B14R2.972 CCC(O)C1Cc2ccccc2S1 Amb27205868 [1,0,0,1,0,0|1,1,0]=4 1676 B14R2.972 CC[C@@H](N)C1Cc2ccccc2O1 Amb27240727 [1,0,0,1,0,0|2,0,0]=4 1677 B14R2.972 CC[C@@H](O)[C@@H]1Cc2ccccc2N1 Amb27629722 [1,0,0,1,0,0|2,0,0]=4 1678 B14R2.972 C[C@@H](CN)C1Cc2ccccc2O1 Amb33744948 [1,0,0,1,0,0|2,0,0]=4 1679 B14R2.972 C[C@@H](CO)C1Cc2ccccc2O1 Amb33727983 [1,0,0,1,0,0|1,0,0]=3 1680 B14R2.972 C[C@H](CN)C1Cc2ccccc2O1 Amb33730088 [1,0,0,1,0,0|2,0,0]=4 1681 B14R2.972 C[C@H](CO)C1Cc2ccccc2O1 Amb33738442 [1,0,0,1,0,0|1,0,0]=3 1682 B14R2.972 NC(CO)C1Cc2ccccc2C1 Amb25082535 [1,0,0,1,0,0|2,0,0]=4 1683 B14R2.972 NC(CO)C1Cc2ccccc2N1 Amb27209769 [1,0,0,1,0,0|2,0,0]=4 1684 B14R2.972 NCC(O)C1Cc2ccccc2C1 Amb33143546 [1,0,0,1,0,0|2,0,0]=4 1685 B14R2.972 NCC(O)C1Cc2ccccc2O1 Amb23586297 [1,0,0,1,0,0|1,0,0]=3 1686 B14R2.972 NC[C@@H](O)C1Cc2ccccc2C1 Amb33342887 [1,0,0,1,0,0|2,0,0]=4 1687 B14R2.972 NC[C@H](O)C1Cc2ccccc2C1 Amb33342888 [1,0,0,1,0,0|2,0,0]=4 1688 B14R2.972 N[C@@H](CO)C1Cc2ccccc2C1 Amb33342875 [1,0,0,1,0,0|2,0,0]=4 1689 B14R2.972 N[C@H](CO)C1Cc2ccccc2C1 Amb26855361 [1,0,0,1,0,0|2,0,0]=4 1690 B14R2.972 OC(CBr)C1Cc2ccccc2C1 Amb33431743 [1,0,0,1,0,0|2,0,0]=4 1691 B14R2.972 OC(CF)C1Cc2ccccc2C1 Amb33342614 [1,0,0,1,0,0|2,0,0]=4 1692 B14R2.972 OCC(O)C1Cc2ccccc2C1 Amb33342616 [1,0,0,1,0,0|1,0,0]=3 1693 B14R2.972 OC[C@H](O)c1cc2ccccc2o1 Amb27605455 [1,0,0,1,0,0|0,0,2]=4 1694 B14R2.1189 Cc1ccccc1C2CC(CO)C2 Amb26391610 [1,0,0,1,0,0|2,0,0]=4 1695 B14R2.1801 CCC1CNc2c(C)cccc2O1 Amb28422228 [1,0,0,1,0,0|2,0,0]=4 1696 B14R2.1801 Cc1cccc2c1NCC(CO)C2 Amb5745000 [1,0,0,1,0,0|2,0,0]=4 1697 B14R2.1801 Cc1cccc2c1OCC(CCl)O2 Amb27863557 [1,0,0,1,0,0|1,0,0]=3 1698 B14R2.1801 Cc1cccc2c1OCC(CN)C2 Amb18195949 [1,0,0,1,0,0|2,0,0]=4 1699 B14R2.1801 Fc1cccc2c1OCC(CBr)O2 Amb27951029 [1,0,0,1,0,0|2,0,0]=4 1700 B14R2.1801 Fc1cccc2c1OC[C@@H](CBr)O2 Amb27964317 [1,0,0,1,0,0|2,0,0]=4 1701 B14R2.1801 Fc1cccc2c1OC[C@H](CBr)O2 Amb24407897 [1,0,0,1,0,0|2,0,0]=4 1702 B14R2.1801 NCC1COc2c(O)cccc2C1 Amb18824722 [1,0,0,1,0,0|2,0,0]=4 1703 B14R2.1801 Nc1cccc2c1OCC(CO)O2 Amb25081276 [1,0,0,1,0,0|1,0,0]=3 1704 B14R2.1801 OCC1CCc2c(O)cccc2C1 Amb18128175 [1,0,0,1,0,0|2,0,0]=4 1705 B14R2.1801 OCC1COc2c(Br)cccc2C1 Amb28197755 [1,0,0,1,0,0|2,0,0]=4 1706 B14R2.1801 OCC1COc2c(F)cccc2N1 Amb27633369 [1,0,0,1,0,0|2,0,0]=4 1707 B14R2.1801 OCC1COc2c(F)cccc2O1 Amb24681819 [1,0,0,1,0,0|1,0,0]=3 1708 B14R2.1801 OC[C@@H]1CCc2c(O)cccc2N1 Amb28293082 [1,0,0,1,0,0|2,0,0]=4 1709 B14R2.1801 OC[C@@H]1COc2c(F)cccc2O1 Amb26559916 [1,0,0,1,0,0|1,0,0]=3 1710 B14R2.1801 OC[C@H]1CCc2c(O)cccc2N1 Amb27162266 [1,0,0,1,0,0|2,0,0]=4 1711 B14R2.1801 OC[C@H]1COc2c(F)cccc2O1 Amb25097076 [1,0,0,1,0,0|1,0,0]=3 1712 B14R2.2973 C#CC1(O)COc2ccccc2C1 Amb28344733 [1,0,0,1,0,0|1,0,1]=4 1713 B14R2.2973 CC1(CBr)COc2ccccc2O1 Amb5730892 [1,0,0,1,0,0|2,0,0]=4 1714 B14R2.2973 CC1(CCl)COc2ccccc2O1 Amb5730893 [1,0,0,1,0,0|2,0,0]=4 1715 B14R2.2973 CC1(CN)COc2ccccc2O1 Amb22264763 [1,0,0,1,0,0|2,0,0]=4 1716 B14R2.2973 CC1(CN)COc2ccccc2O1 Amb5730889 [1,0,0,1,0,0|2,0,0]=4 1717 B14R2.2973 CC1(CO)CCc2ccccc2O1 Amb27651701 [1,0,0,1,0,0|2,0,0]=4 1718 B14R2.2973 CC1(CO)CNc2ccccc2C1 Amb32965571 [1,0,0,1,0,0|2,0,0]=4 1719 B14R2.2973 CC1(CO)CNc2ccccc2O1 Amb32660537 [1,0,0,1,0,0|2,0,0]=4 1720 B14R2.2973 CC1(CO)COc2ccccc2O1 Amb5730891 [1,0,0,1,0,0|1,0,0]=3 1721 B14R2.2973 CCC1(Br)COc2ccccc2O1 Amb32656537 [1,0,0,1,0,0|2,0,0]=4 1722 B14R2.2973 CCC1(O)CCc2ccccc2C1 Amb18180606 [1,0,0,1,0,0|2,0,0]=4 1723 B14R2.2973 N#CC1(O)COc2ccccc2C1 Amb28128143 [1,0,0,1,0,0|1,0,1]=4 1724 B14R2.2973 NC1(CO)CCc2ccccc2C1 Amb18278470 [1,0,0,1,0,0|2,0,0]=4 1725 B14R2.2973 NC1(CO)COc2ccccc2C1 Amb27836985 [1,0,0,1,0,0|1,0,0]=3 1726 B14R2.2973 NC1(CO)COc2ccccc2C1 Amb28828271 [1,0,0,1,0,0|1,0,0]=3 1727 B14R2.2973 NCC1(O)CCc2ccccc2C1 Amb18944137 [1,0,0,1,0,0|2,0,0]=4 1728 B14R2.2973 NCC1(O)COc2ccccc2C1 Amb28319519 [1,0,0,1,0,0|1,0,0]=3 1729 B14R2.2973 NCC1(O)CSc2ccccc2C1 Amb27953611 [1,0,0,1,0,0|1,1,0]=4 1730 B14R2.2973 OC1(CCl)CCc2ccccc2O1 Amb27607667 [1,0,0,1,0,0|2,0,0]=4 1731 B14R2.2973 OCC1(O)CCc2ncccc2C1 Amb35610784 [1,0,0,1,0,0|2,0,0]=4 1732 B14R2.2973 OCC1(O)COc2ccccc2C1 Amb27968345 [1,0,0,1,0,0|0,0,0]=2 1733 B14R2.3508 Cc1ccccc1C2CC2(N)CO Amb27201845 [1,0,0,1,0,0|2,0,0]=4 1734 B14R2.3508 NC1(CO)CC1c2ccccc2O Amb27238922 [1,0,0,1,0,0|2,0,0]=4 1735 B14R2.4634 Cc1ccccc1OCC2CCC2 Amb27177114 [1,0,0,1,0,0|2,0,0]=4 1736 B14R2.4634 Cc1ccccc1OCC2CCN2 Amb27229217 [1,0,0,1,0,0|2,0,0]=4 1737 B14R2.4634 Cc1ccccc1SCC2COC2 Amb27599141 [1,0,0,1,0,0|1,1,0]=4 1738 B14R2.4634 Ic1ccccc1OCC2COC2 Amb27980077 [1,0,0,1,0,0|2,0,0]=4 1739 B14R2.4634 Oc1ccccc1OCC2CCC2 Amb27181162 [1,0,0,1,0,0|2,0,0]=4 1740 B14R2.5632 CC1COc2cccc(Br)c2OC1 Amb25314290 [1,0,0,1,0,0|2,0,0]=4 1741 B14R2.5632 Cc1cccc2c1OCC(C)CN2 Amb17570279 [1,0,0,1,0,0|2,0,0]=4 1742 B14R2.5632 Nc1cccc2c1OCC(O)CO2 Amb17570336 [1,0,0,1,0,0|1,0,0]=3 1743 B14R2.8038 Cc1cccc2c1NCC(O)C2N Amb27457770 [1,0,0,1,0,0|2,0,0]=4 1744 B14R2.8038 Cc1cccc2c1OCC(O)C2N Amb25752262 [1,0,0,1,0,0|1,0,0]=3 1745 B14R2.8038 Cc1cccc2c1OC[C@H](O)[C@H]2N Amb27244831 [1,0,0,1,0,0|1,0,0]=3 1746 B14R2.8038 NC1c2cccc(F)c2OCC1O Amb28042997 [1,0,0,1,0,0|2,0,0]=4 1747 B14R2.8038 NC1c2cccc(I)c2OCC1O Amb26860600 [1,0,0,1,0,0|2,0,0]=4 1748 B14R2.8038 N[C@@H]1c2cccc(Cl)c2OC[C@@H]1O Amb27252257 [1,0,0,1,0,0|2,0,0]=4 1749 B14R2.8038 N[C@H]1CCc2c(O)cccc2[C@@H]1O Amb27252291 [1,0,0,1,0,0|2,0,0]=4 1750 B14R2.8038 N[C@H]1c2cccc(F)c2OC[C@H]1O Amb28457493 [1,0,0,1,0,0|2,0,0]=4 1751 B14R2.8038 Oc1cccc2c1C=C[C@@H](O)[C@@H]2O Amb27195789 [1,0,0,1,0,0|1,0,1]=4 1752 B14R2.8038 Oc1cccc2c1CC[C@H](O)[C@H]2O Amb28057547 [1,0,0,1,0,0|1,0,0]=3 1753 B14R2.16843 Cc1cccc2c1CCC2(O)CN Amb17088082 [1,0,0,1,0,0|2,0,0]=4 1754 B14R2.35816 NCC(O)CC1Cc2ccccc21 Amb35588577 [1,0,0,1,0,0|2,0,0]=4 1755 B14R2.95 C=CC(O)C1COc2ccccc21 Amb27604777 [0,0,0,1,1,0|1,0,1]=4 1756 B14R2.95 CC(CN)C1COc2ccccc21 Amb26530064 [0,0,0,1,1,0|2,0,0]=4 1757 B14R2.95 CC(CO)C1CCc2ccccc21 Amb24413002 [0,0,0,1,1,0|2,0,0]=4 1758 B14R2.95 CC(CO)C1COc2ccccc21 Amb33745861 [0,0,0,1,1,0|1,0,0]=3 1759 B14R2.95 CCC(N)C1COc2ccccc21 Amb27601806 [0,0,0,1,1,0|2,0,0]=4 1760 B14R2.95 CCC(O)C1CCc2ccccc21 Amb27179944 [0,0,0,1,1,0|2,0,0]=4 1761 B14R2.95 CCC(O)C1CNc2ccccc21 Amb35622375 [0,0,0,1,1,0|2,0,0]=4 1762 B14R2.95 CCC(O)C1CSc2ccccc21 Amb27834520 [0,0,0,1,1,0|1,1,0]=4 1763 B14R2.95 CC[C@H](N)C1COc2ccccc21 Amb27811825 [0,0,0,1,1,0|2,0,0]=4 1764 B14R2.95 CC[C@H](O)C1CCc2ccccc21 Amb27619104 [0,0,0,1,1,0|2,0,0]=4 1765 B14R2.95 C[C@@H](CN)C1COc2ccccc21 Amb33743136 [0,0,0,1,1,0|2,0,0]=4 1766 B14R2.95 C[C@@H](CO)C1CCc2ccccc21 Amb33746886 [0,0,0,1,1,0|2,0,0]=4 1767 B14R2.95 C[C@@H](CO)C1COc2ccccc21 Amb33747146 [0,0,0,1,1,0|1,0,0]=3 1768 B14R2.95 C[C@H](CN)C1COc2ccccc21 Amb33748004 [0,0,0,1,1,0|2,0,0]=4 1769 B14R2.95 C[C@H](CO)C1CCc2ccccc21 Amb33730883 [0,0,0,1,1,0|2,0,0]=4 1770 B14R2.95 C[C@H](CO)C1COc2ccccc21 Amb33743121 [0,0,0,1,1,0|1,0,0]=3 1771 B14R2.95 NC(CO)C1CCc2ccccc21 Amb25692204 [0,0,0,1,1,0|2,0,0]=4 1772 B14R2.95 NC(CO)C1CCc2ccccc21 Amb33483403 [0,0,0,1,1,0|2,0,0]=4 1773 B14R2.95 NC(CO)C1CNc2ccccc21 Amb28135906 [0,0,0,1,1,0|2,0,0]=4 1774 B14R2.95 NCC(O)C1CCc2ccccc21 Amb33146125 [0,0,0,1,1,0|2,0,0]=4 1775 B14R2.95 NCC(O)C1COc2ccccc21 Amb23586298 [0,0,0,1,1,0|1,0,0]=3 1776 B14R2.95 NC[C@@H](O)C1CCc2ccccc21 Amb33145745 [0,0,0,1,1,0|2,0,0]=4 1777 B14R2.95 NC[C@H](O)C1CCc2ccccc21 Amb33145746 [0,0,0,1,1,0|2,0,0]=4 1778 B14R2.95 N[C@@H](CO)C1CCc2ccccc21 Amb24490605 [0,0,0,1,1,0|2,0,0]=4 1779 B14R2.95 N[C@H](CO)C1CCc2ccccc21 Amb33146048 [0,0,0,1,1,0|2,0,0]=4 1780 B14R2.95 OC(CBr)C1CCc2ccccc21 Amb33430900 [0,0,0,1,1,0|2,0,0]=4 1781 B14R2.95 OC(CF)C1CCc2ccccc21 Amb33145110 [0,0,0,1,1,0|2,0,0]=4 1782 B14R2.95 OCC(O)C1CCc2ccccc21 Amb33226438 [0,0,0,1,1,0|1,0,0]=3 1783 B14R2.143 NCC1CCOc2ccccc2C1 Amb18195873 [0,0,0,1,1,0|2,0,0]=4 1784 B14R2.1019 CN1CC(CO)Oc2ccccc21 Amb9677670 [0,0,0,1,1,0|2,0,0]=4 1785 B14R2.1019 O=C1O[C@@H](CO)Cc2ccccc21 Amb27588930 [0,0,0,1,1,0|2,0,0]=4 1786 B14R2.1019 O=C1O[C@H](CO)Cc2ccccc21 Amb27472654 [0,0,0,1,1,0|2,0,0]=4 1787 B14R2.2968 CCc1ccccc1CC2(O)CC2 Amb27864419 [0,0,0,1,1,0|2,0,0]=4 1788 B14R2.2968 COc1ccccc1CC2(C)CO2 Amb18184329 [0,0,0,1,1,0|1,0,0]=3 1789 B14R2.2968 COc1ccccc1CC2(F)CC2 Amb28434931 [0,0,0,1,1,0|2,0,0]=4 1790 B14R2.2968 COc1ccccc1CC2(N)CC2 Amb5737546 [0,0,0,1,1,0|2,0,0]=4 1791 B14R2.2968 COc1ccccc1CC2(O)CC2 Amb18184320 [0,0,0,1,1,0|1,0,0]=3 1792 B14R2.2968 COc1cccnc1CC2(O)CC2 Amb33271572 [0,0,0,1,1,0|2,0,0]=4 1793 B14R2.2968 COc1ncccc1CC2(O)CC2 Amb33378537 [0,0,0,1,1,0|2,0,0]=4 1794 B14R2.2968 CSc1ccccc1CC2(O)CC2 Amb32876716 [0,0,0,1,1,0|1,1,0]=4 1795 B14R2.3512 CC1c2ccccc2CC1(N)CO Amb35671952 [0,0,0,1,1,0|2,0,0]=4 1796 B14R2.3512 CC1c2ccccc2CC1(O)CN Amb35672164 [0,0,0,1,1,0|2,0,0]=4 1797 B14R2.3512 CC1c2ccccc2CC1(O)CO Amb35629757 [0,0,0,1,1,0|1,0,0]=3 1798 B14R2.3512 CCC1(O)Cc2ccccc2C1C Amb35629622 [0,0,0,1,1,0|2,0,0]=4 1799 B14R2.8188 OC1Cc2ccccc2C(O)C1O Amb27486581 [0,0,0,1,1,0|2,0,0]=4 1800 B14R2.8188 O[C@H]1Cc2ccccc2[C@H](O)[C@H]1O Amb28206170 [0,0,0,1,1,0|2,0,0]=4 1801 B14R2.11645 COc1cccc2c1CC(C)C2Cl Amb28363566 [0,0,0,1,1,0|2,0,0]=4 1802 B14R2.11645 COc1cccc2c1CC(O)C2N Amb18194677 [0,0,0,1,1,0|1,0,0]=3 1803 B14R2.11645 COc1cccc2c1OC(C)C2N Amb18946101 [0,0,0,1,1,0|2,0,0]=4 1804 B14R2.11647 CCc1cccc2c1C[C@H](CO)N2 Amb28124674 [0,0,0,1,1,0|2,0,0]=4 1805 B14R2.11647 COc1cccc2c1CC(CN)C2 Amb25156159 [0,0,0,1,1,0|2,0,0]=4 1806 B14R2.11647 COc1cccc2c1NC(CO)C2 Amb27780207 [0,0,0,1,1,0|2,0,0]=4 1807 B14R2.11647 COc1cccc2c1OC(CBr)C2 Amb17040453 [0,0,0,1,1,0|2,0,0]=4 1808 B14R2.11647 COc1cccc2c1OC(CO)C2 Amb28139740 [0,0,0,1,1,0|1,0,0]=3 1809 B14R2.11647 COc1cccc2cc(CO)oc12 Amb9175044 [0,0,0,1,1,0|1,0,1]=4 1810 B14R2.11647 COc1cccc2oc(CO)nc12 Amb27246793 [0,0,0,1,1,0|1,0,1]=4 1811 B14R2.11684 CCc1cccc2c1CC(N)CO2 Amb27642527 [0,0,0,1,1,0|2,0,0]=4 1812 B14R2.11684 COc1cccc2c1CC(=O)CO2 Amb15692698 [0,0,0,1,1,0|0,0,2]=4 1813 B14R2.11684 COc1cccc2c1CC(N)CC2 Amb8009555 [0,0,0,1,1,0|2,0,0]=4 1814 B14R2.11684 COc1cccc2c1CC(N)CC2 Amb8631365 [0,0,0,1,1,0|2,0,0]=4 1815 B14R2.11684 COc1cccc2c1CC(N)CO2 Amb18128425 [0,0,0,1,1,0|1,0,0]=3 1816 B14R2.11684 COc1cccc2c1CC(N)CO2 Amb21964615 [0,0,0,1,1,0|1,0,0]=3 1817 B14R2.11684 COc1cccc2c1CC(N)CS2 Amb18130216 [0,0,0,1,1,0|1,1,0]=4 1818 B14R2.11684 COc1cccc2c1CC(O)CO2 Amb28315075 [0,0,0,1,1,0|0,0,0]=2 1819 B14R2.11684 COc1cccc2c1C[C@@H](N)CC2 Amb25849243 [0,0,0,1,1,0|2,0,0]=4 1820 B14R2.11684 COc1cccc2c1C[C@@H](N)CO2 Amb20242974 [0,0,0,1,1,0|1,0,0]=3 1821 B14R2.11684 COc1cccc2c1C[C@H](N)CC2 Amb19888385 [0,0,0,1,1,0|2,0,0]=4 1822 B14R2.11684 COc1cccc2c1C[C@H](N)CN2 Amb28292911 [0,0,0,1,1,0|2,0,0]=4 1823 B14R2.11684 COc1cccc2c1C[C@H](O)CC2 Amb27226070 [0,0,0,1,1,0|1,0,0]=3 1824 B16R2.26 COc1ccccc1N2CCC(O)CC2 Amb17239319 [0,0,0,1,0,1|2,0,0]=4 1825 B16R2.1170 Cc1c(CC(N)CO)oc2ccccc12 Amb33422874 [0,0,0,1,0,1|2,0,0]=4 1826 B16R2.1170 Cc1c(CC(O)CN)oc2ccccc12 Amb33372989 [0,0,0,1,0,1|2,0,0]=4 1827 B16R2.2347 COc1ccccc1C2CCC(CBr)O2 Amb27842910 [0,0,0,1,0,1|2,0,0]=4 1828 B16R2.2347 COc1ccccc1C2COC(CO)C2 Amb32753070 [0,0,0,1,0,1|2,0,0]=4 1829 B16R2.2347 COc1ccccc1C2OCC(CCl)O2 Amb17104735 [0,0,0,1,0,1|1,0,0]=3 1830 B16R2.2347 COc1ccccc1N2CCC(CO)C2 Amb5755276 [0,0,0,1,0,1|2,0,0]=4 1831 B16R2.2347 COc1ccccc1[C@@H]2CO[C@@H](CO)C2 Amb32660627 [0,0,0,1,0,1|2,0,0]=4 1832 B16R2.5347 CC(CBr)CC1COc2ccccc2O1 Amb35683654 [0,0,0,1,0,1|2,0,0]=4 1833 B16R2.5347 CC(CCl)CC1COc2ccccc2O1 Amb35683653 [0,0,0,1,0,1|2,0,0]=4 1834 B16R2.5347 NC(CO)CC1COc2ccccc2C1 Amb33423340 [0,0,0,1,0,1|2,0,0]=4 1835 B16R2.5347 NC(CO)CC1COc2ccccc2O1 Amb33322218 [0,0,0,1,0,1|1,0,0]=3 1836 B16R2.5347 NCC(O)CC1COc2ccccc2C1 Amb33448135 [0,0,0,1,0,1|2,0,0]=4 1837 B16R2.5347 NCC(O)CC1COc2ccccc2O1 Amb33319524 [0,0,0,1,0,1|1,0,0]=3 1838 B16R2.5347 OCC(O)CN1CCc2ccccc2C1 Amb17338779 [0,0,0,1,0,1|2,0,0]=4 1839 B16R2.36502 COc1ccccc1OCC2CC2CN Amb32428751 [0,0,0,1,0,1|2,0,0]=4 1840 B16R2.36502 COc1ccccc1OCC2CC2CO Amb32428747 [0,0,0,1,0,1|1,0,0]=3 1841 B16R2.36789 CCc1cccc2c1OCCC2(O)CN Amb17239357 [0,0,0,1,0,1|2,0,0]=4 1842 B16R2.36789 COc1cccc2c1OCCC2(O)CN Amb17240219 [0,0,0,1,0,1|1,0,0]=3 1843 B16R2.36909 COc1cccc2c1OCCC(CN)C2 Amb18778892 [0,0,0,1,0,1|2,0,0]=4 1844 B16R2.6284 CC(C(=O)O)C1COc2ccccc2O1 Amb33321691 [0,1,0,1,0,0|1,0,1]=4 1845 B16R2.6284 C[C@@H](C(=O)O)C1COc2ccccc2O1 Amb33743249 [0,1,0,1,0,0|1,0,1]=4 1846 B16R2.6284 C[C@H](C(=O)O)C1COc2ccccc2O1 Amb33749523 [0,1,0,1,0,0|1,0,1]=4 1847 B16R2.6284 NC(C(F)F)C1COc2ccccc2O1 Amb32746200 [0,1,0,1,0,0|2,0,0]=4 1848 B16R2.6284 O=C(O)C(O)C1COc2ccccc2C1 Amb26361642 [0,1,0,1,0,0|1,0,1]=4 1849 B16R2.6284 O=C(O)C(O)C1COc2ccccc2O1 Amb33321608 [0,1,0,1,0,0|0,0,1]=3 1850 B16R2.6284 OC(C(F)F)C1COc2ccccc2C1 Amb33404674 [0,1,0,1,0,0|2,0,0]=4 1851 B16R2.6284 OC(C(F)F)C1COc2ccccc2O1 Amb32746532 [0,1,0,1,0,0|1,0,0]=3 1852 B16R2.36806 COc1cccc2c1OCC(C(=O)O)C2 Amb1109943 [0,1,0,1,0,0|1,0,1]=4 1853 B16R2.36806 COc1cccc2c1OCC(C(C)N)C2 Amb32756638 [0,1,0,1,0,0|2,0,0]=4 1854 B16R2.36806 COc1cccc2c1OCC([C@@H](C)N)C2 Amb32716580 [0,1,0,1,0,0|2,0,0]=4 1855 B16R2.36806 COc1cccc2c1OCC([C@H](C)N)C2 Amb32756685 [0,1,0,1,0,0|2,0,0]=4 1856 B16R2.6614 CCOc1ccccc1CCC2(O)CC2 Amb33418718 [0,1,0,1,0,0|2,0,0]=4 1857 B16R2.20005 CCOc1cccc2c1NCC(CO)C2 Amb5745038 [0,1,0,1,0,0|2,0,0]=4 1858 B16R2.170412 OCC(O)CN1CCCc2ccccc21 Amb17338780 [0,1,0,1,0,0|2,0,0]=4 1859 B16R2.5 NOCC(O)CN1CCc2ccccc21 Amb17140303 [0,1,0,1,0,0|2,0,0]=4 1860 B16R2.619 COc1cccc2c1OCC(CCN)C2 Amb18778897 [0,1,0,1,0,0|2,0,0]=4 1861 B16R2.767 CC(CCN)C1COc2ccccc2O1 Amb33321685 [0,1,0,1,0,0|2,0,0]=4 1862 B16R2.767 CC(CON)C1COc2ccccc2C1 Amb33423166 [0,1,0,1,0,0|2,0,0]=4 1863 B16R2.767 CC(CON)C1COc2ccccc2O1 Amb33321160 [0,1,0,1,0,0|1,0,0]=3 1864 B16R2.767 CNCC(O)C1COc2ccccc2C1 Amb33424032 [0,1,0,1,0,0|2,0,0]=4 1865 B16R2.767 CNCC(O)C1COc2ccccc2O1 Amb33359325 [0,1,0,1,0,0|1,0,0]=3 1866 B16R2.767 N#CCC(O)C1COc2ccccc2C1 Amb33448218 [0,1,0,1,0,0|2,0,0]=4 1867 B16R2.767 N#CCC(O)C1COc2ccccc2O1 Amb33320833 [0,1,0,1,0,0|1,0,0]=3 1868 B16R2.767 NC(CCO)C1COc2ccccc2C1 Amb33423981 [0,1,0,1,0,0|2,0,0]=4 1869 B16R2.767 NC(CCO)C1COc2ccccc2O1 Amb22296983 [0,1,0,1,0,0|1,0,0]=3 1870 B16R2.767 NCCC(F)C1COc2ccccc2O1 Amb33321164 [0,1,0,1,0,0|2,0,0]=4 1871 B16R2.767 NCCC(O)C1COc2ccccc2C1 Amb33424015 [0,1,0,1,0,0|2,0,0]=4 1872 B16R2.767 NCCC(O)C1COc2ccccc2O1 Amb33322020 [0,1,0,1,0,0|1,0,0]=3 1873 B16R2.767 NCC[C@@H](O)C1COc2ccccc2C1 Amb33423219 [0,1,0,1,0,0|2,0,0]=4 1874 B16R2.767 NCC[C@@H](O)C1COc2ccccc2O1 Amb33321112 [0,1,0,1,0,0|1,0,0]=3 1875 B16R2.767 NCC[C@H](O)C1COc2ccccc2C1 Amb33226135 [0,1,0,1,0,0|2,0,0]=4 1876 B16R2.767 NCC[C@H](O)C1COc2ccccc2O1 Amb33321165 [0,1,0,1,0,0|1,0,0]=3 1877 B16R2.1480 CCc1ccccc1OCC2OCCO2 Amb17239795 [0,1,0,1,0,0|2,0,0]=4 1878 B16R2.1480 COc1ccccc1OCC2NCCS2 Amb22438989 [0,1,0,1,0,0|1,1,0]=4 1879 B16R2.1480 COc1ccccc1OCC2OCCO2 Amb17240540 [0,1,0,1,0,0|1,0,0]=3 1880 B16R2.1480 COc1ccccc1OC[C@@H]2CCCN2 Amb17051837 [0,1,0,1,0,0|2,0,0]=4 1881 B16R2.2451 COc1ccccc1CC2CCCC2O Amb22059016 [0,1,0,1,0,0|2,0,0]=4 1882 B16R2.2451 COc1ccccc1CC2COCC2Br Amb35612777 [0,1,0,1,0,0|2,0,0]=4 1883 B16R2.2451 COc1ccccc1CC2COCC2Cl Amb29877802 [0,1,0,1,0,0|2,0,0]=4 1884 B16R2.2451 COc1ccccc1OC2CCCC2O Amb32753237 [0,1,0,1,0,0|1,0,0]=3 1885 B16R2.2451 COc1ccccc1O[C@@H]2CCC[C@H]2O Amb32672767 [0,1,0,1,0,0|1,0,0]=3 1886 B16R2.151483 COc1cccc2c1CCC2(O)CCN Amb31143153 [0,1,0,1,0,0|2,0,0]=4 1887 B16R2.442 NCC(CO)C1COc2ccccc2C1 Amb33423305 [0,1,0,1,0,0|2,0,0]=4 1888 B16R2.442 NCC(CO)C1COc2ccccc2O1 Amb33321168 [0,1,0,1,0,0|1,0,0]=3 1889 B16R2.201368 COc1cccc(Br)c1CCC2(O)CC2 Amb33452020 [0,1,0,1,0,0|2,0,0]=4 1890 B16R2.201368 COc1cccc(C)c1CCC2(O)CC2 Amb33446431 [0,1,0,1,0,0|2,0,0]=4 1891 B16R2.201368 COc1cccc(Cl)c1CCC2(O)CC2 Amb33257095 [0,1,0,1,0,0|2,0,0]=4 1892 B16R2.201368 COc1cccc(F)c1CCC2(O)CC2 Amb33201286 [0,1,0,1,0,0|2,0,0]=4 1893 B16R2.3864 CC(C)(CBr)C1COc2ccccc2O1 Amb33434161 [0,1,0,1,0,0|2,0,0]=4 1894 B16R2.3864 CC(C)(CN)C1COc2ccccc2O1 Amb33321670 [0,1,0,1,0,0|2,0,0]=4 1895 B16R2.3864 CC(C)(CO)C1COc2ccccc2C1 Amb33423560 [0,1,0,1,0,0|2,0,0]=4 1896 B16R2.3864 CC(C)(CO)C1COc2ccccc2O1 Amb33321671 [0,1,0,1,0,0|1,0,0]=3 1897 B16R2.3864 CC(N)(CO)C1COc2ccccc2C1 Amb33448247 [0,1,0,1,0,0|2,0,0]=4 1898 B16R2.3864 CC(N)(CO)C1COc2ccccc2O1 Amb33320217 [0,1,0,1,0,0|1,0,0]=3 1899 B16R2.3864 CC(O)(CN)C1COc2ccccc2C1 Amb33448162 [0,1,0,1,0,0|2,0,0]=4 1900 B16R2.3864 CC(O)(CN)C1COc2ccccc2O1 Amb18656531 [0,1,0,1,0,0|1,0,0]=3 1901 B16R2.3864 NCC(F)(F)C1COc2ccccc2O1 Amb32746213 [0,1,0,1,0,0|2,0,0]=4 1902 B16R2.3864 OCC(F)(F)C1COc2ccccc2C1 Amb33404304 [0,1,0,1,0,0|2,0,0]=4 1903 B16R2.3864 OCC(F)(F)C1COc2ccccc2O1 Amb32746216 [0,1,0,1,0,0|1,0,0]=3 1904 B16R2.10072 COc1c(Br)cccc1CCC2(O)CC2 Amb33007653 [0,1,0,1,0,0|2,0,0]=4 1905 B16R2.10072 COc1c(C)cccc1CCC2(O)CC2 Amb33322808 [0,1,0,1,0,0|2,0,0]=4 1906 B16R2.10072 COc1c(Cl)cccc1CCC2(O)CC2 Amb33262097 [0,1,0,1,0,0|2,0,0]=4 1907 B16R2.10072 COc1c(F)cccc1CCC2(O)CC2 Amb33375996 [0,1,0,1,0,0|2,0,0]=4 1908 B16R2.6383 COc1ccc(C)cc1NC2CCC2O Amb33617443 [0,1,0,1,0,0|2,0,0]=4 1909 B16R2.39517 COc1ccc(C)c2c1NCC(CO)C2 Amb5745039 [0,1,0,1,0,0|2,0,0]=4 1910 B16R2.196401 COc1ccc(Br)cc1CCC2(O)CC2 Amb33331993 [0,1,0,1,0,0|2,0,0]=4 1911 B16R2.196401 COc1ccc(C)cc1CCC2(O)CC2 Amb33197068 [0,1,0,1,0,0|2,0,0]=4 1912 B16R2.196401 COc1ccc(Cl)cc1CCC2(O)CC2 Amb33413889 [0,1,0,1,0,0|2,0,0]=4 1913 B16R2.196401 COc1ccc(F)cc1CCC2(O)CC2 Amb33225255 [0,1,0,1,0,0|2,0,0]=4 1914 B16R2.7927 COc1cc(Br)cc2c1OCC(CN)C2 Amb22754306 [0,1,0,1,0,0|2,0,0]=4 1915 B16R2.39957 COc1cc(N)ccc1OCC2CCC2 Amb23575720 [0,1,0,1,0,0|2,0,0]=4 1916 B16R2.182477 COc1cc(Br)ccc1CCC2(O)CC2 Amb33477389 [0,1,0,1,0,0|2,0,0]=4 1917 B16R2.182477 COc1cc(C)ccc1CCC2(O)CC2 Amb33142219 [0,1,0,1,0,0|2,0,0]=4 1918 B16R2.182477 COc1cc(Cl)ccc1CCC2(O)CC2 Amb33052268 [0,1,0,1,0,0|2,0,0]=4 1919 B16R2.182477 COc1cc(F)ccc1CCC2(O)CC2 Amb33310673 [0,1,0,1,0,0|2,0,0]=4 1920 B16R2.182477 COc1cc(O)ccc1CCC2(O)CC2 Amb33312005 [0,1,0,1,0,0|2,0,0]=4 1921 B16R3.2583 O[C@@H]1CC[C@@H]2Oc3ccccc3N2C1 Amb28455084 [0,0,0,2,0,0|2,0,0]=4 1922 B16R3.10764 OC1COC2(CCc3ccccc32)C1 Amb35584938 [0,0,0,2,0,0|2,0,0]=4 1923 B16R3.1011 OCC1OC2CC1Nc3ccccc32 Amb27773797 [0,0,0,2,0,0|2,0,0]=4 1924 B16R3.3329 OC1CCCC2c3ccccc3OC12 Amb27631938 [0,0,0,2,0,0|2,0,0]=4 1925 B16R3.2641 OC1COC2CC1Oc3ccccc32 Amb27191075 [0,0,0,2,0,0|1,0,0]=3 1926 B16R3.2641 O[C@@H]1CO[C@@H]2C[C@@H]1Nc3ccccc32 Amb27259181 [0,0,0,2,0,0|2,0,0]=4 1927 B16R3.2641 O[C@H]1CO[C@H]2C[C@H]1Nc3ccccc32 Amb27636370 [0,0,0,2,0,0|2,0,0]=4 1928 B16R3.5186 NC1CC1C2COc3ccccc3O2 Amb33321672 [0,0,0,2,0,0|2,0,0]=4 1929 B16R3.5186 N[C@@H]1C[C@H]1C2COc3ccccc3O2 Amb33321673 [0,0,0,2,0,0|2,0,0]=4 1930 B16R3.11647 CC1(C2COc3ccccc3C2)CO1 Amb33448265 [0,0,0,2,0,0|2,0,0]=4 1931 B16R3.11647 CC1(C2COc3ccccc3O2)CO1 Amb33320218 [0,0,0,2,0,0|1,0,0]=3 1932 B16R3.11647 NC1(C2COc3ccccc3O2)CC1 Amb33171563 [0,0,0,2,0,0|2,0,0]=4 1933 B16R3.11647 OC1(C2COc3ccccc3C2)CC1 Amb19072946 [0,0,0,2,0,0|2,0,0]=4 1934 B16R3.11647 OC1(C2COc3ccccc3O2)CC1 Amb19073804 [0,0,0,2,0,0|1,0,0]=3 1935 B16R3.15796 CC1C(O)C2COc3ccccc3C12 Amb27264437 [0,0,0,2,0,0|2,0,0]=4 1936 B16R3.275899 c1ccc2c(c1)OCC(C3CCN3)O2 Amb33321177 [0,0,0,2,0,0|2,0,0]=4 1937 B16R3.275899 c1ccc2c(c1)OCC(C3CNC3)O2 Amb33321178 [0,0,0,2,0,0|2,0,0]=4 1938 B16R3.44322 COc1cccc2c1CCC3(CO3)C2 Amb33746898 [0,0,0,2,0,0|2,0,0]=4 1939 B16R3.257809 COc1cccc2c1C3CC(O)C2O3 Amb27206058 [0,0,0,2,0,0|1,0,0]=3 1940 B16R3.257809 COc1cccc2c1[C@@H]3C[C@@H](O)[C@H]2O3 Amb27970984 [0,0,0,2,0,0|1,0,0]=3 1941 B12R1.75 C#Cc1ccccc1CC(C)O Amb27472516 [1,0,0,0,1,0|1,0,1]=4 1942 B12R1.75 C#Cc1ccccc1C[C@@H](C)O Amb33203580 [1,0,0,0,1,0|1,0,1]=4 1943 B12R1.75 C#Cc1ccccc1C[C@H](C)O Amb33201590 [1,0,0,0,1,0|1,0,1]=4 1944 B12R1.75 CC(O)Cc1ccccc1C#N Amb24474257 [1,0,0,0,1,0|2,0,0]=4 1945 B12R1.75 CC(O)Cc1ccccc1CN Amb18908652 [1,0,0,0,1,0|2,0,0]=4 1946 B12R1.75 CC(O)Cc1ccccc1CO Amb28242482 [1,0,0,0,1,0|2,0,0]=4 1947 B12R1.75 CCc1ccccc1CC(C)Br Amb33335942 [1,0,0,0,1,0|2,0,0]=4 1948 B12R1.75 CCc1ccccc1CC(C)O Amb26490254 [1,0,0,0,1,0|1,0,0]=3 1949 B12R1.75 CCc1ccccc1CN(C)O Amb33199028 [1,0,0,0,1,0|2,0,0]=4 1950 B12R1.75 CCc1ccccc1C[C@@H](C)N Amb24524719 [1,0,0,0,1,0|2,0,0]=4 1951 B12R1.75 CCc1ccccc1C[C@@H](C)O Amb26865028 [1,0,0,0,1,0|1,0,0]=3 1952 B12R1.75 CCc1ccccc1C[C@H](C)N Amb26498566 [1,0,0,0,1,0|2,0,0]=4 1953 B12R1.75 CCc1ccccc1C[C@H](C)O Amb33198989 [1,0,0,0,1,0|1,0,0]=3 1954 B12R1.75 CCc1ccccc1OC(C)C Amb27629046 [1,0,0,0,1,0|2,0,0]=4 1955 B12R1.75 CNc1ccccc1OC(C)C Amb17138597 [1,0,0,0,1,0|2,0,0]=4 1956 B12R1.75 COc1ccccc1CB(O)O Amb27240545 [1,0,0,0,1,0|1,0,0]=3 1957 B12R1.75 COc1ccccc1CC(=O)O Amb2209376 [1,0,0,0,1,0|0,0,2]=4 1958 B12R1.75 COc1ccccc1CC(C)=O Amb4606012 [1,0,0,0,1,0|0,0,2]=4 1959 B12R1.75 COc1ccccc1CC(C)Br Amb24341666 [1,0,0,0,1,0|1,0,0]=3 1960 B12R1.75 COc1ccccc1CC(C)C Amb26042887 [1,0,0,0,1,0|1,0,0]=3 1961 B12R1.75 COc1ccccc1CC(C)N Amb2719601 [1,0,0,0,1,0|1,0,0]=3 1962 B12R1.75 COc1ccccc1CC(C)O Amb4605914 [1,0,0,0,1,0|0,0,0]=2 1963 B12R1.75 COc1ccccc1CC(C)S Amb18321706 [1,0,0,0,1,0|0,1,0]=3 1964 B12R1.75 COc1ccccc1CN(C)N Amb18563733 [1,0,0,0,1,0|2,0,0]=4 1965 B12R1.75 COc1ccccc1CN(C)O Amb33362106 [1,0,0,0,1,0|1,0,0]=3 1966 B12R1.75 COc1ccccc1C[C@@H](C)N Amb13952975 [1,0,0,0,1,0|1,0,0]=3 1967 B12R1.75 COc1ccccc1C[C@@H](C)N Amb30526839 [1,0,0,0,1,0|1,0,0]=3 1968 B12R1.75 COc1ccccc1C[C@@H](C)O Amb13952974 [1,0,0,0,1,0|0,0,0]=2 1969 B12R1.75 COc1ccccc1C[C@H](C)O Amb13952973 [1,0,0,0,1,0|0,0,0]=2 1970 B12R1.75 COc1ccccc1NC(C)C Amb6688395 [1,0,0,0,1,0|2,0,0]=4 1971 B12R1.75 COc1ccccc1OC(C)=O Amb2688624 [1,0,0,0,1,0|0,0,2]=4 1972 B12R1.75 COc1ccccc1OC(C)C Amb26323147 [1,0,0,0,1,0|1,0,0]=3 1973 B12R1.75 COc1ccccc1OC(F)F Amb17232988 [1,0,0,0,1,0|2,0,0]=4 1974 B12R1.75 COc1ccccc1SC(C)C Amb24659908 [1,0,0,0,1,0|1,1,0]=4 1975 B12R1.75 COc1cccnc1CC(C)Br Amb33451428 [1,0,0,0,1,0|2,0,0]=4 1976 B12R1.75 COc1cccnc1CC(C)N Amb8011417 [1,0,0,0,1,0|2,0,0]=4 1977 B12R1.75 COc1cccnc1CC(C)O Amb33079777 [1,0,0,0,1,0|1,0,0]=3 1978 B12R1.75 COc1cccnc1CN(C)O Amb33268281 [1,0,0,0,1,0|2,0,0]=4 1979 B12R1.75 COc1cccnc1C[C@@H](C)N Amb33272862 [1,0,0,0,1,0|2,0,0]=4 1980 B12R1.75 COc1cccnc1C[C@@H](C)O Amb33272859 [1,0,0,0,1,0|1,0,0]=3 1981 B12R1.75 COc1cccnc1C[C@H](C)N Amb33272976 [1,0,0,0,1,0|2,0,0]=4 1982 B12R1.75 COc1cccnc1C[C@H](C)O Amb33272860 [1,0,0,0,1,0|1,0,0]=3 1983 B12R1.75 COc1cccnc1OC(C)C Amb27827230 [1,0,0,0,1,0|2,0,0]=4 1984 B12R1.75 COc1ccncc1CC(C)N Amb26948717 [1,0,0,0,1,0|2,0,0]=4 1985 B12R1.75 COc1ncccc1CC(C)Br Amb33389467 [1,0,0,0,1,0|2,0,0]=4 1986 B12R1.75 COc1ncccc1CC(C)N Amb8011407 [1,0,0,0,1,0|2,0,0]=4 1987 B12R1.75 COc1ncccc1CC(C)O Amb27416940 [1,0,0,0,1,0|1,0,0]=3 1988 B12R1.75 COc1ncccc1CN(C)O Amb33379535 [1,0,0,0,1,0|2,0,0]=4 1989 B12R1.75 COc1ncccc1C[C@@H](C)N Amb33379160 [1,0,0,0,1,0|2,0,0]=4 1990 B12R1.75 COc1ncccc1C[C@@H](C)O Amb22896932 [1,0,0,0,1,0|1,0,0]=3 1991 B12R1.75 COc1ncccc1C[C@H](C)N Amb33379158 [1,0,0,0,1,0|2,0,0]=4 1992 B12R1.75 COc1ncccc1C[C@H](C)O Amb33379157 [1,0,0,0,1,0|1,0,0]=3 1993 B12R1.75 CSc1ccccc1CC(C)Br Amb33007111 [1,0,0,0,1,0|1,1,0]=4 1994 B12R1.75 CSc1ccccc1CC(C)N Amb28341490 [1,0,0,0,1,0|1,1,0]=4 1995 B12R1.75 CSc1ccccc1CC(C)N Amb31188238 [1,0,0,0,1,0|1,1,0]=4 1996 B12R1.75 CSc1ccccc1CC(C)O Amb27187741 [1,0,0,0,1,0|0,1,0]=3 1997 B12R1.75 CSc1ccccc1CN(C)O Amb33266275 [1,0,0,0,1,0|1,1,0]=4 1998 B12R1.75 CSc1ccccc1C[C@@H](C)N Amb25039285 [1,0,0,0,1,0|1,1,0]=4 1999 B12R1.75 CSc1ccccc1C[C@@H](C)O Amb33465845 [1,0,0,0,1,0|0,1,0]=3 2000 B12R1.75 CSc1ccccc1C[C@H](C)N Amb25835778 [1,0,0,0,1,0|1,1,0]=4 2001 B12R1.75 CSc1ccccc1C[C@H](C)O Amb33465846 [1,0,0,0,1,0|0,1,0]=3 2002 B12R1.75 CSc1ccccc1OC(C)C Amb27810757 [1,0,0,0,1,0|1,1,0]=4 2003 B12R1.75 C[C@@H](O)Cc1ccccc1C#N Amb33314659 [1,0,0,0,1,0|2,0,0]=4 2004 B12R1.75 C[C@H](O)Cc1ccccc1C#N Amb33314660 [1,0,0,0,1,0|2,0,0]=4 2005 B12R1.353 Cc1cscc1NCC(O)CO Amb28254695 [1,0,0,0,1,0|2,0,0]=4 2006 B12R1.371 C=CC(O)Cc1ccccc1C Amb28401244 [1,0,0,0,1,0|1,0,1]=4 2007 B12R1.371 CC(CO)Cc1ccccc1F Amb26508993 [1,0,0,0,1,0|2,0,0]=4 2008 B12R1.371 CC(CO)Cc1ccccc1O Amb28061434 [1,0,0,0,1,0|1,0,0]=3 2009 B12R1.371 CC(CO)Oc1ccccc1Br Amb17249276 [1,0,0,0,1,0|2,0,0]=4 2010 B12R1.371 CC(CO)Oc1ccccc1Cl Amb17234356 [1,0,0,0,1,0|2,0,0]=4 2011 B12R1.371 CC(CO)Oc1ccccc1F Amb17232739 [1,0,0,0,1,0|2,0,0]=4 2012 B12R1.371 CC(CO)Oc1ccccc1I Amb25828459 [1,0,0,0,1,0|2,0,0]=4 2013 B12R1.371 CC(CO)Sc1ccccc1O Amb27869464 [1,0,0,0,1,0|1,1,0]=4 2014 B12R1.371 CC(Cc1ccccc1O)NO Amb28074598 [1,0,0,0,1,0|2,0,0]=4 2015 B12R1.371 CCC(C)Cc1ccccc1O Amb27177732 [1,0,0,0,1,0|2,0,0]=4 2016 B12R1.371 CCC(C)Oc1ccccc1C Amb28364230 [1,0,0,0,1,0|2,0,0]=4 2017 B12R1.371 CCC(Cl)Cc1ccccc1C Amb17477425 [1,0,0,0,1,0|2,0,0]=4 2018 B12R1.371 CCC(N)Cc1ccccc1C Amb9428910 [1,0,0,0,1,0|2,0,0]=4 2019 B12R1.371 CCC(O)Cc1ccccc1Br Amb24465632 [1,0,0,0,1,0|2,0,0]=4 2020 B12R1.371 CCC(O)Cc1ccccc1C Amb17138581 [1,0,0,0,1,0|1,0,0]=3 2021 B12R1.371 CCC(O)Cc1ccccc1Cl Amb17139101 [1,0,0,0,1,0|2,0,0]=4 2022 B12R1.371 CCC(O)Cc1ccccc1F Amb17138635 [1,0,0,0,1,0|2,0,0]=4 2023 B12R1.371 CCC(O)Cc1ccccc1N Amb25335274 [1,0,0,0,1,0|2,0,0]=4 2024 B12R1.371 CCC(O)Sc1ccccc1C Amb22228394 [1,0,0,0,1,0|1,1,0]=4 2025 B12R1.371 CC[C@@H](C)Cc1ccccc1O Amb28243798 [1,0,0,0,1,0|2,0,0]=4 2026 B12R1.371 C[C@@H](CO)Cc1ccccc1Cl Amb28207131 [1,0,0,0,1,0|2,0,0]=4 2027 B12R1.371 C[C@@H](CO)Cc1ccccc1F Amb26956773 [1,0,0,0,1,0|2,0,0]=4 2028 B12R1.371 C[C@H](CO)Cc1ccccc1F Amb25837933 [1,0,0,0,1,0|2,0,0]=4 2029 B12R1.371 C[C@H](CO)Oc1ccccc1Cl Amb27405252 [1,0,0,0,1,0|2,0,0]=4 2030 B12R1.371 C[C@H](CO)Oc1ccccc1I Amb25150105 [1,0,0,0,1,0|2,0,0]=4 2031 B12R1.371 Cc1ccccc1CC(=O)CO Amb18563611 [1,0,0,0,1,0|0,0,2]=4 2032 B12R1.371 Cc1ccccc1CC(C)CBr Amb25733982 [1,0,0,0,1,0|2,0,0]=4 2033 B12R1.371 Cc1ccccc1CC(C)CCl Amb28422132 [1,0,0,0,1,0|2,0,0]=4 2034 B12R1.371 Cc1ccccc1CC(C)CN Amb5743837 [1,0,0,0,1,0|2,0,0]=4 2035 B12R1.371 Cc1ccccc1CC(C)CO Amb25152371 [1,0,0,0,1,0|1,0,0]=3 2036 B12R1.371 Cc1ccccc1CC(N)CO Amb17062685 [1,0,0,0,1,0|1,0,0]=3 2037 B12R1.371 Cc1ccccc1CC(N)CO Amb33329338 [1,0,0,0,1,0|1,0,0]=3 2038 B12R1.371 Cc1ccccc1CC(O)C#N Amb28244190 [1,0,0,0,1,0|1,0,1]=4 2039 B12R1.371 Cc1ccccc1CC(O)CN Amb17232545 [1,0,0,0,1,0|1,0,0]=3 2040 B12R1.371 Cc1ccccc1CC(O)CN Amb32661067 [1,0,0,0,1,0|1,0,0]=3 2041 B12R1.371 Cc1ccccc1C[C@@H](C)CN Amb33747733 [1,0,0,0,1,0|2,0,0]=4 2042 B12R1.371 Cc1ccccc1C[C@@H](C)CO Amb33746673 [1,0,0,0,1,0|1,0,0]=3 2043 B12R1.371 Cc1ccccc1C[C@H](C)CN Amb33738932 [1,0,0,0,1,0|2,0,0]=4 2044 B12R1.371 Cc1ccccc1C[C@H](C)CO Amb33738161 [1,0,0,0,1,0|1,0,0]=3 2045 B12R1.371 Cc1ccccc1C[C@H](N)CO Amb26844931 [1,0,0,0,1,0|1,0,0]=3 2046 B12R1.371 Cc1ccccc1OC(C)CBr Amb17248431 [1,0,0,0,1,0|2,0,0]=4 2047 B12R1.371 Cc1ccccc1OC(C)CCl Amb17234168 [1,0,0,0,1,0|2,0,0]=4 2048 B12R1.371 Cc1ccccc1OC(C)CN Amb5781295 [1,0,0,0,1,0|2,0,0]=4 2049 B12R1.371 Cc1ccccc1OC(C)CO Amb17232600 [1,0,0,0,1,0|1,0,0]=3 2050 B12R1.371 Cc1cccnc1CC(N)CO Amb25751493 [1,0,0,0,1,0|2,0,0]=4 2051 B12R1.371 Cc1cccnc1CC(O)CN Amb33360241 [1,0,0,0,1,0|2,0,0]=4 2052 B12R1.371 Cc1ccncc1CC(C)CO Amb27241561 [1,0,0,0,1,0|2,0,0]=4 2053 B12R1.371 Cc1ccncc1CC(N)CO Amb33377024 [1,0,0,0,1,0|2,0,0]=4 2054 B12R1.371 Cc1ccncc1CC(O)CCl Amb27187736 [1,0,0,0,1,0|2,0,0]=4 2055 B12R1.371 Cc1ccncc1CC(O)CN Amb33376386 [1,0,0,0,1,0|2,0,0]=4 2056 B12R1.371 Cc1cnccc1CC(N)CO Amb24549921 [1,0,0,0,1,0|2,0,0]=4 2057 B12R1.371 Cc1cnccc1CC(O)CN Amb33426442 [1,0,0,0,1,0|2,0,0]=4 2058 B12R1.371 Cc1ncccc1CC(N)CO Amb26616316 [1,0,0,0,1,0|2,0,0]=4 2059 B12R1.371 Cc1ncccc1CC(O)CN Amb32878360 [1,0,0,0,1,0|2,0,0]=4 2060 B12R1.371 NC(CO)Cc1ccccc1Br Amb18747032 [1,0,0,0,1,0|2,0,0]=4 2061 B12R1.371 NC(CO)Cc1ccccc1Cl Amb17062694 [1,0,0,0,1,0|2,0,0]=4 2062 B12R1.371 NC(CO)Cc1ccccc1F Amb17062688 [1,0,0,0,1,0|2,0,0]=4 2063 B12R1.371 NC(CO)Cc1ccccc1O Amb18827210 [1,0,0,0,1,0|1,0,0]=3 2064 B12R1.371 NCC(O)Cc1ccccc1Br Amb18069447 [1,0,0,0,1,0|2,0,0]=4 2065 B12R1.371 NCC(O)Cc1ccccc1Cl Amb17234263 [1,0,0,0,1,0|2,0,0]=4 2066 B12R1.371 NCC(O)Cc1ccccc1Cl Amb32652702 [1,0,0,0,1,0|2,0,0]=4 2067 B12R1.371 NCC(O)Cc1ccccc1F Amb17232700 [1,0,0,0,1,0|2,0,0]=4 2068 B12R1.371 NCC(O)Cc1ccccc1O Amb26883501 [1,0,0,0,1,0|1,0,0]=3 2069 B12R1.371 N[C@@H](CO)Cc1ccccc1Cl Amb25106847 [1,0,0,0,1,0|2,0,0]=4 2070 B12R1.371 N[C@H](CO)Cc1ccccc1Cl Amb22233157 [1,0,0,0,1,0|2,0,0]=4 2071 B12R1.371 N[C@H](CO)Cc1ccccc1F Amb25308478 [1,0,0,0,1,0|2,0,0]=4 2072 B12R1.371 Nc1ccccc1C[C@H](N)CO Amb22233158 [1,0,0,0,1,0|2,0,0]=4 2073 B12R1.371 Oc1ccccc1CC(Cl)CCl Amb28313629 [1,0,0,0,1,0|2,0,0]=4 2074 B12R1.77 C#CC(O)c1ccccc1OC Amb8392583 [0,0,0,0,2,0|1,0,1]=4 2075 B12R1.77 C#Cc1ccccc1C(O)CO Amb33223718 [0,0,0,0,2,0|1,0,1]=4 2076 B12R1.77 C=CC(O)c1ccccc1OC Amb27984970 [0,0,0,0,2,0|1,0,1]=4 2077 B12R1.77 CCC(Cl)c1ccccc1OC Amb17139100 [0,0,0,0,2,0|2,0,0]=4 2078 B12R1.77 CCC(N)c1ccccc1OC Amb1130946 [0,0,0,0,2,0|2,0,0]=4 2079 B12R1.77 CCC(N)c1ccccc1OC Amb22276944 [0,0,0,0,2,0|2,0,0]=4 2080 B12R1.77 CCC(O)c1ccccc1OC Amb9363957 [0,0,0,0,2,0|1,0,0]=3 2081 B12R1.77 CCC(S)c1ccccc1OC Amb32788144 [0,0,0,0,2,0|1,1,0]=4 2082 B12R1.77 CC[C@@H](N)c1ccccc1OC Amb22284332 [0,0,0,0,2,0|2,0,0]=4 2083 B12R1.77 CC[C@@H](O)c1ccccc1OC Amb25719888 [0,0,0,0,2,0|1,0,0]=3 2084 B12R1.77 CC[C@@H](O)c1cccnc1OC Amb28363657 [0,0,0,0,2,0|2,0,0]=4 2085 B12R1.77 CC[C@H](N)c1ccccc1OC Amb24431089 [0,0,0,0,2,0|2,0,0]=4 2086 B12R1.77 CC[C@H](O)c1ccccc1OC Amb28142822 [0,0,0,0,2,0|1,0,0]=3 2087 B12R1.77 CC[C@H](O)c1cccnc1OC Amb27808304 [0,0,0,0,2,0|2,0,0]=4 2088 B12R1.77 CCc1ccccc1C(C)CO Amb27169936 [0,0,0,0,2,0|2,0,0]=4 2089 B12R1.77 CCc1ccccc1C(N)CO Amb18298043 [0,0,0,0,2,0|2,0,0]=4 2090 B12R1.77 CCc1ccccc1C(O)CBr Amb33335950 [0,0,0,0,2,0|2,0,0]=4 2091 B12R1.77 CCc1ccccc1C(O)CC Amb27218079 [0,0,0,0,2,0|2,0,0]=4 2092 B12R1.77 CCc1ccccc1C(O)CCl Amb33413446 [0,0,0,0,2,0|2,0,0]=4 2093 B12R1.77 CCc1ccccc1C(O)CF Amb33198985 [0,0,0,0,2,0|2,0,0]=4 2094 B12R1.77 CCc1ccccc1C(O)CN Amb18991061 [0,0,0,0,2,0|2,0,0]=4 2095 B12R1.77 CCc1ccccc1C(O)CO Amb26632387 [0,0,0,0,2,0|1,0,0]=3 2096 B12R1.77 CCc1ccccc1[C@@H](C)CO Amb25057871 [0,0,0,0,2,0|2,0,0]=4 2097 B12R1.77 CCc1ccccc1[C@@H](N)CO Amb24732257 [0,0,0,0,2,0|2,0,0]=4 2098 B12R1.77 CCc1ccccc1[C@@H](O)CN Amb33200208 [0,0,0,0,2,0|2,0,0]=4 2099 B12R1.77 CCc1ccccc1[C@H](C)CO Amb25964413 [0,0,0,0,2,0|2,0,0]=4 2100 B12R1.77 CCc1ccccc1[C@H](N)CO Amb25836785 [0,0,0,0,2,0|2,0,0]=4 2101 B12R1.77 CCc1ccccc1[C@H](O)CN Amb33199005 [0,0,0,0,2,0|2,0,0]=4 2102 B12R1.77 COc1ccccc1C(=O)CO Amb18800999 [0,0,0,0,2,0|0,0,2]=4 2103 B12R1.77 COc1ccccc1C(C)CBr Amb17248428 [0,0,0,0,2,0|2,0,0]=4 2104 B12R1.77 COc1ccccc1C(C)CCl Amb17234159 [0,0,0,0,2,0|2,0,0]=4 2105 B12R1.77 COc1ccccc1C(C)CN Amb8950155 [0,0,0,0,2,0|2,0,0]=4 2106 B12R1.77 COc1ccccc1C(C)CO Amb17232593 [0,0,0,0,2,0|1,0,0]=3 2107 B12R1.77 COc1ccccc1C(F)CN Amb24760875 [0,0,0,0,2,0|2,0,0]=4 2108 B12R1.77 COc1ccccc1C(F)CO Amb28207483 [0,0,0,0,2,0|1,0,0]=3 2109 B12R1.77 COc1ccccc1C(N)CF Amb26006468 [0,0,0,0,2,0|2,0,0]=4 2110 B12R1.77 COc1ccccc1C(N)CN Amb9380699 [0,0,0,0,2,0|2,0,0]=4 2111 B12R1.77 COc1ccccc1C(N)CO Amb19515359 [0,0,0,0,2,0|1,0,0]=3 2112 B12R1.77 COc1ccccc1C(N)CO Amb2236320 [0,0,0,0,2,0|1,0,0]=3 2113 B12R1.77 COc1ccccc1C(O)C#N Amb9270813 [0,0,0,0,2,0|1,0,1]=4 2114 B12R1.77 COc1ccccc1C(O)CBr Amb17206128 [0,0,0,0,2,0|1,0,0]=3 2115 B12R1.77 COc1ccccc1C(O)CCl Amb17234352 [0,0,0,0,2,0|1,0,0]=3 2116 B12R1.77 COc1ccccc1C(O)CF Amb24513945 [0,0,0,0,2,0|1,0,0]=3 2117 B12R1.77 COc1ccccc1C(O)CI Amb27608051 [0,0,0,0,2,0|1,0,0]=3 2118 B12R1.77 COc1ccccc1C(O)CN Amb10068896 [0,0,0,0,2,0|1,0,0]=3 2119 B12R1.77 COc1ccccc1C(O)CN Amb2699085 [0,0,0,0,2,0|1,0,0]=3 2120 B12R1.77 COc1ccccc1C(O)CN Amb9703594 [0,0,0,0,2,0|1,0,0]=3 2121 B12R1.77 COc1ccccc1C(O)CO Amb18563838 [0,0,0,0,2,0|0,0,0]=2 2122 B12R1.77 COc1ccccc1[C@@H](C)CN Amb33731062 [0,0,0,0,2,0|2,0,0]=4 2123 B12R1.77 COc1ccccc1[C@@H](C)CO Amb27755405 [0,0,0,0,2,0|1,0,0]=3 2124 B12R1.77 COc1ccccc1[C@@H](C)NO Amb27411380 [0,0,0,0,2,0|2,0,0]=4 2125 B12R1.77 COc1ccccc1[C@@H](N)CO Amb25148582 [0,0,0,0,2,0|1,0,0]=3 2126 B12R1.77 COc1ccccc1[C@@H](O)CBr Amb6893362 [0,0,0,0,2,0|1,0,0]=3 2127 B12R1.77 COc1ccccc1[C@@H](O)CN Amb24485476 [0,0,0,0,2,0|1,0,0]=3 2128 B12R1.77 COc1ccccc1[C@H](C)CN Amb33737275 [0,0,0,0,2,0|2,0,0]=4 2129 B12R1.77 COc1ccccc1[C@H](C)CO Amb27486249 [0,0,0,0,2,0|1,0,0]=3 2130 B12R1.77 COc1ccccc1[C@H](N)CF Amb27494573 [0,0,0,0,2,0|2,0,0]=4 2131 B12R1.77 COc1ccccc1[C@H](N)CO Amb33871615 [0,0,0,0,2,0|1,0,0]=3 2132 B12R1.77 COc1ccccc1[C@H](O)CBr Amb6893363 [0,0,0,0,2,0|1,0,0]=3 2133 B12R1.77 COc1ccccc1[C@H](O)CN Amb25805339 [0,0,0,0,2,0|1,0,0]=3 2134 B12R1.77 COc1cccnc1C(N)CO Amb25152308 [0,0,0,0,2,0|2,0,0]=4 2135 B12R1.77 COc1cccnc1C(O)CBr Amb33009330 [0,0,0,0,2,0|2,0,0]=4 2136 B12R1.77 COc1cccnc1C(O)CCl Amb33057667 [0,0,0,0,2,0|2,0,0]=4 2137 B12R1.77 COc1cccnc1C(O)CF Amb33272640 [0,0,0,0,2,0|2,0,0]=4 2138 B12R1.77 COc1cccnc1C(O)CN Amb26539896 [0,0,0,0,2,0|2,0,0]=4 2139 B12R1.77 COc1cccnc1C(O)CN Amb35752875 [0,0,0,0,2,0|2,0,0]=4 2140 B12R1.77 COc1cccnc1C(O)CO Amb33272642 [0,0,0,0,2,0|1,0,0]=3 2141 B12R1.77 COc1cccnc1[C@@H](N)CO Amb25937670 [0,0,0,0,2,0|2,0,0]=4 2142 B12R1.77 COc1cccnc1[C@@H](O)CN Amb33273774 [0,0,0,0,2,0|2,0,0]=4 2143 B12R1.77 COc1cccnc1[C@@H](O)CN Amb33803197 [0,0,0,0,2,0|2,0,0]=4 2144 B12R1.77 COc1cccnc1[C@H](N)CO Amb25053324 [0,0,0,0,2,0|2,0,0]=4 2145 B12R1.77 COc1cccnc1[C@H](O)CN Amb33273773 [0,0,0,0,2,0|2,0,0]=4 2146 B12R1.77 COc1cccnc1[C@H](O)CN Amb33803140 [0,0,0,0,2,0|2,0,0]=4 2147 B12R1.77 COc1ncccc1C(N)CO Amb25727735 [0,0,0,0,2,0|2,0,0]=4 2148 B12R1.77 COc1ncccc1C(O)CBr Amb33388203 [0,0,0,0,2,0|2,0,0]=4 2149 B12R1.77 COc1ncccc1C(O)CCl Amb33256910 [0,0,0,0,2,0|2,0,0]=4 2150 B12R1.77 COc1ncccc1C(O)CF Amb33378966 [0,0,0,0,2,0|2,0,0]=4 2151 B12R1.77 COc1ncccc1C(O)CN Amb25915378 [0,0,0,0,2,0|2,0,0]=4 2152 B12R1.77 COc1ncccc1C(O)CO Amb33378967 [0,0,0,0,2,0|1,0,0]=3 2153 B12R1.77 COc1ncccc1[C@@H](N)CO Amb25328570 [0,0,0,0,2,0|2,0,0]=4 2154 B12R1.77 COc1ncccc1[C@@H](O)CN Amb33379172 [0,0,0,0,2,0|2,0,0]=4 2155 B12R1.77 COc1ncccc1[C@H](N)CO Amb25326364 [0,0,0,0,2,0|2,0,0]=4 2156 B12R1.77 COc1ncccc1[C@H](O)CN Amb33379171 [0,0,0,0,2,0|2,0,0]=4 2157 B12R1.77 CSc1ccccc1C(N)CO Amb27603805 [0,0,0,0,2,0|1,1,0]=4 2158 B12R1.77 CSc1ccccc1C(O)CBr Amb33006842 [0,0,0,0,2,0|1,1,0]=4 2159 B12R1.77 CSc1ccccc1C(O)CCl Amb33223274 [0,0,0,0,2,0|1,1,0]=4 2160 B12R1.77 CSc1ccccc1C(O)CF Amb33465836 [0,0,0,0,2,0|1,1,0]=4 2161 B12R1.77 CSc1ccccc1C(O)CN Amb26318490 [0,0,0,0,2,0|1,1,0]=4 2162 B12R1.77 CSc1ccccc1C(O)CO Amb33465837 [0,0,0,0,2,0|0,1,0]=3 2163 B12R1.77 CSc1ccccc1[C@@H](N)CO Amb25149782 [0,0,0,0,2,0|1,1,0]=4 2164 B12R1.77 CSc1ccccc1[C@@H](O)CN Amb33472531 [0,0,0,0,2,0|1,1,0]=4 2165 B12R1.77 CSc1ccccc1[C@H](N)CO Amb27601234 [0,0,0,0,2,0|1,1,0]=4 2166 B12R1.77 CSc1ccccc1[C@H](O)CN Amb33472540 [0,0,0,0,2,0|1,1,0]=4 2167 B12R1.77 N#Cc1ccccc1C(O)CO Amb33314650 [0,0,0,0,2,0|2,0,0]=4