0 B12R1.270 C#Cc1ccc(C)c(OCC)c1 Amb30015953 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.270 C#Cc1ccc(O)c(OCC)c1 Amb27149603 [0,0,0,0,0,0|1,0,1]=2 2 B12R1.270 C#Cc1cnc(C)c(OCC)c1 Amb28041409 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.270 C=CCc1cc(C=O)ccc1O Amb2496484 [0,0,0,0,0,0|1,0,2]=3 4 B12R1.270 C=COc1cc(C=C)ccc1F Amb26013881 [0,0,0,0,0,0|2,0,2]=4 5 B12R1.270 C=Cc1cc(NCC)c(N)cn1 Amb27961174 [0,0,0,0,0,0|4,0,0]=4 6 B12R1.270 C=Cc1ccc(O)c(OCC)c1 Amb33376113 [0,0,0,0,0,0|1,0,0]=1 7 B12R1.270 C=Cc1ccc(O)c(\C=N\O)c1 Amb24434625 [0,0,0,0,0,0|4,0,0]=4 8 B12R1.270 C=Cc1cnc(C)c(OCC)c1 Amb27615637 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.270 CC#Cc1cc(C#N)ccc1O Amb27749789 [0,0,0,0,0,0|2,0,2]=4 10 B12R1.270 CCCc1cc(C#N)ccc1O Amb18645496 [0,0,0,0,0,0|2,0,1]=3 11 B12R1.270 CCCc1cc(C=O)ccc1O Amb27403523 [0,0,0,0,0,0|1,0,0]=1 12 B12R1.270 CCCc1cc(CBr)ccc1F Amb32709906 [0,0,0,0,0,0|3,0,1]=4 13 B12R1.270 CCCc1cc(CCl)ccc1F Amb32709928 [0,0,0,0,0,0|3,0,1]=4 14 B12R1.270 CCCc1cc(CN)ccc1F Amb26993973 [0,0,0,0,0,0|3,0,1]=4 15 B12R1.270 CCCc1cc(OC)ccc1O Amb27654010 [0,0,0,0,0,0|3,0,0]=3 16 B12R1.270 CCCc1nc(C#N)ccc1O Amb27246575 [0,0,0,0,0,0|3,0,1]=4 17 B12R1.270 CCNc1cc(C#N)ccc1C Amb18284697 [0,0,0,0,0,0|3,0,1]=4 18 B12R1.270 CCNc1cc(OC)ccc1C Amb27244503 [0,0,0,0,0,0|4,0,0]=4 19 B12R1.270 CCNc1cc(OC)ccc1F Amb27240606 [0,0,0,0,0,0|4,0,0]=4 20 B12R1.270 CCNc1cc(OC)ccc1N Amb25111820 [0,0,0,0,0,0|4,0,0]=4 21 B12R1.270 CCNc1cc(SC)ccc1C Amb27396627 [0,0,0,0,0,0|4,0,0]=4 22 B12R1.270 CCNc1nc(C=O)ccc1C Amb27408681 [0,0,0,0,0,0|3,0,0]=3 23 B12R1.270 CCOc1cc(C#N)ccc1C Amb26876266 [0,0,0,0,0,0|2,0,1]=3 24 B12R1.270 CCOc1cc(C#N)ccc1F Amb27256907 [0,0,0,0,0,0|2,0,1]=3 25 B12R1.270 CCOc1cc(C#N)ccc1I Amb23437517 [0,0,0,0,0,0|2,0,1]=3 26 B12R1.270 CCOc1cc(C#N)ccc1N Amb24701044 [0,0,0,0,0,0|2,0,1]=3 27 B12R1.270 CCOc1cc(C#N)ccc1O Amb1657776 [0,0,0,0,0,0|1,0,1]=2 28 B12R1.270 CCOc1cc(C#N)ccc1S Amb26459922 [0,0,0,0,0,0|1,1,1]=3 29 B12R1.270 CCOc1cc(C#N)cnc1N Amb27834363 [0,0,0,0,0,0|3,0,1]=4 30 B12R1.270 CCOc1cc(C=O)ccc1Br Amb22500717 [0,0,0,0,0,0|1,0,0]=1 31 B12R1.270 CCOc1cc(C=O)ccc1C Amb22500724 [0,0,0,0,0,0|1,0,0]=1 32 B12R1.270 CCOc1cc(C=O)ccc1F Amb10066935 [0,0,0,0,0,0|1,0,0]=1 33 B12R1.270 CCOc1cc(C=O)ccc1O Amb837240 [0,0,0,0,0,0|0,0,0]=0 34 B12R1.270 CCOc1cc(C=O)ccc1S Amb32688027 [0,0,0,0,0,0|0,1,0]=1 35 B12R1.270 CCOc1cc(CBr)ccc1F Amb27474815 [0,0,0,0,0,0|2,0,1]=3 36 B12R1.270 CCOc1cc(CBr)ccc1I Amb27810322 [0,0,0,0,0,0|2,0,1]=3 37 B12R1.270 CCOc1cc(CBr)ccc1O Amb33386402 [0,0,0,0,0,0|1,0,1]=2 38 B12R1.270 CCOc1cc(CBr)ncc1C Amb28293376 [0,0,0,0,0,0|3,0,1]=4 39 B12R1.270 CCOc1cc(CC)ccc1N Amb27273602 [0,0,0,0,0,0|2,0,1]=3 40 B12R1.270 CCOc1cc(CCl)ccc1Cl Amb22501132 [0,0,0,0,0,0|2,0,1]=3 41 B12R1.270 CCOc1cc(CCl)ccc1O Amb17477719 [0,0,0,0,0,0|1,0,1]=2 42 B12R1.270 CCOc1cc(CCl)ncc1C Amb27661407 [0,0,0,0,0,0|3,0,1]=4 43 B12R1.270 CCOc1cc(CN)ccc1O Amb1117009 [0,0,0,0,0,0|1,0,1]=2 44 B12R1.270 CCOc1cc(CN)ccc1O Amb19260515 [0,0,0,0,0,0|1,0,1]=2 45 B12R1.270 CCOc1cc(CO)ccc1Cl Amb25868761 [0,0,0,0,0,0|1,0,2]=3 46 B12R1.270 CCOc1cc(CO)ccc1F Amb27267479 [0,0,0,0,0,0|1,0,2]=3 47 B12R1.270 CCOc1cc(CO)ccc1O Amb2687724 [0,0,0,0,0,0|0,0,2]=2 48 B12R1.270 CCOc1cc(CO)cnc1Cl Amb28042488 [0,0,0,0,0,0|2,0,2]=4 49 B12R1.270 CCOc1cc(CS)ccc1O Amb32788795 [0,0,0,0,0,0|0,1,1]=2 50 B12R1.270 CCOc1cc(NC)ccc1C Amb35698142 [0,0,0,0,0,0|3,0,0]=3 51 B12R1.270 CCOc1cc(NN)ccc1Br Amb27669893 [0,0,0,0,0,0|3,0,0]=3 52 B12R1.270 CCOc1cc(NN)ccc1C Amb27599804 [0,0,0,0,0,0|3,0,0]=3 53 B12R1.270 CCOc1cc(NN)ccc1Cl Amb28202680 [0,0,0,0,0,0|3,0,0]=3 54 B12R1.270 CCOc1cc(NN)ccc1F Amb25217688 [0,0,0,0,0,0|3,0,0]=3 55 B12R1.270 CCOc1cc(NN)ccc1I Amb24638208 [0,0,0,0,0,0|3,0,0]=3 56 B12R1.270 CCOc1cc(NN)ccc1N Amb27259748 [0,0,0,0,0,0|3,0,0]=3 57 B12R1.270 CCOc1cc(NN)ccc1O Amb25921861 [0,0,0,0,0,0|2,0,0]=2 58 B12R1.270 CCOc1cc(NN)ccc1S Amb26458133 [0,0,0,0,0,0|2,1,0]=3 59 B12R1.270 CCOc1cc(OC)ccc1Br Amb28127812 [0,0,0,0,0,0|3,0,0]=3 60 B12R1.270 CCOc1cc(OC)ccc1N Amb18646728 [0,0,0,0,0,0|3,0,0]=3 61 B12R1.270 CCOc1cc(SC)ccc1C Amb26350654 [0,0,0,0,0,0|3,0,0]=3 62 B12R1.270 CCOc1cc(SC)ccc1F Amb24699144 [0,0,0,0,0,0|3,0,0]=3 63 B12R1.270 CCOc1cc(SC)ccc1N Amb28141001 [0,0,0,0,0,0|3,0,0]=3 64 B12R1.270 CCOc1cc([N+]#N)ccc1C Amb29859462 [0,0,0,0,0,0|3,0,0]=3 65 B12R1.270 CCOc1nc(C=O)ccc1C Amb22755012 [0,0,0,0,0,0|2,0,0]=2 66 B12R1.270 CCOc1nc(OC)ccc1N Amb8889283 [0,0,0,0,0,0|4,0,0]=4 67 B12R1.270 CCSc1cc(C#N)ccc1Cl Amb27770730 [0,0,0,0,0,0|2,1,1]=4 68 B12R1.270 CCSc1cc(C#N)ccc1F Amb27464545 [0,0,0,0,0,0|2,1,1]=4 69 B12R1.270 CCSc1cc(C#N)ccc1I Amb26518768 [0,0,0,0,0,0|2,1,1]=4 70 B12R1.270 CCSc1cc(C#N)ccc1N Amb27222654 [0,0,0,0,0,0|2,1,1]=4 71 B12R1.270 CCSc1cc(C#N)ccc1O Amb26622350 [0,0,0,0,0,0|1,1,1]=3 72 B12R1.270 CCSc1cc(CC)ccc1Br Amb24472311 [0,0,0,0,0,0|2,1,1]=4 73 B12R1.270 CCSc1cc(CC)ccc1C Amb26328802 [0,0,0,0,0,0|2,1,1]=4 74 B12R1.270 CCSc1cc(CC)ccc1Cl Amb28041047 [0,0,0,0,0,0|2,1,1]=4 75 B12R1.270 CCSc1cc(CC)ccc1F Amb28124825 [0,0,0,0,0,0|2,1,1]=4 76 B12R1.270 CCSc1cc(CC)ccc1I Amb27628723 [0,0,0,0,0,0|2,1,1]=4 77 B12R1.270 CCSc1cc(CC)ccc1O Amb27464678 [0,0,0,0,0,0|1,1,1]=3 78 B12R1.270 CCSc1cc(OC)ccc1C Amb28288445 [0,0,0,0,0,0|3,1,0]=4 79 B12R1.270 CCSc1cc(OC)ccc1Cl Amb25842400 [0,0,0,0,0,0|3,1,0]=4 80 B12R1.270 CCSc1cc(OC)ccc1F Amb27469900 [0,0,0,0,0,0|3,1,0]=4 81 B12R1.270 CCSc1cc(OC)ccc1I Amb24495018 [0,0,0,0,0,0|3,1,0]=4 82 B12R1.270 CCSc1cc(OC)ccc1N Amb26645059 [0,0,0,0,0,0|3,1,0]=4 83 B12R1.270 CCSc1cc(OC)ccc1O Amb27410605 [0,0,0,0,0,0|2,1,0]=3 84 B12R1.270 CCc1ccc(O)c(CNC)c1 Amb27946814 [0,0,0,0,0,0|3,0,1]=4 85 B12R1.270 CNCc1cc(CF)ccc1O Amb27229257 [0,0,0,0,0,0|3,0,1]=4 86 B12R1.270 CNCc1cc(CN)ccc1O Amb33038392 [0,0,0,0,0,0|3,0,1]=4 87 B12R1.270 CNCc1cc(OC)ccc1O Amb6719023 [0,0,0,0,0,0|4,0,0]=4 88 B12R1.270 COc1ccc(O)c(CCBr)c1 Amb33006863 [0,0,0,0,0,0|4,0,0]=4 89 B12R1.270 COc1ccc(O)c(CCN)c1 Amb8895388 [0,0,0,0,0,0|4,0,0]=4 90 B12R1.270 COc1ccc(O)c(CCO)c1 Amb18646895 [0,0,0,0,0,0|4,0,0]=4 91 B12R1.270 COc1ccc(O)c(CCS)c1 Amb32874796 [0,0,0,0,0,0|4,0,0]=4 92 B12R1.270 Cc1ccc(C#N)cc1OCCl Amb25938199 [0,0,0,0,0,0|3,0,1]=4 93 B12R1.270 NCCc1cc(CCl)ccc1O Amb27830674 [0,0,0,0,0,0|3,0,1]=4 94 B12R1.270 NCCc1cc(CN)ccc1O Amb23559326 [0,0,0,0,0,0|3,0,1]=4 95 B12R1.270 NCCc1cc(CN)ccc1O Amb24117572 [0,0,0,0,0,0|3,0,1]=4 96 B12R1.270 NNc1ccc(Br)c(OCF)c1 Amb25921898 [0,0,0,0,0,0|4,0,0]=4 97 B12R1.270 O=CNc1cc(C=O)ccc1O Amb28397239 [0,0,0,0,0,0|2,0,1]=3 98 B12R1.270 O=Cc1ccc(O)c(CCF)c1 Amb27256343 [0,0,0,0,0,0|2,0,0]=2 99 B11R1.182 C=COC1=CC(=O)C=CC1=O Amb28454028 [1,0,0,0,0,0|0,0,3]=4 100 B11R1.182 CCCc1cc(Br)ccc1N Amb28128360 [1,0,0,0,0,0|3,0,0]=4 101 B11R1.182 CCCc1cc(Br)ccc1O Amb27839911 [1,0,0,0,0,0|2,0,0]=3 102 B11R1.182 CCCc1cc(N)ccc1Br Amb28140059 [1,0,0,0,0,0|3,0,0]=4 103 B11R1.182 CCCc1cc(N)ccc1N Amb27645477 [1,0,0,0,0,0|3,0,0]=4 104 B11R1.182 CCCc1cc(O)ccc1Br Amb28139098 [1,0,0,0,0,0|2,0,1]=4 105 B11R1.182 CCCc1cc(O)ccc1Cl Amb26910144 [1,0,0,0,0,0|2,0,1]=4 106 B11R1.182 CCCc1nc(I)ccc1O Amb27237710 [1,0,0,0,0,0|3,0,0]=4 107 B11R1.182 CCNC1=CC(=O)C=CC1=O Amb27828586 [1,0,0,0,0,0|1,0,1]=3 108 B11R1.182 CCNc1cc(Br)ccc1C Amb9595585 [1,0,0,0,0,0|3,0,0]=4 109 B11R1.182 CCNc1cc(Br)ccc1Cl Amb24438946 [1,0,0,0,0,0|3,0,0]=4 110 B11R1.182 CCNc1cc(Br)ccc1N Amb22059682 [1,0,0,0,0,0|3,0,0]=4 111 B11R1.182 CCNc1cc(C)ccc1Br Amb27169701 [1,0,0,0,0,0|2,0,1]=4 112 B11R1.182 CCNc1cc(C)ccc1C Amb10609582 [1,0,0,0,0,0|2,0,1]=4 113 B11R1.182 CCNc1cc(C)ccc1C Amb4313308 [1,0,0,0,0,0|2,0,1]=4 114 B11R1.182 CCNc1cc(C)ccc1F Amb7760288 [1,0,0,0,0,0|2,0,1]=4 115 B11R1.182 CCNc1cc(C)ccc1N Amb23114121 [1,0,0,0,0,0|2,0,1]=4 116 B11R1.182 CCNc1cc(C)ccc1O Amb1091058 [1,0,0,0,0,0|1,0,1]=3 117 B11R1.182 CCNc1cc(Cl)ccc1C Amb6683518 [1,0,0,0,0,0|3,0,0]=4 118 B11R1.182 CCNc1cc(Cl)ccc1Cl Amb6687675 [1,0,0,0,0,0|3,0,0]=4 119 B11R1.182 CCNc1cc(Cl)ccc1F Amb9238490 [1,0,0,0,0,0|3,0,0]=4 120 B11R1.182 CCNc1cc(Cl)ccc1I Amb30016026 [1,0,0,0,0,0|3,0,0]=4 121 B11R1.182 CCNc1cc(Cl)ccc1N Amb27828628 [1,0,0,0,0,0|3,0,0]=4 122 B11R1.182 CCNc1cc(Cl)ccc1N Amb33338826 [1,0,0,0,0,0|3,0,0]=4 123 B11R1.182 CCNc1cc(Cl)ccc1O Amb18940920 [1,0,0,0,0,0|2,0,0]=3 124 B11R1.182 CCNc1cc(F)ccc1Br Amb27823513 [1,0,0,0,0,0|3,0,0]=4 125 B11R1.182 CCNc1cc(F)ccc1C Amb30982589 [1,0,0,0,0,0|3,0,0]=4 126 B11R1.182 CCNc1cc(F)ccc1C Amb6698533 [1,0,0,0,0,0|3,0,0]=4 127 B11R1.182 CCNc1cc(F)ccc1F Amb6691521 [1,0,0,0,0,0|3,0,0]=4 128 B11R1.182 CCNc1cc(F)ccc1N Amb18961168 [1,0,0,0,0,0|3,0,0]=4 129 B11R1.182 CCNc1cc(F)ccc1O Amb18057774 [1,0,0,0,0,0|2,0,0]=3 130 B11R1.182 CCNc1cc(I)ccc1Cl Amb27971950 [1,0,0,0,0,0|3,0,0]=4 131 B11R1.182 CCNc1cc(O)ccc1C Amb6608932 [1,0,0,0,0,0|2,0,1]=4 132 B11R1.182 CCOC1=CC(=O)C=CC1=O Amb25808014 [1,0,0,0,0,0|0,0,1]=2 133 B11R1.182 CCOC1=CC(=O)NC=C1Cl Amb27962702 [1,0,0,0,0,0|2,0,0]=3 134 B11R1.182 CCOC1=NC(=O)C=CN1C Amb27641175 [1,0,0,0,0,0|3,0,0]=4 135 B11R1.182 CCOc1cc(Br)ccc1Br Amb19888214 [1,0,0,0,0,0|2,0,0]=3 136 B11R1.182 CCOc1cc(Br)ccc1C Amb22490068 [1,0,0,0,0,0|2,0,0]=3 137 B11R1.182 CCOc1cc(Br)ccc1Cl Amb19888232 [1,0,0,0,0,0|2,0,0]=3 138 B11R1.182 CCOc1cc(Br)ccc1F Amb21963483 [1,0,0,0,0,0|2,0,0]=3 139 B11R1.182 CCOc1cc(Br)ccc1I Amb19888233 [1,0,0,0,0,0|2,0,0]=3 140 B11R1.182 CCOc1cc(Br)ccc1N Amb18657907 [1,0,0,0,0,0|2,0,0]=3 141 B11R1.182 CCOc1cc(Br)ccc1O Amb5781633 [1,0,0,0,0,0|1,0,0]=2 142 B11R1.182 CCOc1cc(Br)ccc1S Amb28280097 [1,0,0,0,0,0|1,1,0]=3 143 B11R1.182 CCOc1cc(Br)cnc1Br Amb2609587 [1,0,0,0,0,0|3,0,0]=4 144 B11R1.182 CCOc1cc(Br)cnc1C Amb26887601 [1,0,0,0,0,0|3,0,0]=4 145 B11R1.182 CCOc1cc(Br)cnc1Cl Amb22276716 [1,0,0,0,0,0|3,0,0]=4 146 B11R1.182 CCOc1cc(Br)cnc1F Amb25922797 [1,0,0,0,0,0|3,0,0]=4 147 B11R1.182 CCOc1cc(Br)cnc1N Amb24087653 [1,0,0,0,0,0|3,0,0]=4 148 B11R1.182 CCOc1cc(Br)ncc1Br Amb2609585 [1,0,0,0,0,0|3,0,0]=4 149 B11R1.182 CCOc1cc(Br)ncc1Cl Amb27463550 [1,0,0,0,0,0|3,0,0]=4 150 B11R1.182 CCOc1cc(C)ccc1Br Amb25085057 [1,0,0,0,0,0|1,0,1]=3 151 B11R1.182 CCOc1cc(C)ccc1N Amb6275717 [1,0,0,0,0,0|1,0,1]=3 152 B11R1.182 CCOc1cc(C)ccc1O Amb2720927 [1,0,0,0,0,0|0,0,1]=2 153 B11R1.182 CCOc1cc(C)ccc1S Amb26606875 [1,0,0,0,0,0|0,1,1]=3 154 B11R1.182 CCOc1cc(C)cnc1N Amb25337641 [1,0,0,0,0,0|2,0,1]=4 155 B11R1.182 CCOc1cc(Cl)ccc1F Amb16186002 [1,0,0,0,0,0|2,0,0]=3 156 B11R1.182 CCOc1cc(Cl)ccc1N Amb18960041 [1,0,0,0,0,0|2,0,0]=3 157 B11R1.182 CCOc1cc(Cl)ccc1N Amb22274126 [1,0,0,0,0,0|2,0,0]=3 158 B11R1.182 CCOc1cc(Cl)ccc1O Amb18126988 [1,0,0,0,0,0|1,0,0]=2 159 B11R1.182 CCOc1cc(Cl)ccc1S Amb26597554 [1,0,0,0,0,0|1,1,0]=3 160 B11R1.182 CCOc1cc(Cl)cnc1Br Amb28127947 [1,0,0,0,0,0|3,0,0]=4 161 B11R1.182 CCOc1cc(Cl)ncc1N Amb27209340 [1,0,0,0,0,0|3,0,0]=4 162 B11R1.182 CCOc1cc(Cl)ncc1O Amb27600930 [1,0,0,0,0,0|2,0,0]=3 163 B11R1.182 CCOc1cc(F)ccc1Br Amb24065598 [1,0,0,0,0,0|2,0,0]=3 164 B11R1.182 CCOc1cc(F)ccc1C Amb27606152 [1,0,0,0,0,0|2,0,0]=3 165 B11R1.182 CCOc1cc(F)ccc1Cl Amb10841500 [1,0,0,0,0,0|2,0,0]=3 166 B11R1.182 CCOc1cc(F)ccc1N Amb1129616 [1,0,0,0,0,0|2,0,0]=3 167 B11R1.182 CCOc1cc(F)ccc1N Amb21964960 [1,0,0,0,0,0|2,0,0]=3 168 B11R1.182 CCOc1cc(F)ccc1S Amb24649837 [1,0,0,0,0,0|1,1,0]=3 169 B11R1.182 CCOc1cc(F)cnc1C Amb27228819 [1,0,0,0,0,0|3,0,0]=4 170 B11R1.182 CCOc1cc(F)cnc1I Amb27445771 [1,0,0,0,0,0|3,0,0]=4 171 B11R1.182 CCOc1cc(I)ccc1S Amb27469856 [1,0,0,0,0,0|1,1,0]=3 172 B11R1.182 CCOc1cc(I)cnc1F Amb27209515 [1,0,0,0,0,0|3,0,0]=4 173 B11R1.182 CCOc1cc(I)ncc1F Amb25223805 [1,0,0,0,0,0|3,0,0]=4 174 B11R1.182 CCOc1cc(N)ccc1Br Amb22274125 [1,0,0,0,0,0|2,0,0]=3 175 B11R1.182 CCOc1cc(N)ccc1Br Amb6366087 [1,0,0,0,0,0|2,0,0]=3 176 B11R1.182 CCOc1cc(N)ccc1C Amb19283587 [1,0,0,0,0,0|2,0,0]=3 177 B11R1.182 CCOc1cc(N)ccc1C Amb9381361 [1,0,0,0,0,0|2,0,0]=3 178 B11R1.182 CCOc1cc(N)ccc1Cl Amb19959885 [1,0,0,0,0,0|2,0,0]=3 179 B11R1.182 CCOc1cc(N)ccc1N Amb26919930 [1,0,0,0,0,0|2,0,0]=3 180 B11R1.182 CCOc1cc(N)ccc1O Amb18125535 [1,0,0,0,0,0|1,0,0]=2 181 B11R1.182 CCOc1cc(N)ccc1S Amb26460975 [1,0,0,0,0,0|1,1,0]=3 182 B11R1.182 CCOc1cc(N)cnc1Br Amb19958188 [1,0,0,0,0,0|3,0,0]=4 183 B11R1.182 CCOc1cc(N)cnc1C Amb27947982 [1,0,0,0,0,0|3,0,0]=4 184 B11R1.182 CCOc1cc(N)cnc1Cl Amb23437253 [1,0,0,0,0,0|3,0,0]=4 185 B11R1.182 CCOc1cc(N)cnc1N Amb23437251 [1,0,0,0,0,0|3,0,0]=4 186 B11R1.182 CCOc1cc(N)ncc1Br Amb22263317 [1,0,0,0,0,0|3,0,0]=4 187 B11R1.182 CCOc1cc(O)ccc1Br Amb24091323 [1,0,0,0,0,0|1,0,1]=3 188 B11R1.182 CCOc1cc(O)ccc1N Amb28652848 [1,0,0,0,0,0|1,0,1]=3 189 B11R1.182 CCOc1cc(O)ccc1O Amb18125661 [1,0,0,0,0,0|0,0,1]=2 190 B11R1.182 CCOc1cc(O)ccc1S Amb25188767 [1,0,0,0,0,0|0,1,1]=3 191 B11R1.182 CCOc1cc(O)cnc1Cl Amb27600192 [1,0,0,0,0,0|2,0,1]=4 192 B11R1.182 CCOc1cc(S)ccc1C Amb26055384 [1,0,0,0,0,0|1,1,0]=3 193 B11R1.182 CCOc1cc(S)ccc1F Amb25677321 [1,0,0,0,0,0|1,1,0]=3 194 B11R1.182 CCOc1cc(S)ccc1O Amb33223760 [1,0,0,0,0,0|0,1,0]=2 195 B11R1.182 CCOc1nc(Br)ccc1Br Amb27667188 [1,0,0,0,0,0|3,0,0]=4 196 B11R1.182 CCOc1nc(C)ccc1N Amb27848482 [1,0,0,0,0,0|2,0,1]=4 197 B11R1.182 CCOc1nc(C)ccc1O Amb32669711 [1,0,0,0,0,0|1,0,1]=3 198 B11R1.182 CCOc1nc(Cl)ccc1N Amb26615356 [1,0,0,0,0,0|3,0,0]=4 199 B11R1.182 CCOc1nc(F)ccc1N Amb33035349 [1,0,0,0,0,0|3,0,0]=4 200 B11R1.182 CCOc1nc(I)ccc1F Amb25238962 [1,0,0,0,0,0|3,0,0]=4 201 B11R1.182 CCOc1nc(N)ccc1Br Amb27871463 [1,0,0,0,0,0|3,0,0]=4 202 B11R1.182 CCOc1nc(N)ccc1N Amb8889142 [1,0,0,0,0,0|3,0,0]=4 203 B11R1.182 CCOc1nc(O)ccc1N Amb8889926 [1,0,0,0,0,0|2,0,1]=4 204 B11R1.182 CCSc1cc(Br)ccc1Br Amb25324695 [1,0,0,0,0,0|2,1,0]=4 205 B11R1.182 CCSc1cc(Br)ccc1C Amb25891668 [1,0,0,0,0,0|2,1,0]=4 206 B11R1.182 CCSc1cc(Br)ccc1Cl Amb27234899 [1,0,0,0,0,0|2,1,0]=4 207 B11R1.182 CCSc1cc(Br)ccc1F Amb26395974 [1,0,0,0,0,0|2,1,0]=4 208 B11R1.182 CCSc1cc(Br)ccc1I Amb28182552 [1,0,0,0,0,0|2,1,0]=4 209 B11R1.182 CCSc1cc(Br)ccc1O Amb24732310 [1,0,0,0,0,0|1,1,0]=3 210 B11R1.182 CCSc1cc(C)ccc1C Amb27194507 [1,0,0,0,0,0|1,1,1]=4 211 B11R1.182 CCSc1cc(C)ccc1Cl Amb25721943 [1,0,0,0,0,0|1,1,1]=4 212 B11R1.182 CCSc1cc(C)ccc1F Amb26504011 [1,0,0,0,0,0|1,1,1]=4 213 B11R1.182 CCSc1cc(C)ccc1I Amb25891795 [1,0,0,0,0,0|1,1,1]=4 214 B11R1.182 CCSc1cc(C)ccc1N Amb24399329 [1,0,0,0,0,0|1,1,1]=4 215 B11R1.182 CCSc1cc(C)ccc1O Amb26634530 [1,0,0,0,0,0|0,1,1]=3 216 B11R1.182 CCSc1cc(Cl)ccc1Br Amb25782875 [1,0,0,0,0,0|2,1,0]=4 217 B11R1.182 CCSc1cc(Cl)ccc1C Amb25923209 [1,0,0,0,0,0|2,1,0]=4 218 B11R1.182 CCSc1cc(Cl)ccc1Cl Amb25250548 [1,0,0,0,0,0|2,1,0]=4 219 B11R1.182 CCSc1cc(Cl)ccc1F Amb25891612 [1,0,0,0,0,0|2,1,0]=4 220 B11R1.182 CCSc1cc(Cl)ccc1I Amb28185509 [1,0,0,0,0,0|2,1,0]=4 221 B11R1.182 CCSc1cc(Cl)ccc1N Amb28048872 [1,0,0,0,0,0|2,1,0]=4 222 B11R1.182 CCSc1cc(F)ccc1C Amb24484432 [1,0,0,0,0,0|2,1,0]=4 223 B11R1.182 CCSc1cc(F)ccc1Cl Amb27494960 [1,0,0,0,0,0|2,1,0]=4 224 B11R1.182 CCSc1cc(F)ccc1F Amb25352573 [1,0,0,0,0,0|2,1,0]=4 225 B11R1.182 CCSc1cc(F)ccc1I Amb27823458 [1,0,0,0,0,0|2,1,0]=4 226 B11R1.182 CCSc1cc(F)ccc1N Amb18961236 [1,0,0,0,0,0|2,1,0]=4 227 B11R1.182 CCSc1cc(F)ccc1O Amb25722002 [1,0,0,0,0,0|1,1,0]=3 228 B11R1.182 CCSc1cc(I)ccc1C Amb27868740 [1,0,0,0,0,0|2,1,0]=4 229 B11R1.182 CCSc1cc(I)ccc1Cl Amb24379061 [1,0,0,0,0,0|2,1,0]=4 230 B11R1.182 CCSc1cc(I)ccc1F Amb24591510 [1,0,0,0,0,0|2,1,0]=4 231 B11R1.182 CCSc1cc(I)ccc1N Amb28253071 [1,0,0,0,0,0|2,1,0]=4 232 B11R1.182 CCSc1cc(I)ccc1O Amb28187342 [1,0,0,0,0,0|1,1,0]=3 233 B11R1.182 CCSc1cc(N)ccc1Br Amb25955506 [1,0,0,0,0,0|2,1,0]=4 234 B11R1.182 CCSc1cc(N)ccc1C Amb18962632 [1,0,0,0,0,0|2,1,0]=4 235 B11R1.182 CCSc1cc(N)ccc1Cl Amb25893012 [1,0,0,0,0,0|2,1,0]=4 236 B11R1.182 CCSc1cc(N)ccc1N Amb26372746 [1,0,0,0,0,0|2,1,0]=4 237 B11R1.182 CCSc1cc(O)ccc1Br Amb24600972 [1,0,0,0,0,0|1,1,1]=4 238 B11R1.182 CCSc1cc(O)ccc1F Amb24396758 [1,0,0,0,0,0|1,1,1]=4 239 B11R1.182 CCSc1cc(O)ccc1I Amb26984357 [1,0,0,0,0,0|1,1,1]=4 240 B11R1.182 CCSc1cc(O)ccc1N Amb26508590 [1,0,0,0,0,0|1,1,1]=4 241 B11R1.182 CCSc1cc(O)ccc1O Amb25922682 [1,0,0,0,0,0|0,1,1]=3 242 B11R1.182 CNCc1cc(Br)ccc1O Amb31305183 [1,0,0,0,0,0|3,0,0]=4 243 B11R1.182 CNCc1cc(Br)ccc1O Amb7173567 [1,0,0,0,0,0|3,0,0]=4 244 B11R1.182 CNCc1cc(C)ccc1O Amb9776245 [1,0,0,0,0,0|2,0,1]=4 245 B11R1.182 CNCc1cc(Cl)ccc1O Amb1113632 [1,0,0,0,0,0|3,0,0]=4 246 B11R1.182 CNCc1cc(F)ccc1O Amb18941476 [1,0,0,0,0,0|3,0,0]=4 247 B11R1.182 CNCc1cc(O)ccc1O Amb19929937 [1,0,0,0,0,0|2,0,1]=4 248 B11R1.182 COCc1cc(C)ccc1O Amb18125394 [1,0,0,0,0,0|2,0,1]=4 249 B11R1.182 COCc1cc(N)ccc1O Amb24065718 [1,0,0,0,0,0|3,0,0]=4 250 B11R1.182 CSCc1cc(C)ccc1O Amb18126552 [1,0,0,0,0,0|2,0,1]=4 251 B11R1.182 CSCc1cc(Cl)ccc1O Amb18650044 [1,0,0,0,0,0|3,0,0]=4 252 B11R1.182 C\C=C/c1cc(C)ccc1O Amb27854651 [1,0,0,0,0,0|1,0,2]=4 253 B11R1.182 C\C=C\c1cc(Br)ccc1O Amb26936727 [1,0,0,0,0,0|2,0,1]=4 254 B11R1.182 C\C=C\c1cc(F)ccc1O Amb24737454 [1,0,0,0,0,0|2,0,1]=4 255 B11R1.182 C\C=N\c1cc(C)ccc1O Amb26431822 [1,0,0,0,0,0|1,0,2]=4 256 B11R1.182 C\C=N\c1cc(O)ccc1O Amb27848200 [1,0,0,0,0,0|1,0,2]=4 257 B11R1.182 Cc1ccc(Br)c(OCCl)c1 Amb32685631 [1,0,0,0,0,0|2,0,1]=4 258 B11R1.182 Cc1ccc(Br)cc1OCCl Amb27425299 [1,0,0,0,0,0|3,0,0]=4 259 B11R1.182 Cc1ccc(F)c(OCCl)c1 Amb28130898 [1,0,0,0,0,0|2,0,1]=4 260 B11R1.182 Cc1ccc(F)cc1OCCl Amb26483781 [1,0,0,0,0,0|3,0,0]=4 261 B11R1.182 Cc1ccc(O)c(CCBr)c1 Amb33009011 [1,0,0,0,0,0|2,0,1]=4 262 B11R1.182 Cc1ccc(O)c(CCN)c1 Amb18054566 [1,0,0,0,0,0|2,0,1]=4 263 B11R1.182 Cc1ccc(O)c(CCO)c1 Amb27954032 [1,0,0,0,0,0|2,0,1]=4 264 B11R1.182 Cc1ccc(O)c(CCS)c1 Amb33267898 [1,0,0,0,0,0|2,0,1]=4 265 B11R1.182 ClCOc1cc(Br)ccc1Cl Amb25770971 [1,0,0,0,0,0|3,0,0]=4 266 B11R1.182 ClCOc1cc(Cl)ccc1Br Amb32685632 [1,0,0,0,0,0|3,0,0]=4 267 B11R1.182 Fc1ccc(Br)c(OCCl)c1 Amb26455480 [1,0,0,0,0,0|3,0,0]=4 268 B11R1.182 Fc1ccc(Br)cc1OCCl Amb25075004 [1,0,0,0,0,0|3,0,0]=4 269 B11R1.182 Fc1ccc(Cl)c(OCCl)c1 Amb28206255 [1,0,0,0,0,0|3,0,0]=4 270 B11R1.182 Fc1ccc(F)c(OCCl)c1 Amb25785994 [1,0,0,0,0,0|3,0,0]=4 271 B11R1.182 NCCc1cc(Br)ccc1O Amb28398000 [1,0,0,0,0,0|3,0,0]=4 272 B11R1.182 NCCc1cc(Cl)ccc1O Amb5761080 [1,0,0,0,0,0|3,0,0]=4 273 B11R1.182 NCCc1cc(F)ccc1O Amb18555152 [1,0,0,0,0,0|3,0,0]=4 274 B11R1.182 NCCc1cc(I)ccc1O Amb25938897 [1,0,0,0,0,0|3,0,0]=4 275 B11R1.182 NCCc1cc(O)ccc1O Amb17593832 [1,0,0,0,0,0|2,0,1]=4 276 B11R1.182 Nc1ccc(O)c(CCO)c1 Amb27823127 [1,0,0,0,0,0|3,0,0]=4 277 B11R1.182 OCCc1cc(Br)ccc1O Amb28240563 [1,0,0,0,0,0|3,0,0]=4 278 B11R1.182 OCCc1cc(Cl)ccc1O Amb33052625 [1,0,0,0,0,0|3,0,0]=4 279 B11R1.182 OCCc1cc(F)ccc1O Amb33380284 [1,0,0,0,0,0|3,0,0]=4 280 B11R1.182 OCCc1cc(O)ccc1O Amb22751348 [1,0,0,0,0,0|2,0,1]=4 281 B11R1.182 Oc1ccc(Br)cc1CCBr Amb33333275 [1,0,0,0,0,0|3,0,0]=4 282 B11R1.182 Oc1ccc(Br)cc1CCS Amb33333971 [1,0,0,0,0,0|3,0,0]=4 283 B11R1.182 Oc1ccc(Cl)cc1CCBr Amb33477190 [1,0,0,0,0,0|3,0,0]=4 284 B11R1.182 Oc1ccc(Cl)cc1CCS Amb33261203 [1,0,0,0,0,0|3,0,0]=4 285 B11R1.182 Oc1ccc(F)cc1CCBr Amb33387909 [1,0,0,0,0,0|3,0,0]=4 286 B11R1.182 Oc1ccc(F)cc1CCS Amb33379206 [1,0,0,0,0,0|3,0,0]=4 287 B11R1.182 Oc1ccc(O)c(CCBr)c1 Amb25028166 [1,0,0,0,0,0|2,0,1]=4 288 B11R1.182 Oc1ccc(O)c(CCS)c1 Amb22388692 [1,0,0,0,0,0|2,0,1]=4 289 B11R1.189 C#CCc1cccc(C=O)c1 Amb25113373 [1,0,0,0,0,0|1,0,2]=4 290 B11R1.189 C#Cc1cc(OCC)ccn1 Amb24445335 [1,0,0,0,0,0|2,0,1]=4 291 B11R1.189 C#Cc1cccc(NCC)c1 Amb6684375 [1,0,0,0,0,0|2,0,1]=4 292 B11R1.189 C#Cc1cccc(OCC)c1 Amb24477546 [1,0,0,0,0,0|1,0,1]=3 293 B11R1.189 C#Cc1cccc(OCC)n1 Amb26459871 [1,0,0,0,0,0|2,0,1]=4 294 B11R1.189 C#Cc1cccc(SCC)c1 Amb30016004 [1,0,0,0,0,0|1,1,1]=4 295 B11R1.189 C=CCc1cccc(C=O)c1 Amb25066956 [1,0,0,0,0,0|1,0,2]=4 296 B11R1.189 C=Cc1cccc(CCC)n1 Amb25151665 [1,0,0,0,0,0|3,0,0]=4 297 B11R1.189 C=Cc1cccc(CCN)c1 Amb25292174 [1,0,0,0,0,0|3,0,0]=4 298 B11R1.189 C=Cc1cccc(CCO)c1 Amb27602591 [1,0,0,0,0,0|3,0,0]=4 299 B11R1.189 C=Cc1cccc(CNC)c1 Amb27389559 [1,0,0,0,0,0|3,0,0]=4 300 B11R1.189 C=Cc1cccc(COC)c1 Amb24684177 [1,0,0,0,0,0|3,0,0]=4 301 B11R1.189 C=Cc1cccc(OCC)c1 Amb25151360 [1,0,0,0,0,0|1,0,0]=2 302 B11R1.189 C=Cc1cccc(OCC)n1 Amb24487079 [1,0,0,0,0,0|2,0,0]=3 303 B11R1.189 C=Cc1ccnc(CCC)c1 Amb25841573 [1,0,0,0,0,0|3,0,0]=4 304 B11R1.189 C=Cc1ccnc(NCC)c1 Amb25913624 [1,0,0,0,0,0|3,0,0]=4 305 B11R1.189 C=Cc1cncc(CCC)c1 Amb24730613 [1,0,0,0,0,0|3,0,0]=4 306 B11R1.189 C=Cc1cncc(NCC)c1 Amb24701358 [1,0,0,0,0,0|3,0,0]=4 307 B11R1.189 CCCc1cc(C=O)ccn1 Amb24099546 [1,0,0,0,0,0|2,0,0]=3 308 B11R1.189 CCCc1cccc(C=O)c1 Amb18124936 [1,0,0,0,0,0|1,0,0]=2 309 B11R1.189 CCCc1cccc(CBr)c1 Amb27839649 [1,0,0,0,0,0|2,0,1]=4 310 B11R1.189 CCCc1cccc(CCl)c1 Amb25987075 [1,0,0,0,0,0|2,0,1]=4 311 B11R1.189 CCCc1cccc(CN)c1 Amb22494798 [1,0,0,0,0,0|2,0,1]=4 312 B11R1.189 CCCc1cccc(CO)c1 Amb25340766 [1,0,0,0,0,0|1,0,2]=4 313 B11R1.189 CCCc1cccc(NN)c1 Amb2726258 [1,0,0,0,0,0|3,0,0]=4 314 B11R1.189 CCCc1ccnc(C=O)c1 Amb27422905 [1,0,0,0,0,0|2,0,0]=3 315 B11R1.189 CCCc1cncc(C=O)c1 Amb18831335 [1,0,0,0,0,0|2,0,0]=3 316 B11R1.189 CCCc1nccc(C=O)n1 Amb18181665 [1,0,0,0,0,0|3,0,0]=4 317 B11R1.189 CCNc1cccc(C#N)c1 Amb6696319 [1,0,0,0,0,0|2,0,1]=4 318 B11R1.189 CCNc1cccc(CC)c1 Amb6699903 [1,0,0,0,0,0|2,0,1]=4 319 B11R1.189 CCNc1cccc(CCl)c1 Amb28059425 [1,0,0,0,0,0|2,0,1]=4 320 B11R1.189 CCNc1cccc(CN)c1 Amb18251329 [1,0,0,0,0,0|2,0,1]=4 321 B11R1.189 CCNc1cccc(CO)c1 Amb9227130 [1,0,0,0,0,0|1,0,2]=4 322 B11R1.189 CCNc1cccc(OC)c1 Amb4313311 [1,0,0,0,0,0|3,0,0]=4 323 B11R1.189 CCNc1cccc(SC)c1 Amb6687794 [1,0,0,0,0,0|3,0,0]=4 324 B11R1.189 CCOc1cc(C#N)ccn1 Amb6280287 [1,0,0,0,0,0|2,0,1]=4 325 B11R1.189 CCOc1cc(C=O)ccn1 Amb27617411 [1,0,0,0,0,0|1,0,0]=2 326 B11R1.189 CCOc1cc(C=O)ncn1 Amb27193309 [1,0,0,0,0,0|2,0,0]=3 327 B11R1.189 CCOc1cc(CBr)ccn1 Amb27823617 [1,0,0,0,0,0|2,0,1]=4 328 B11R1.189 CCOc1cc(CCl)ccn1 Amb18789577 [1,0,0,0,0,0|2,0,1]=4 329 B11R1.189 CCOc1cc(CCl)ccn1 Amb33069669 [1,0,0,0,0,0|2,0,1]=4 330 B11R1.189 CCOc1cc(CN)ccn1 Amb33543124 [1,0,0,0,0,0|2,0,1]=4 331 B11R1.189 CCOc1cc(CO)ccn1 Amb18177251 [1,0,0,0,0,0|1,0,2]=4 332 B11R1.189 CCOc1cc(NN)ccn1 Amb28249033 [1,0,0,0,0,0|3,0,0]=4 333 B11R1.189 CCOc1cc(OC)ccn1 Amb25830951 [1,0,0,0,0,0|3,0,0]=4 334 B11R1.189 CCOc1cccc(C#N)c1 Amb1211892 [1,0,0,0,0,0|1,0,1]=3 335 B11R1.189 CCOc1cccc(C=O)c1 Amb2589522 [1,0,0,0,0,0|0,0,0]=1 336 B11R1.189 CCOc1cccc(C=O)n1 Amb20669383 [1,0,0,0,0,0|1,0,0]=2 337 B11R1.189 CCOc1cccc(CBr)c1 Amb8835666 [1,0,0,0,0,0|1,0,1]=3 338 B11R1.189 CCOc1cccc(CCl)c1 Amb6649816 [1,0,0,0,0,0|1,0,1]=3 339 B11R1.189 CCOc1cccc(CCl)n1 Amb18185708 [1,0,0,0,0,0|2,0,1]=4 340 B11R1.189 CCOc1cccc(CN)c1 Amb1130363 [1,0,0,0,0,0|1,0,1]=3 341 B11R1.189 CCOc1cccc(CN)n1 Amb18296172 [1,0,0,0,0,0|2,0,1]=4 342 B11R1.189 CCOc1cccc(CO)c1 Amb3538708 [1,0,0,0,0,0|0,0,2]=3 343 B11R1.189 CCOc1cccc(CO)n1 Amb18182842 [1,0,0,0,0,0|1,0,2]=4 344 B11R1.189 CCOc1cccc(CS)c1 Amb27472942 [1,0,0,0,0,0|0,1,1]=3 345 B11R1.189 CCOc1cccc(NN)c1 Amb18179438 [1,0,0,0,0,0|2,0,0]=3 346 B11R1.189 CCOc1cccc(OC)c1 Amb22727873 [1,0,0,0,0,0|2,0,0]=3 347 B11R1.189 CCOc1cccc(ON)c1 Amb24472215 [1,0,0,0,0,0|2,0,0]=3 348 B11R1.189 CCOc1cccc(SC)c1 Amb27266096 [1,0,0,0,0,0|2,0,0]=3 349 B11R1.189 CCOc1cccc([Mg]Br)c1 Amb6300525 [1,0,0,0,0,0|2,0,0]=3 350 B11R1.189 CCOc1cccc([N+]#N)c1 Amb28319693 [1,0,0,0,0,0|2,0,0]=3 351 B11R1.189 CCOc1ccnc(C#N)c1 Amb22494774 [1,0,0,0,0,0|2,0,1]=4 352 B11R1.189 CCOc1ccnc(C=O)c1 Amb22233946 [1,0,0,0,0,0|1,0,0]=2 353 B11R1.189 CCOc1ccnc(CBr)c1 Amb28246357 [1,0,0,0,0,0|2,0,1]=4 354 B11R1.189 CCOc1ccnc(CN)c1 Amb18999420 [1,0,0,0,0,0|2,0,1]=4 355 B11R1.189 CCOc1ccnc(CO)c1 Amb18177249 [1,0,0,0,0,0|1,0,2]=4 356 B11R1.189 CCOc1cncc(C#N)c1 Amb23455240 [1,0,0,0,0,0|2,0,1]=4 357 B11R1.189 CCOc1cncc(C=O)c1 Amb22754944 [1,0,0,0,0,0|1,0,0]=2 358 B11R1.189 CCOc1cncc(CN)c1 Amb25340471 [1,0,0,0,0,0|2,0,1]=4 359 B11R1.189 CCOc1cncc(CO)c1 Amb25875725 [1,0,0,0,0,0|1,0,2]=4 360 B11R1.189 CCSc1cccc(C#N)c1 Amb18645932 [1,0,0,0,0,0|1,1,1]=4 361 B11R1.189 CCSc1cccc(C=O)c1 Amb18646622 [1,0,0,0,0,0|0,1,0]=2 362 B11R1.189 CCSc1cccc(CC)c1 Amb25128021 [1,0,0,0,0,0|1,1,1]=4 363 B11R1.189 CCSc1cccc(CN)c1 Amb24093851 [1,0,0,0,0,0|1,1,1]=4 364 B11R1.189 CCSc1cccc(NC)c1 Amb29859415 [1,0,0,0,0,0|2,1,0]=4 365 B11R1.189 CCSc1cccc(NN)c1 Amb35690280 [1,0,0,0,0,0|2,1,0]=4 366 B11R1.189 CCSc1cccc(OC)c1 Amb25887073 [1,0,0,0,0,0|2,1,0]=4 367 B11R1.189 CCSc1cccc(SC)c1 Amb24484431 [1,0,0,0,0,0|2,1,0]=4 368 B11R1.189 CCSc1cccc([N+]#N)c1 Amb29859459 [1,0,0,0,0,0|2,1,0]=4 369 B11R1.189 CNCc1cc(C=O)ccn1 Amb27646813 [1,0,0,0,0,0|3,0,0]=4 370 B11R1.189 CNCc1ccnc(C=O)c1 Amb27211005 [1,0,0,0,0,0|3,0,0]=4 371 B11R1.189 COCc1cccc(C=O)c1 Amb19375375 [1,0,0,0,0,0|2,0,0]=3 372 B11R1.189 COCc1cccc(C=O)n1 Amb8010581 [1,0,0,0,0,0|3,0,0]=4 373 B11R1.189 COCc1ccnc(C=O)c1 Amb27665187 [1,0,0,0,0,0|3,0,0]=4 374 B11R1.189 COc1cccc(OCCl)c1 Amb27867934 [1,0,0,0,0,0|3,0,0]=4 375 B11R1.189 CSCc1cccc(C=O)c1 Amb27971562 [1,0,0,0,0,0|2,0,0]=3 376 B11R1.189 N#CCc1cccc(C=O)c1 Amb25711180 [1,0,0,0,0,0|2,0,1]=4 377 B11R1.189 N#Cc1cccc(OCCl)c1 Amb26880228 [1,0,0,0,0,0|2,0,1]=4 378 B11R1.189 NCCc1cc(C=O)ccn1 Amb27635541 [1,0,0,0,0,0|3,0,0]=4 379 B11R1.189 NCCc1ccnc(C=O)c1 Amb28199002 [1,0,0,0,0,0|3,0,0]=4 380 B11R1.189 [C-]#[N+]c1cccc(OCC)c1 Amb32797432 [1,0,0,0,0,0|2,0,0]=3 381 B11R1.189 [N-]=[N+]=Nc1cccc(C=O)c1 Amb27790670 [1,0,0,0,0,0|3,0,0]=4 382 B11R1.280 C#Cc1ccc(Br)c(OC)c1 Amb33331478 [1,0,0,0,0,0|2,0,1]=4 383 B11R1.280 C#Cc1ccc(C)c(OC)c1 Amb30015948 [1,0,0,0,0,0|2,0,1]=4 384 B11R1.280 C#Cc1ccc(Cl)c(OC)c1 Amb26371137 [1,0,0,0,0,0|2,0,1]=4 385 B11R1.280 C#Cc1ccc(F)c(CC)c1 Amb29859511 [1,0,0,0,0,0|2,0,1]=4 386 B11R1.280 C#Cc1ccc(F)c(OC)c1 Amb26430203 [1,0,0,0,0,0|2,0,1]=4 387 B11R1.280 C#Cc1ccc(N)c(OC)c1 Amb25836406 [1,0,0,0,0,0|2,0,1]=4 388 B11R1.280 C#Cc1ccc(O)c(OC)c1 Amb27167659 [1,0,0,0,0,0|1,0,1]=3 389 B11R1.280 C=Cc1cc(C=O)ccc1F Amb28073772 [1,0,0,0,0,0|1,0,2]=4 390 B11R1.280 C=Cc1cc(CC)c(N)cn1 Amb26318645 [1,0,0,0,0,0|3,0,0]=4 391 B11R1.280 C=Cc1cc(OC)c(F)cn1 Amb24487045 [1,0,0,0,0,0|3,0,0]=4 392 B11R1.280 C=Cc1ccc(Br)c(OC)c1 Amb33331784 [1,0,0,0,0,0|2,0,0]=3 393 B11R1.280 C=Cc1ccc(C)c(OC)c1 Amb33420865 [1,0,0,0,0,0|2,0,0]=3 394 B11R1.280 C=Cc1ccc(C)c(OC)n1 Amb24487091 [1,0,0,0,0,0|3,0,0]=4 395 B11R1.280 C=Cc1ccc(Cl)c(OC)c1 Amb33390305 [1,0,0,0,0,0|2,0,0]=3 396 B11R1.280 C=Cc1ccc(F)c(CN)c1 Amb27883459 [1,0,0,0,0,0|3,0,0]=4 397 B11R1.280 C=Cc1ccc(F)c(OC)c1 Amb22749045 [1,0,0,0,0,0|2,0,0]=3 398 B11R1.280 C=Cc1ccc(F)c(OC)n1 Amb27776476 [1,0,0,0,0,0|3,0,0]=4 399 B11R1.280 C=Cc1ccc(N)c(CC)c1 Amb27596764 [1,0,0,0,0,0|2,0,0]=3 400 B11R1.280 C=Cc1ccc(N)c(OC)n1 Amb26978668 [1,0,0,0,0,0|3,0,0]=4 401 B11R1.280 C=Cc1ccc(O)c(C=C)c1 Amb28287065 [1,0,0,0,0,0|1,0,2]=4 402 B11R1.280 C=Cc1ccc(O)c(OC)c1 Amb6296659 [1,0,0,0,0,0|1,0,0]=2 403 B11R1.280 C=Cc1cnc(Cl)c(OC)c1 Amb25922890 [1,0,0,0,0,0|3,0,0]=4 404 B11R1.280 C=Cc1cnc(N)c(OC)c1 Amb25849926 [1,0,0,0,0,0|3,0,0]=4 405 B11R1.280 C=Cc1cnc(O)c(CN)c1 Amb25936663 [1,0,0,0,0,0|3,0,0]=4 406 B11R1.280 CCC1=C\C(=N\O)C=CC1=O Amb28130608 [1,0,0,0,0,0|1,0,2]=4 407 B11R1.280 CCN1C=C(C=O)C=CC1=O Amb27965000 [1,0,0,0,0,0|1,0,1]=3 408 B11R1.280 CCc1cc(C#N)ccc1Br Amb19892746 [1,0,0,0,0,0|2,0,1]=4 409 B11R1.280 CCc1cc(C#N)ccc1C Amb28349523 [1,0,0,0,0,0|2,0,1]=4 410 B11R1.280 CCc1cc(C#N)ccc1Cl Amb19892751 [1,0,0,0,0,0|2,0,1]=4 411 B11R1.280 CCc1cc(C#N)ccc1F Amb22166872 [1,0,0,0,0,0|2,0,1]=4 412 B11R1.280 CCc1cc(C#N)ccc1I Amb28134329 [1,0,0,0,0,0|2,0,1]=4 413 B11R1.280 CCc1cc(C#N)ccc1N Amb2684405 [1,0,0,0,0,0|2,0,1]=4 414 B11R1.280 CCc1cc(C#N)ccc1O Amb27834281 [1,0,0,0,0,0|1,0,1]=3 415 B11R1.280 CCc1cc(C#N)ccc1S Amb25782970 [1,0,0,0,0,0|1,1,1]=4 416 B11R1.280 CCc1cc(C=O)ccc1Br Amb33744343 [1,0,0,0,0,0|1,0,0]=2 417 B11R1.280 CCc1cc(C=O)ccc1Cl Amb19892755 [1,0,0,0,0,0|1,0,0]=2 418 B11R1.280 CCc1cc(C=O)ccc1O Amb25891446 [1,0,0,0,0,0|0,0,0]=1 419 B11R1.280 CCc1cc(C=O)cnc1Cl Amb27861431 [1,0,0,0,0,0|2,0,0]=3 420 B11R1.280 CCc1cc(CN)ccc1C Amb26879691 [1,0,0,0,0,0|2,0,1]=4 421 B11R1.280 CCc1cc(CN)ccc1N Amb24102924 [1,0,0,0,0,0|2,0,1]=4 422 B11R1.280 CCc1cc(CO)ccc1C Amb27169239 [1,0,0,0,0,0|1,0,2]=4 423 B11R1.280 CCc1cc(CO)ccc1Cl Amb26959420 [1,0,0,0,0,0|1,0,2]=4 424 B11R1.280 CCc1cc(CS)ccc1Br Amb28345986 [1,0,0,0,0,0|1,1,1]=4 425 B11R1.280 CCc1cc(N=O)ccc1O Amb27227025 [1,0,0,0,0,0|1,0,0]=2 426 B11R1.280 CCc1cc(NC)ccc1N Amb27813616 [1,0,0,0,0,0|3,0,0]=4 427 B11R1.280 CCc1cc(NN)ccc1Br Amb27618299 [1,0,0,0,0,0|3,0,0]=4 428 B11R1.280 CCc1cc(NN)ccc1Cl Amb25289457 [1,0,0,0,0,0|3,0,0]=4 429 B11R1.280 CCc1cc(NN)ccc1I Amb27844722 [1,0,0,0,0,0|3,0,0]=4 430 B11R1.280 CCc1cc(NN)ccc1N Amb28252444 [1,0,0,0,0,0|3,0,0]=4 431 B11R1.280 CCc1cc(NN)ccc1O Amb25223493 [1,0,0,0,0,0|2,0,0]=3 432 B11R1.280 CCc1cc(NN)ccc1S Amb25922211 [1,0,0,0,0,0|2,1,0]=4 433 B11R1.280 CCc1cc(OC)ccc1Br Amb22752641 [1,0,0,0,0,0|3,0,0]=4 434 B11R1.280 CCc1cc(OC)ccc1N Amb18057236 [1,0,0,0,0,0|3,0,0]=4 435 B11R1.280 CCc1cc(OC)ccc1O Amb18057238 [1,0,0,0,0,0|2,0,0]=3 436 B11R1.280 CCc1cc(SC)ccc1C Amb25073434 [1,0,0,0,0,0|3,0,0]=4 437 B11R1.280 CCc1cc(SC)ccc1Cl Amb26600191 [1,0,0,0,0,0|3,0,0]=4 438 B11R1.280 CCc1cc(SC)ccc1N Amb25891736 [1,0,0,0,0,0|3,0,0]=4 439 B11R1.280 CCc1cc([N+]#N)ccc1C Amb27480722 [1,0,0,0,0,0|3,0,0]=4 440 B11R1.280 CCc1cc([N+]#N)ccc1F Amb35690477 [1,0,0,0,0,0|3,0,0]=4 441 B11R1.280 CCc1ccc(Br)c(CC)c1 Amb25149056 [1,0,0,0,0,0|2,0,1]=4 442 B11R1.280 CCc1ccc(Br)c(OC)c1 Amb22752637 [1,0,0,0,0,0|2,0,1]=4 443 B11R1.280 CCc1ccc(C)c(CC)c1 Amb22489907 [1,0,0,0,0,0|2,0,1]=4 444 B11R1.280 CCc1ccc(F)c(CC)c1 Amb25720151 [1,0,0,0,0,0|2,0,1]=4 445 B11R1.280 CCc1ccc(N)c(CC)c1 Amb18125027 [1,0,0,0,0,0|2,0,1]=4 446 B11R1.280 CCc1ccc(N)c(OC)c1 Amb4303790 [1,0,0,0,0,0|2,0,1]=4 447 B11R1.280 CCc1ccc(O)c(OC)c1 Amb2720982 [1,0,0,0,0,0|1,0,1]=3 448 B11R1.280 CCc1ccc(O)c(SC)c1 Amb27453450 [1,0,0,0,0,0|1,1,1]=4 449 B11R1.280 CCc1ccc(S)c(CC)c1 Amb24402186 [1,0,0,0,0,0|1,1,1]=4 450 B11R1.280 CCc1ccc(S)c(OC)c1 Amb26475481 [1,0,0,0,0,0|1,1,1]=4 451 B11R1.280 CCc1nc(C=O)ncc1C Amb27967648 [1,0,0,0,0,0|3,0,0]=4 452 B11R1.280 CNc1cc(C#N)ccc1O Amb27860165 [1,0,0,0,0,0|2,0,1]=4 453 B11R1.280 CNc1cc(C=O)ccc1O Amb27464014 [1,0,0,0,0,0|1,0,0]=2 454 B11R1.280 CNc1cc(CN)ccc1O Amb28200193 [1,0,0,0,0,0|2,0,1]=4 455 B11R1.280 CNc1cc(OC)ccc1O Amb18553545 [1,0,0,0,0,0|3,0,0]=4 456 B11R1.280 CNc1cc(SC)ccc1O Amb27244760 [1,0,0,0,0,0|3,0,0]=4 457 B11R1.280 CNc1ccc(Br)c(OC)c1 Amb26622174 [1,0,0,0,0,0|3,0,0]=4 458 B11R1.280 CNc1ccc(C)c(OC)c1 Amb25942974 [1,0,0,0,0,0|3,0,0]=4 459 B11R1.280 CNc1ccc(Cl)c(OC)c1 Amb28069919 [1,0,0,0,0,0|3,0,0]=4 460 B11R1.280 CNc1ccc(F)c(OC)c1 Amb25718501 [1,0,0,0,0,0|3,0,0]=4 461 B11R1.280 CNc1ccc(N)c(OC)c1 Amb26888208 [1,0,0,0,0,0|3,0,0]=4 462 B11R1.280 COC1=C\C(=N\O)C=CC1=O Amb28140640 [1,0,0,0,0,0|1,0,2]=4 463 B11R1.280 COc1cc(C#N)ccc1Br Amb17772373 [1,0,0,0,0,0|2,0,1]=4 464 B11R1.280 COc1cc(C#N)ccc1C Amb10068739 [1,0,0,0,0,0|2,0,1]=4 465 B11R1.280 COc1cc(C#N)ccc1Cl Amb17912110 [1,0,0,0,0,0|2,0,1]=4 466 B11R1.280 COc1cc(C#N)ccc1F Amb6296365 [1,0,0,0,0,0|2,0,1]=4 467 B11R1.280 COc1cc(C#N)ccc1I Amb23437516 [1,0,0,0,0,0|2,0,1]=4 468 B11R1.280 COc1cc(C#N)ccc1N Amb13882837 [1,0,0,0,0,0|2,0,1]=4 469 B11R1.280 COc1cc(C#N)ccc1O Amb1209844 [1,0,0,0,0,0|1,0,1]=3 470 B11R1.280 COc1cc(C#N)ccc1S Amb25204900 [1,0,0,0,0,0|1,1,1]=4 471 B11R1.280 COc1cc(C#N)ncc1O Amb25074057 [1,0,0,0,0,0|2,0,1]=4 472 B11R1.280 COc1cc(C=O)ccc1Br Amb18771155 [1,0,0,0,0,0|1,0,0]=2 473 B11R1.280 COc1cc(C=O)ccc1C Amb2592690 [1,0,0,0,0,0|1,0,0]=2 474 B11R1.280 COc1cc(C=O)ccc1Cl Amb9871394 [1,0,0,0,0,0|1,0,0]=2 475 B11R1.280 COc1cc(C=O)ccc1F Amb2688144 [1,0,0,0,0,0|1,0,0]=2 476 B11R1.280 COc1cc(C=O)ccc1I Amb22500722 [1,0,0,0,0,0|1,0,0]=2 477 B11R1.280 COc1cc(C=O)ccc1N Amb10603960 [1,0,0,0,0,0|1,0,0]=2 478 B11R1.280 COc1cc(C=O)ccc1O Amb1880873 [1,0,0,0,0,0|0,0,0]=1 479 B11R1.280 COc1cc(C=O)ccc1S Amb10610424 [1,0,0,0,0,0|0,1,0]=2 480 B11R1.280 COc1cc(C=O)cnc1Br Amb27866439 [1,0,0,0,0,0|2,0,0]=3 481 B11R1.280 COc1cc(C=O)cnc1Cl Amb26870411 [1,0,0,0,0,0|2,0,0]=3 482 B11R1.280 COc1cc(C=O)cnc1F Amb25892515 [1,0,0,0,0,0|2,0,0]=3 483 B11R1.280 COc1cc(C=O)cnc1I Amb27823469 [1,0,0,0,0,0|2,0,0]=3 484 B11R1.280 COc1cc(C=O)cnc1N Amb25825796 [1,0,0,0,0,0|2,0,0]=3 485 B11R1.280 COc1cc(C=O)ncc1Br Amb27667572 [1,0,0,0,0,0|2,0,0]=3 486 B11R1.280 COc1cc(C=O)ncc1Cl Amb26490625 [1,0,0,0,0,0|2,0,0]=3 487 B11R1.280 COc1cc(C=O)ncc1F Amb25982677 [1,0,0,0,0,0|2,0,0]=3 488 B11R1.280 COc1cc(C=O)ncc1I Amb27666443 [1,0,0,0,0,0|2,0,0]=3 489 B11R1.280 COc1cc(CBr)ccc1Br Amb22501129 [1,0,0,0,0,0|2,0,1]=4 490 B11R1.280 COc1cc(CBr)ccc1C Amb25075362 [1,0,0,0,0,0|2,0,1]=4 491 B11R1.280 COc1cc(CBr)ccc1Cl Amb22002709 [1,0,0,0,0,0|2,0,1]=4 492 B11R1.280 COc1cc(CBr)ccc1F Amb10605881 [1,0,0,0,0,0|2,0,1]=4 493 B11R1.280 COc1cc(CBr)ccc1I Amb23437522 [1,0,0,0,0,0|2,0,1]=4 494 B11R1.280 COc1cc(CBr)ccc1O Amb24079588 [1,0,0,0,0,0|1,0,1]=3 495 B11R1.280 COc1cc(CCl)ccc1Br Amb22501124 [1,0,0,0,0,0|2,0,1]=4 496 B11R1.280 COc1cc(CCl)ccc1C Amb9004321 [1,0,0,0,0,0|2,0,1]=4 497 B11R1.280 COc1cc(CCl)ccc1Cl Amb22501136 [1,0,0,0,0,0|2,0,1]=4 498 B11R1.280 COc1cc(CCl)ccc1F Amb19958737 [1,0,0,0,0,0|2,0,1]=4 499 B11R1.280 COc1cc(CCl)ccc1N Amb27858233 [1,0,0,0,0,0|2,0,1]=4 500 B11R1.280 COc1cc(CCl)ccc1O Amb17477803 [1,0,0,0,0,0|1,0,1]=3 501 B11R1.280 COc1cc(CF)ccc1O Amb27617639 [1,0,0,0,0,0|1,0,1]=3 502 B11R1.280 COc1cc(CN)ccc1Br Amb22500718 [1,0,0,0,0,0|2,0,1]=4 503 B11R1.280 COc1cc(CN)ccc1C Amb10610104 [1,0,0,0,0,0|2,0,1]=4 504 B11R1.280 COc1cc(CN)ccc1C Amb6255452 [1,0,0,0,0,0|2,0,1]=4 505 B11R1.280 COc1cc(CN)ccc1Cl Amb18908883 [1,0,0,0,0,0|2,0,1]=4 506 B11R1.280 COc1cc(CN)ccc1Cl Amb22501133 [1,0,0,0,0,0|2,0,1]=4 507 B11R1.280 COc1cc(CN)ccc1F Amb19884033 [1,0,0,0,0,0|2,0,1]=4 508 B11R1.280 COc1cc(CN)ccc1F Amb22498732 [1,0,0,0,0,0|2,0,1]=4 509 B11R1.280 COc1cc(CN)ccc1I Amb23437523 [1,0,0,0,0,0|2,0,1]=4 510 B11R1.280 COc1cc(CN)ccc1N Amb18201291 [1,0,0,0,0,0|2,0,1]=4 511 B11R1.280 COc1cc(CN)ccc1N Amb33465391 [1,0,0,0,0,0|2,0,1]=4 512 B11R1.280 COc1cc(CN)ccc1O Amb1111183 [1,0,0,0,0,0|1,0,1]=3 513 B11R1.280 COc1cc(CN)ccc1O Amb33513228 [1,0,0,0,0,0|1,0,1]=3 514 B11R1.280 COc1cc(CN)ccc1O Amb33531126 [1,0,0,0,0,0|1,0,1]=3 515 B11R1.280 COc1cc(CN)ncc1O Amb28401495 [1,0,0,0,0,0|2,0,1]=4 516 B11R1.280 COc1cc(CO)ccc1Br Amb10602018 [1,0,0,0,0,0|1,0,2]=4 517 B11R1.280 COc1cc(CO)ccc1C Amb9004303 [1,0,0,0,0,0|1,0,2]=4 518 B11R1.280 COc1cc(CO)ccc1Cl Amb22170282 [1,0,0,0,0,0|1,0,2]=4 519 B11R1.280 COc1cc(CO)ccc1F Amb10605579 [1,0,0,0,0,0|1,0,2]=4 520 B11R1.280 COc1cc(CO)ccc1I Amb23437520 [1,0,0,0,0,0|1,0,2]=4 521 B11R1.280 COc1cc(CO)ccc1N Amb22001532 [1,0,0,0,0,0|1,0,2]=4 522 B11R1.280 COc1cc(CO)ccc1O Amb534863 [1,0,0,0,0,0|0,0,2]=3 523 B11R1.280 COc1cc(CS)ccc1Br Amb24682300 [1,0,0,0,0,0|1,1,1]=4 524 B11R1.280 COc1cc(CS)ccc1C Amb33420864 [1,0,0,0,0,0|1,1,1]=4 525 B11R1.280 COc1cc(CS)ccc1Cl Amb32788120 [1,0,0,0,0,0|1,1,1]=4 526 B11R1.280 COc1cc(CS)ccc1F Amb33312429 [1,0,0,0,0,0|1,1,1]=4 527 B11R1.280 COc1cc(CS)ccc1O Amb25803294 [1,0,0,0,0,0|0,1,1]=3 528 B11R1.280 COc1cc(N=N)ccc1N Amb27632262 [1,0,0,0,0,0|3,0,0]=4 529 B11R1.280 COc1cc(NN)ccc1Br Amb27482694 [1,0,0,0,0,0|3,0,0]=4 530 B11R1.280 COc1cc(NN)ccc1C Amb22011759 [1,0,0,0,0,0|3,0,0]=4 531 B11R1.280 COc1cc(NN)ccc1Cl Amb25339439 [1,0,0,0,0,0|3,0,0]=4 532 B11R1.280 COc1cc(NN)ccc1Cl Amb33446991 [1,0,0,0,0,0|3,0,0]=4 533 B11R1.280 COc1cc(NN)ccc1F Amb22831896 [1,0,0,0,0,0|3,0,0]=4 534 B11R1.280 COc1cc(NN)ccc1F Amb27786188 [1,0,0,0,0,0|3,0,0]=4 535 B11R1.280 COc1cc(NN)ccc1I Amb25265675 [1,0,0,0,0,0|3,0,0]=4 536 B11R1.280 COc1cc(NN)ccc1N Amb27665702 [1,0,0,0,0,0|3,0,0]=4 537 B11R1.280 COc1cc(NN)ccc1O Amb24712582 [1,0,0,0,0,0|2,0,0]=3 538 B11R1.280 COc1cc(NN)ccc1S Amb28434921 [1,0,0,0,0,0|2,1,0]=4 539 B11R1.280 COc1cc(OC)c(O)cn1 Amb27638946 [1,0,0,0,0,0|3,0,0]=4 540 B11R1.280 COc1cc(SC)ccc1F Amb28182540 [1,0,0,0,0,0|3,0,0]=4 541 B11R1.280 COc1cc(SC)ccc1I Amb24368771 [1,0,0,0,0,0|3,0,0]=4 542 B11R1.280 COc1cc(SC)ccc1N Amb20623878 [1,0,0,0,0,0|3,0,0]=4 543 B11R1.280 COc1cc(SC)ccc1N Amb33321473 [1,0,0,0,0,0|3,0,0]=4 544 B11R1.280 COc1cc(SC)ccc1O Amb18126705 [1,0,0,0,0,0|2,0,0]=3 545 B11R1.280 COc1cc([N+]#N)ccc1Br Amb27883636 [1,0,0,0,0,0|3,0,0]=4 546 B11R1.280 COc1cc([N+]#N)ccc1C Amb29859461 [1,0,0,0,0,0|3,0,0]=4 547 B11R1.280 COc1ccc(Br)c(OC)c1 Amb2685124 [1,0,0,0,0,0|3,0,0]=4 548 B11R1.280 COc1ccc(C)c(OC)c1 Amb4037064 [1,0,0,0,0,0|3,0,0]=4 549 B11R1.280 COc1ccc(Cl)c(OC)c1 Amb2685872 [1,0,0,0,0,0|3,0,0]=4 550 B11R1.280 COc1ccc(F)c(OC)c1 Amb2687362 [1,0,0,0,0,0|3,0,0]=4 551 B11R1.280 COc1ccc(I)c(OC)c1 Amb2687371 [1,0,0,0,0,0|3,0,0]=4 552 B11R1.280 COc1ccc(N)c(OC)c1 Amb2725495 [1,0,0,0,0,0|3,0,0]=4 553 B11R1.280 COc1ccc(O)c(CBr)c1 Amb25113636 [1,0,0,0,0,0|3,0,0]=4 554 B11R1.280 COc1ccc(O)c(CCl)c1 Amb26478439 [1,0,0,0,0,0|3,0,0]=4 555 B11R1.280 COc1ccc(O)c(CN)c1 Amb19373988 [1,0,0,0,0,0|3,0,0]=4 556 B11R1.280 COc1ccc(O)c(CN)c1 Amb2697341 [1,0,0,0,0,0|3,0,0]=4 557 B11R1.280 COc1ccc(O)c(CO)c1 Amb8391850 [1,0,0,0,0,0|3,0,0]=4 558 B11R1.280 COc1ccc(O)c(CS)c1 Amb32788401 [1,0,0,0,0,0|3,0,0]=4 559 B11R1.280 COc1ccc(O)c(OC)c1 Amb17199437 [1,0,0,0,0,0|2,0,0]=3 560 B11R1.280 COc1ccc(O)c(OC)n1 Amb2696838 [1,0,0,0,0,0|3,0,0]=4 561 B11R1.280 COc1ccc(S)c(OC)c1 Amb2687435 [1,0,0,0,0,0|2,1,0]=4 562 B11R1.280 COc1ccc([Mg+])c(OC)c1 Amb22489729 [1,0,0,0,0,0|3,0,0]=4 563 B11R1.280 COc1nc(C=O)ccc1Br Amb24724915 [1,0,0,0,0,0|2,0,0]=3 564 B11R1.280 COc1nc(C=O)ccc1C Amb28423438 [1,0,0,0,0,0|2,0,0]=3 565 B11R1.280 COc1nc(C=O)ccc1Cl Amb25104651 [1,0,0,0,0,0|2,0,0]=3 566 B11R1.280 COc1nc(C=O)ccc1F Amb25151176 [1,0,0,0,0,0|2,0,0]=3 567 B11R1.280 COc1nc(C=O)ccc1I Amb27615892 [1,0,0,0,0,0|2,0,0]=3 568 B11R1.280 COc1nc(C=O)ncc1Br Amb33749371 [1,0,0,0,0,0|3,0,0]=4 569 B11R1.280 COc1nc(CN)ccc1O Amb27832857 [1,0,0,0,0,0|2,0,1]=4 570 B11R1.280 CSc1cc(C#N)ccc1O Amb27483107 [1,0,0,0,0,0|1,1,1]=4 571 B11R1.280 CSc1cc(C=O)ccc1C Amb27439060 [1,0,0,0,0,0|1,1,0]=3 572 B11R1.280 CSc1cc(C=O)ccc1F Amb25891721 [1,0,0,0,0,0|1,1,0]=3 573 B11R1.280 CSc1cc(C=O)ccc1O Amb24648702 [1,0,0,0,0,0|0,1,0]=2 574 B11R1.280 CSc1cc(CO)ccc1O Amb27974050 [1,0,0,0,0,0|0,1,2]=4 575 B11R1.280 CSc1cc(N=O)ccc1O Amb28074718 [1,0,0,0,0,0|1,1,0]=3 576 B11R1.280 CSc1ccc(O)c(SC)c1 Amb18129646 [1,0,0,0,0,0|2,1,0]=4 577 B11R1.280 C\C=C1/C=CC(=O)C(OC)=C1 Amb28429538 [1,0,0,0,0,0|1,0,1]=3 578 B11R1.280 Cc1ccc(C=O)cc1C#N Amb16230003 [1,0,0,0,0,0|2,0,1]=4 579 B11R1.280 Cc1ccc(C=O)cc1CCl Amb28197535 [1,0,0,0,0,0|2,0,0]=3 580 B11R1.280 Cc1ccc(C=O)cc1CO Amb28128396 [1,0,0,0,0,0|2,0,0]=3 581 B11R1.280 Cc1ccc(C=O)cc1NN Amb26989903 [1,0,0,0,0,0|3,0,0]=4 582 B11R1.280 Cc1ccc(C=O)nc1CCl Amb28060927 [1,0,0,0,0,0|3,0,0]=4 583 B11R1.280 Cc1cnc(C=O)cc1CCl Amb27443136 [1,0,0,0,0,0|3,0,0]=4 584 B11R1.280 Cc1ncc(C=O)cc1CCl Amb27424083 [1,0,0,0,0,0|3,0,0]=4 585 B11R1.280 N#Cc1cc(C=O)ccc1Br Amb22011727 [1,0,0,0,0,0|2,0,1]=4 586 B11R1.280 N#Cc1cc(C=O)ccc1Cl Amb22170248 [1,0,0,0,0,0|2,0,1]=4 587 B11R1.280 N#Cc1cc(C=O)ccc1F Amb3939299 [1,0,0,0,0,0|2,0,1]=4 588 B11R1.280 N#Cc1cc(C=O)ccc1N Amb21926780 [1,0,0,0,0,0|2,0,1]=4 589 B11R1.280 N#Cc1cc(C=O)ccc1O Amb22396045 [1,0,0,0,0,0|1,0,1]=3 590 B11R1.280 N#Cc1ccc(O)c(CBr)c1 Amb25999555 [1,0,0,0,0,0|2,0,1]=4 591 B11R1.280 N#Cc1ccc(O)c(CCl)c1 Amb25807970 [1,0,0,0,0,0|2,0,1]=4 592 B11R1.280 N#Cc1ccc(O)c(CN)c1 Amb24117594 [1,0,0,0,0,0|2,0,1]=4 593 B11R1.280 NCc1cc(C=O)ccc1O Amb23559308 [1,0,0,0,0,0|1,0,0]=2 594 B11R1.280 NCc1ccc(O)c(CN)c1 Amb23559383 [1,0,0,0,0,0|2,0,1]=4 595 B11R1.280 NCc1ccc(O)c(CN)c1 Amb24117611 [1,0,0,0,0,0|2,0,1]=4 596 B11R1.280 NCc1ccc(O)c(CO)c1 Amb23559300 [1,0,0,0,0,0|2,0,1]=4 597 B11R1.280 NCc1ccc(O)c(CO)c1 Amb24117543 [1,0,0,0,0,0|2,0,1]=4 598 B11R1.280 NNc1cc(C=O)ccc1Br Amb27965688 [1,0,0,0,0,0|3,0,0]=4 599 B11R1.280 NNc1cc(C=O)ccc1Cl Amb26608271 [1,0,0,0,0,0|3,0,0]=4 600 B11R1.280 NNc1cc(C=O)ccc1F Amb28135579 [1,0,0,0,0,0|3,0,0]=4 601 B11R1.280 NNc1cc(C=O)ccc1I Amb27439336 [1,0,0,0,0,0|3,0,0]=4 602 B11R1.280 NNc1cc(C=O)ccc1O Amb25964241 [1,0,0,0,0,0|2,0,0]=3 603 B11R1.280 NNc1cc(C=O)ccc1S Amb26582559 [1,0,0,0,0,0|2,1,0]=4 604 B11R1.280 NNc1ccc(O)c(CBr)c1 Amb26896624 [1,0,0,0,0,0|3,0,0]=4 605 B11R1.280 NNc1ccc(O)c(CCl)c1 Amb26645480 [1,0,0,0,0,0|3,0,0]=4 606 B11R1.280 NNc1ccc(O)c(CO)c1 Amb28135617 [1,0,0,0,0,0|3,0,0]=4 607 B11R1.280 O=Cc1cc(C=O)c(O)cn1 Amb27451309 [1,0,0,0,0,0|2,0,1]=4 608 B11R1.280 O=Cc1cc(N=O)ccc1O Amb27176374 [1,0,0,0,0,0|2,0,1]=4 609 B11R1.280 O=Cc1ccc(Br)c(C=O)c1 Amb22754824 [1,0,0,0,0,0|2,0,1]=4 610 B11R1.280 O=Cc1ccc(Br)c(CCl)c1 Amb27237291 [1,0,0,0,0,0|2,0,0]=3 611 B11R1.280 O=Cc1ccc(Br)c(CO)c1 Amb23437486 [1,0,0,0,0,0|2,0,0]=3 612 B11R1.280 O=Cc1ccc(Cl)c(C=O)c1 Amb27176469 [1,0,0,0,0,0|2,0,1]=4 613 B11R1.280 O=Cc1ccc(Cl)c(CBr)c1 Amb28241466 [1,0,0,0,0,0|2,0,0]=3 614 B11R1.280 O=Cc1ccc(F)c(CBr)c1 Amb22735655 [1,0,0,0,0,0|2,0,0]=3 615 B11R1.280 O=Cc1ccc(I)c(CBr)c1 Amb28284711 [1,0,0,0,0,0|2,0,0]=3 616 B11R1.280 O=Cc1ccc(O)c(C=O)c1 Amb2720284 [1,0,0,0,0,0|1,0,1]=3 617 B11R1.280 O=Cc1ccc(O)c(CCl)c1 Amb2796313 [1,0,0,0,0,0|1,0,0]=2 618 B11R1.280 O=Cc1ccc(O)c(CO)c1 Amb3778843 [1,0,0,0,0,0|1,0,0]=2 619 B11R1.280 O=Cc1cnc(Cl)c(CCl)c1 Amb28436416 [1,0,0,0,0,0|3,0,0]=4 620 B11R1.280 O=Cc1cnc(O)c(C=O)c1 Amb28124823 [1,0,0,0,0,0|2,0,1]=4 621 B11R1.280 OCc1ccc(O)c(CO)c1 Amb18125663 [1,0,0,0,0,0|1,0,2]=4 622 B11R1.280 [C-]#[N+]c1ccc(Br)c(OC)c1 Amb32797423 [1,0,0,0,0,0|3,0,0]=4 623 B11R1.280 [C-]#[N+]c1ccc(C)c(OC)c1 Amb32797378 [1,0,0,0,0,0|3,0,0]=4 624 B11R1.280 [C-]#[N+]c1ccc(Cl)c(OC)c1 Amb32797366 [1,0,0,0,0,0|3,0,0]=4 625 B11R1.280 [C-]#[N+]c1ccc(F)c(OC)c1 Amb32797401 [1,0,0,0,0,0|3,0,0]=4 626 B13R1.97 C=C(C)Cc1cc(C=O)ccc1O Amb27802717 [0,1,0,0,0,0|1,0,1]=3 627 B13R1.97 C=Cc1ccc(C)c(OC(F)F)c1 Amb32750447 [0,1,0,0,0,0|3,0,0]=4 628 B13R1.97 C=Cc1ccc(N)c(OC(C)C)n1 Amb27390028 [0,1,0,0,0,0|3,0,0]=4 629 B13R1.97 C=Cc1ccc(O)c(CN(C)C)c1 Amb32874418 [0,1,0,0,0,0|3,0,0]=4 630 B13R1.97 C=Cc1ccc(O)c(C[C@@H](C)N)c1 Amb27644712 [0,1,0,0,0,0|2,0,0]=3 631 B13R1.97 C=Cc1ccc(O)c(C[C@H](C)N)c1 Amb27779182 [0,1,0,0,0,0|2,0,0]=3 632 B13R1.97 CC(=O)Cc1cc(C=O)ccc1Br Amb25981258 [0,1,0,0,0,0|2,0,1]=4 633 B13R1.97 CC(=O)Cc1cc(C=O)ccc1C Amb27193341 [0,1,0,0,0,0|2,0,1]=4 634 B13R1.97 CC(=O)Cc1cc(C=O)ccc1Cl Amb27877062 [0,1,0,0,0,0|2,0,1]=4 635 B13R1.97 CC(=O)Cc1cc(C=O)ccc1F Amb28135640 [0,1,0,0,0,0|2,0,1]=4 636 B13R1.97 CC(=O)Cc1cc(C=O)ccc1I Amb28284211 [0,1,0,0,0,0|2,0,1]=4 637 B13R1.97 CC(=O)Nc1cc(C=O)ccc1C Amb18127906 [0,1,0,0,0,0|2,0,1]=4 638 B13R1.97 CC(C)Cc1cc(C=O)ccc1F Amb28132053 [0,1,0,0,0,0|2,0,0]=3 639 B13R1.97 CC(C)Oc1cc(C#N)ccc1Cl Amb28243682 [0,1,0,0,0,0|2,0,1]=4 640 B13R1.97 CC(C)Oc1cc(C#N)ccc1N Amb28204177 [0,1,0,0,0,0|2,0,1]=4 641 B13R1.97 CC(C)Oc1cc(C#N)ccc1O Amb27476032 [0,1,0,0,0,0|1,0,1]=3 642 B13R1.97 CC(C)Oc1cc(C=O)ccc1Br Amb25116029 [0,1,0,0,0,0|1,0,0]=2 643 B13R1.97 CC(C)Oc1cc(C=O)ccc1Cl Amb27618173 [0,1,0,0,0,0|1,0,0]=2 644 B13R1.97 CC(C)Oc1cc(C=O)ccc1F Amb22490031 [0,1,0,0,0,0|1,0,0]=2 645 B13R1.97 CC(C)Oc1cc(C=O)ccc1O Amb24555038 [0,1,0,0,0,0|0,0,0]=1 646 B13R1.97 CC(C)Oc1cc(C=O)cnc1F Amb27156921 [0,1,0,0,0,0|2,0,0]=3 647 B13R1.97 CC(C)Oc1cc(CO)ccc1Cl Amb24710670 [0,1,0,0,0,0|1,0,2]=4 648 B13R1.97 CC(C)Oc1cc(CO)ccc1F Amb33068438 [0,1,0,0,0,0|1,0,2]=4 649 B13R1.97 CC(N)Cc1cc(CCl)ccc1O Amb26519903 [0,1,0,0,0,0|2,0,1]=4 650 B13R1.97 CC(N)Cc1cc(CN)ccc1O Amb27423841 [0,1,0,0,0,0|2,0,1]=4 651 B13R1.97 CCc1ccc(Br)c(OC(C)C)c1 Amb27638195 [0,1,0,0,0,0|2,0,1]=4 652 B13R1.97 CCc1ccc(I)c(OC(C)C)c1 Amb27451429 [0,1,0,0,0,0|2,0,1]=4 653 B13R1.97 CCc1ccc(N)c(OC(C)C)c1 Amb27179547 [0,1,0,0,0,0|2,0,1]=4 654 B13R1.97 CCc1ccc(O)c(C[C@@H](C)N)c1 Amb27167629 [0,1,0,0,0,0|2,0,1]=4 655 B13R1.97 CCc1ccc(O)c(C[C@H](C)N)c1 Amb28134673 [0,1,0,0,0,0|2,0,1]=4 656 B13R1.97 CN(C)Cc1cc(C=O)ccc1O Amb24117544 [0,1,0,0,0,0|2,0,0]=3 657 B13R1.97 CN(C)Cc1cc(C=O)ccc1O Amb2721922 [0,1,0,0,0,0|2,0,0]=3 658 B13R1.97 CN(C)Cc1cc(C=O)ccc1O Amb32645896 [0,1,0,0,0,0|2,0,0]=3 659 B13R1.97 CNc1ccc(O)c(OC(C)C)c1 Amb27831876 [0,1,0,0,0,0|2,0,0]=3 660 B13R1.97 COc1ccc(Br)c(OC(C)C)c1 Amb27651318 [0,1,0,0,0,0|3,0,0]=4 661 B13R1.97 COc1ccc(N)c(OC(C)C)c1 Amb27626393 [0,1,0,0,0,0|3,0,0]=4 662 B13R1.97 COc1ccc(O)c(CC(C)Br)c1 Amb33006865 [0,1,0,0,0,0|3,0,0]=4 663 B13R1.97 COc1ccc(O)c(CC(C)N)c1 Amb4079432 [0,1,0,0,0,0|3,0,0]=4 664 B13R1.97 COc1ccc(O)c(CC(C)O)c1 Amb32876015 [0,1,0,0,0,0|3,0,0]=4 665 B13R1.97 COc1ccc(O)c(C[C@@H](C)N)c1 Amb25067476 [0,1,0,0,0,0|3,0,0]=4 666 B13R1.97 COc1ccc(O)c(C[C@@H](C)O)c1 Amb32875635 [0,1,0,0,0,0|3,0,0]=4 667 B13R1.97 COc1ccc(O)c(C[C@H](C)N)c1 Amb25111458 [0,1,0,0,0,0|3,0,0]=4 668 B13R1.97 COc1ccc(O)c(C[C@H](C)O)c1 Amb32875636 [0,1,0,0,0,0|3,0,0]=4 669 B13R1.97 COc1ccc(O)c(OC(C)C)c1 Amb18129027 [0,1,0,0,0,0|2,0,0]=3 670 B13R1.97 COc1ccc(O)c(OC(F)F)c1 Amb28128635 [0,1,0,0,0,0|3,0,0]=4 671 B13R1.97 CSc1ccc(N)c(OC(C)C)c1 Amb27772482 [0,1,0,0,0,0|3,0,0]=4 672 B13R1.97 CSc1ccc(O)c(C[C@H](C)N)c1 Amb27772422 [0,1,0,0,0,0|3,0,0]=4 673 B13R1.97 C[C@H](N)Cc1cc(C#N)ccc1O Amb28134029 [0,1,0,0,0,0|2,0,1]=4 674 B13R1.97 Cc1ccc(C=O)cc1OC(C)C Amb27828893 [0,1,0,0,0,0|1,0,0]=2 675 B13R1.97 Cc1ccc(C=O)cc1OC(F)F Amb33295392 [0,1,0,0,0,0|2,0,0]=3 676 B13R1.97 N#Cc1ccc(O)c(OC(F)F)c1 Amb26844988 [0,1,0,0,0,0|2,0,1]=4 677 B13R1.97 NNc1ccc(O)c(OC(F)F)c1 Amb26557176 [0,1,0,0,0,0|3,0,0]=4 678 B13R1.97 O=Cc1cc(OC(F)F)c(Cl)cn1 Amb25269841 [0,1,0,0,0,0|3,0,0]=4 679 B13R1.97 O=Cc1cc(OC(F)F)c(F)cn1 Amb27634084 [0,1,0,0,0,0|3,0,0]=4 680 B13R1.97 O=Cc1ccc(F)c(OC(F)F)c1 Amb22896538 [0,1,0,0,0,0|2,0,0]=3 681 B13R1.97 O=Cc1ccc(O)c(OC(F)F)c1 Amb4322886 [0,1,0,0,0,0|1,0,0]=2 682 B13R1.97 O=Cc1cnc(Cl)c(OC(F)F)c1 Amb25991995 [0,1,0,0,0,0|3,0,0]=4 683 B13R1.97 O=Cc1cnc(F)c(OC(F)F)c1 Amb27847126 [0,1,0,0,0,0|3,0,0]=4 684 B13R1.354 C=CCc1cc(C(=O)O)ccc1O Amb17157376 [0,1,0,0,0,0|1,0,2]=4 685 B13R1.354 C=CCc1cc(C(C)=O)ccc1O Amb2612085 [0,1,0,0,0,0|1,0,2]=4 686 B13R1.354 CC(=O)c1ccc(O)c(CCCl)c1 Amb19149243 [0,1,0,0,0,0|2,0,0]=3 687 B13R1.354 CC(=O)c1ccc(O)c(CCO)c1 Amb6892146 [0,1,0,0,0,0|2,0,0]=3 688 B13R1.354 CCCN1C=C(C(=O)Cl)C=CC1=O Amb24379444 [0,1,0,0,0,0|2,0,1]=4 689 B13R1.354 CCCN1C=C(C(=O)O)C=CC1=O Amb18984957 [0,1,0,0,0,0|2,0,1]=4 690 B13R1.354 CCCN1C=C(C(N)=O)C=CC1=O Amb24400533 [0,1,0,0,0,0|2,0,1]=4 691 B13R1.354 CCCc1cc(B(O)O)ccc1O Amb28312832 [0,1,0,0,0,0|2,0,1]=4 692 B13R1.354 CCCc1cc(C(=O)O)ccc1Cl Amb25129061 [0,1,0,0,0,0|2,0,0]=3 693 B13R1.354 CCCc1cc(C(=O)O)ccc1F Amb19958807 [0,1,0,0,0,0|2,0,0]=3 694 B13R1.354 CCCc1cc(C(=O)O)ccc1O Amb16229669 [0,1,0,0,0,0|1,0,0]=2 695 B13R1.354 CCCc1cc(C(C)=O)ccc1C Amb28246583 [0,1,0,0,0,0|2,0,0]=3 696 B13R1.354 CCCc1cc([N+](=O)[O-])ccc1F Amb32696494 [0,1,0,0,0,0|3,0,0]=4 697 B13R1.354 CCCc1cc([N+](=O)[O-])ccc1N Amb22522471 [0,1,0,0,0,0|3,0,0]=4 698 B13R1.354 CCNc1cc(C(=O)O)ccc1Cl Amb18270551 [0,1,0,0,0,0|2,0,0]=3 699 B13R1.354 CCNc1cc(C(=O)O)ccc1N Amb25854288 [0,1,0,0,0,0|2,0,0]=3 700 B13R1.354 CCNc1cc(C(C)=O)ccc1Cl Amb18930547 [0,1,0,0,0,0|2,0,0]=3 701 B13R1.354 CCNc1cc(C(C)=O)ccc1F Amb18267249 [0,1,0,0,0,0|2,0,0]=3 702 B13R1.354 CCNc1cc(C(N)=O)ccc1C Amb27188680 [0,1,0,0,0,0|2,0,0]=3 703 B13R1.354 CCNc1cc(C(N)=O)ccc1N Amb28242073 [0,1,0,0,0,0|2,0,0]=3 704 B13R1.354 CCNc1cc(C(N)=O)ncc1C Amb27598336 [0,1,0,0,0,0|3,0,0]=4 705 B13R1.354 CCNc1cc([N+](=O)[O-])ccc1Br Amb17306892 [0,1,0,0,0,0|3,0,0]=4 706 B13R1.354 CCNc1cc([N+](=O)[O-])ccc1C Amb4017980 [0,1,0,0,0,0|3,0,0]=4 707 B13R1.354 CCNc1nc(C(=O)O)ccc1N Amb27392735 [0,1,0,0,0,0|3,0,0]=4 708 B13R1.354 CCOc1cc(B(O)O)ccc1C Amb22490147 [0,1,0,0,0,0|2,0,1]=4 709 B13R1.354 CCOc1cc(B(O)O)ccc1Cl Amb9766268 [0,1,0,0,0,0|2,0,1]=4 710 B13R1.354 CCOc1cc(B(O)O)ccc1F Amb10841318 [0,1,0,0,0,0|2,0,1]=4 711 B13R1.354 CCOc1cc(B(O)O)ccc1N Amb27259322 [0,1,0,0,0,0|2,0,1]=4 712 B13R1.354 CCOc1cc(B(O)O)ccc1O Amb27657123 [0,1,0,0,0,0|1,0,1]=3 713 B13R1.354 CCOc1cc(C(=N)N)ccc1O Amb8831699 [0,1,0,0,0,0|1,0,0]=2 714 B13R1.354 CCOc1cc(C(=O)Cl)ccc1F Amb25870362 [0,1,0,0,0,0|1,0,0]=2 715 B13R1.354 CCOc1cc(C(=O)O)ccc1Br Amb26047800 [0,1,0,0,0,0|1,0,0]=2 716 B13R1.354 CCOc1cc(C(=O)O)ccc1C Amb17483556 [0,1,0,0,0,0|1,0,0]=2 717 B13R1.354 CCOc1cc(C(=O)O)ccc1Cl Amb22001079 [0,1,0,0,0,0|1,0,0]=2 718 B13R1.354 CCOc1cc(C(=O)O)ccc1F Amb26339329 [0,1,0,0,0,0|1,0,0]=2 719 B13R1.354 CCOc1cc(C(=O)O)ccc1I Amb28344479 [0,1,0,0,0,0|1,0,0]=2 720 B13R1.354 CCOc1cc(C(=O)O)ccc1N Amb8963108 [0,1,0,0,0,0|1,0,0]=2 721 B13R1.354 CCOc1cc(C(=O)O)ccc1O Amb2697877 [0,1,0,0,0,0|0,0,0]=1 722 B13R1.354 CCOc1cc(C(=O)O)ccc1S Amb27618508 [0,1,0,0,0,0|0,1,0]=2 723 B13R1.354 CCOc1cc(C(=O)O)cnc1Cl Amb28255789 [0,1,0,0,0,0|2,0,0]=3 724 B13R1.354 CCOc1cc(C(=O)O)ncc1Br Amb32418351 [0,1,0,0,0,0|2,0,0]=3 725 B13R1.354 CCOc1cc(C(C)=O)ccc1Br Amb24078638 [0,1,0,0,0,0|1,0,0]=2 726 B13R1.354 CCOc1cc(C(C)=O)ccc1C Amb27471837 [0,1,0,0,0,0|1,0,0]=2 727 B13R1.354 CCOc1cc(C(C)=O)ccc1Cl Amb27618174 [0,1,0,0,0,0|1,0,0]=2 728 B13R1.354 CCOc1cc(C(C)=O)ccc1F Amb28385515 [0,1,0,0,0,0|1,0,0]=2 729 B13R1.354 CCOc1cc(C(C)=O)ccc1I Amb25079538 [0,1,0,0,0,0|1,0,0]=2 730 B13R1.354 CCOc1cc(C(C)=O)ccc1O Amb18128637 [0,1,0,0,0,0|0,0,0]=1 731 B13R1.354 CCOc1cc(C(C)=O)cnc1C Amb28320989 [0,1,0,0,0,0|2,0,0]=3 732 B13R1.354 CCOc1cc(C(C)N)ccc1O Amb27233737 [0,1,0,0,0,0|1,0,1]=3 733 B13R1.354 CCOc1cc(C(C)O)ccc1F Amb25726972 [0,1,0,0,0,0|1,0,2]=4 734 B13R1.354 CCOc1cc(C(C)O)ccc1I Amb28455360 [0,1,0,0,0,0|1,0,2]=4 735 B13R1.354 CCOc1cc(C(C)O)ccc1O Amb28252871 [0,1,0,0,0,0|0,0,2]=3 736 B13R1.354 CCOc1cc(C(N)=O)ccc1Br Amb27150261 [0,1,0,0,0,0|1,0,0]=2 737 B13R1.354 CCOc1cc(C(N)=O)ccc1Cl Amb27245451 [0,1,0,0,0,0|1,0,0]=2 738 B13R1.354 CCOc1cc(C(N)=O)ccc1I Amb28047580 [0,1,0,0,0,0|1,0,0]=2 739 B13R1.354 CCOc1cc(C(N)=O)ccc1N Amb22584105 [0,1,0,0,0,0|1,0,0]=2 740 B13R1.354 CCOc1cc(C(N)=S)ccc1O Amb8834037 [0,1,0,0,0,0|0,1,0]=2 741 B13R1.354 CCOc1cc(N(=O)=O)ccc1N Amb22396479 [0,1,0,0,0,0|2,0,0]=3 742 B13R1.354 CCOc1cc([C@@H](C)N)ccc1C Amb27640687 [0,1,0,0,0,0|2,0,1]=4 743 B13R1.354 CCOc1cc([C@@H](C)N)ccc1O Amb27592403 [0,1,0,0,0,0|1,0,1]=3 744 B13R1.354 CCOc1cc([C@@H](C)O)ccc1O Amb25342215 [0,1,0,0,0,0|0,0,2]=3 745 B13R1.354 CCOc1cc([C@H](C)N)ccc1O Amb24655943 [0,1,0,0,0,0|1,0,1]=3 746 B13R1.354 CCOc1cc([C@H](C)O)ccc1O Amb25669197 [0,1,0,0,0,0|0,0,2]=3 747 B13R1.354 CCOc1cc([N+](=O)[O-])ccc1Br Amb10808051 [0,1,0,0,0,0|2,0,0]=3 748 B13R1.354 CCOc1cc([N+](=O)[O-])ccc1C Amb26358756 [0,1,0,0,0,0|2,0,0]=3 749 B13R1.354 CCOc1cc([N+](=O)[O-])ccc1Cl Amb21856263 [0,1,0,0,0,0|2,0,0]=3 750 B13R1.354 CCOc1cc([N+](=O)[O-])ccc1F Amb21963797 [0,1,0,0,0,0|2,0,0]=3 751 B13R1.354 CCOc1cc([N+](=O)[O-])ccc1S Amb28203575 [0,1,0,0,0,0|1,1,0]=3 752 B13R1.354 CCOc1cc([N+](=O)[O-])cnc1Br Amb24637071 [0,1,0,0,0,0|3,0,0]=4 753 B13R1.354 CCOc1cc([N+](=O)[O-])cnc1Cl Amb23437246 [0,1,0,0,0,0|3,0,0]=4 754 B13R1.354 CCOc1cc([N+](=O)[O-])cnc1O Amb27648943 [0,1,0,0,0,0|2,0,0]=3 755 B13R1.354 CCOc1cc([N+](=O)[O-])ncc1Br Amb24696689 [0,1,0,0,0,0|3,0,0]=4 756 B13R1.354 CCOc1nc(C(N)=O)ccc1N Amb25300196 [0,1,0,0,0,0|2,0,0]=3 757 B13R1.354 CCOc1nc([N+](=O)[O-])ccc1Br Amb25771959 [0,1,0,0,0,0|3,0,0]=4 758 B13R1.354 CCSc1cc(C(=O)O)ccc1Br Amb25786331 [0,1,0,0,0,0|1,1,0]=3 759 B13R1.354 CCSc1cc(C(=O)O)ccc1C Amb18638225 [0,1,0,0,0,0|1,1,0]=3 760 B13R1.354 CCSc1cc(C(=O)O)ccc1Cl Amb26471155 [0,1,0,0,0,0|1,1,0]=3 761 B13R1.354 CCSc1cc(C(=O)O)ccc1F Amb26454627 [0,1,0,0,0,0|1,1,0]=3 762 B13R1.354 CCSc1cc(C(=O)O)ccc1I Amb26345654 [0,1,0,0,0,0|1,1,0]=3 763 B13R1.354 CCSc1cc(C(=O)O)ccc1N Amb27946858 [0,1,0,0,0,0|1,1,0]=3 764 B13R1.354 CCSc1cc(C(=O)O)ccc1O Amb28241209 [0,1,0,0,0,0|0,1,0]=2 765 B13R1.354 CCSc1cc([N+](=O)[O-])ccc1Br Amb26509755 [0,1,0,0,0,0|2,1,0]=4 766 B13R1.354 CCSc1cc([N+](=O)[O-])ccc1C Amb25126848 [0,1,0,0,0,0|2,1,0]=4 767 B13R1.354 CCSc1cc([N+](=O)[O-])ccc1F Amb28118673 [0,1,0,0,0,0|2,1,0]=4 768 B13R1.354 CCSc1cc([N+](=O)[O-])ccc1I Amb28136706 [0,1,0,0,0,0|2,1,0]=4 769 B13R1.354 CCSc1cc([N+](=O)[O-])ccc1O Amb28348425 [0,1,0,0,0,0|1,1,0]=3 770 B13R1.354 CNCc1cc([N+](=O)[O-])ccc1O Amb18294775 [0,1,0,0,0,0|3,0,0]=4 771 B13R1.354 COCc1cc(C(=O)O)ccc1F Amb18303063 [0,1,0,0,0,0|3,0,0]=4 772 B13R1.354 COCc1cc(C(C)=O)ccc1O Amb1104394 [0,1,0,0,0,0|2,0,0]=3 773 B13R1.354 COCc1cc(C(N)=O)ccc1F Amb27598261 [0,1,0,0,0,0|3,0,0]=4 774 B13R1.354 COCc1cc([N+](=O)[O-])ccc1O Amb28347827 [0,1,0,0,0,0|3,0,0]=4 775 B13R1.354 CSCc1cc(C(=O)O)ccc1F Amb19002588 [0,1,0,0,0,0|3,0,0]=4 776 B13R1.354 CSCc1cc(C(C)=O)ccc1O Amb2728546 [0,1,0,0,0,0|2,0,0]=3 777 B13R1.354 CSCc1cc(C(N)=O)ccc1F Amb27854448 [0,1,0,0,0,0|3,0,0]=4 778 B13R1.354 CSSc1cc(C(=O)O)ccc1F Amb28289203 [0,1,0,0,0,0|2,1,0]=4 779 B13R1.354 C\C=C\c1cc(C(=O)O)ccc1O Amb547735 [0,1,0,0,0,0|1,0,1]=3 780 B13R1.354 Cc1ccc(C(=O)O)cc1CCN Amb17201640 [0,1,0,0,0,0|3,0,0]=4 781 B13R1.354 Cc1ccc([N+](=O)[O-])cc1OCCl Amb24678722 [0,1,0,0,0,0|3,0,0]=4 782 B13R1.354 N#CNc1cc(C(=O)O)ccc1O Amb29870396 [0,1,0,0,0,0|2,0,1]=4 783 B13R1.354 NCCc1cc(C(=O)O)ccc1Cl Amb27961258 [0,1,0,0,0,0|3,0,0]=4 784 B13R1.354 NCCc1cc(C(=O)O)ccc1O Amb26519911 [0,1,0,0,0,0|2,0,0]=3 785 B13R1.354 NCCc1cc([N+](=O)[O-])ccc1O Amb33079722 [0,1,0,0,0,0|3,0,0]=4 786 B13R1.354 O=C(O)c1ccc(O)c(\C=C\Br)c1 Amb33135180 [0,1,0,0,0,0|2,0,1]=4 787 B13R1.354 O=CNc1cc(C(=O)O)ccc1O Amb22047561 [0,1,0,0,0,0|2,0,1]=4 788 B13R1.354 O=[N+]([O-])c1ccc(Br)c(OCCl)c1 Amb27610304 [0,1,0,0,0,0|3,0,0]=4 789 B13R1.354 O=[N+]([O-])c1ccc(Cl)c(OCCl)c1 Amb25054392 [0,1,0,0,0,0|3,0,0]=4 790 B13R1.354 O=[N+]([O-])c1ccc(O)c(CCBr)c1 Amb33477217 [0,1,0,0,0,0|3,0,0]=4 791 B13R1.354 O=[N+]([O-])c1ccc(O)c(CCO)c1 Amb33448462 [0,1,0,0,0,0|3,0,0]=4 792 B13R1.354 O=[N+]([O-])c1ccc(O)c(CCS)c1 Amb33379376 [0,1,0,0,0,0|3,0,0]=4 793 B13R1.354 [N-]=[N+]=Nc1cc(C(=O)O)ccc1O Amb23454576 [0,1,0,0,0,0|3,0,0]=4 794 B13R1.355 C#Cc1ccc(OC)c(OCC)c1 Amb10071053 [0,1,0,0,0,0|1,0,1]=3 795 B13R1.355 C=CCc1cc(C=O)ccc1OC Amb838522 [0,1,0,0,0,0|1,0,2]=4 796 B13R1.355 C=Cc1ccc(OC)c(OCC)c1 Amb33449892 [0,1,0,0,0,0|1,0,0]=2 797 B13R1.355 CCCc1cc(CBr)ccc1OC Amb32709904 [0,1,0,0,0,0|2,0,1]=4 798 B13R1.355 CCCc1cc(CCl)ccc1OC Amb32709926 [0,1,0,0,0,0|2,0,1]=4 799 B13R1.355 CCCc1cc(CN)ccc1OC Amb32709961 [0,1,0,0,0,0|2,0,1]=4 800 B13R1.355 CCNc1cc(CC)ccc1OC Amb18057582 [0,1,0,0,0,0|2,0,1]=4 801 B13R1.355 CCNc1cc(OC)ccc1OC Amb4313310 [0,1,0,0,0,0|3,0,0]=4 802 B13R1.355 CCOc1cc(C#N)ccc1NN Amb25921961 [0,1,0,0,0,0|2,0,1]=4 803 B13R1.355 CCOc1cc(C#N)ccc1OC Amb5761942 [0,1,0,0,0,0|1,0,1]=3 804 B13R1.355 CCOc1cc(C=O)ccc1OC Amb6387844 [0,1,0,0,0,0|0,0,0]=1 805 B13R1.355 CCOc1cc(CBr)ccc1NN Amb27200470 [0,1,0,0,0,0|2,0,1]=4 806 B13R1.355 CCOc1cc(CBr)ccc1OC Amb8835649 [0,1,0,0,0,0|1,0,1]=3 807 B13R1.355 CCOc1cc(CC)ccc1NN Amb25249928 [0,1,0,0,0,0|2,0,1]=4 808 B13R1.355 CCOc1cc(CCl)ccc1NN Amb28134373 [0,1,0,0,0,0|2,0,1]=4 809 B13R1.355 CCOc1cc(CCl)ccc1OC Amb6617055 [0,1,0,0,0,0|1,0,1]=3 810 B13R1.355 CCOc1cc(CN)ccc1OC Amb33528218 [0,1,0,0,0,0|1,0,1]=3 811 B13R1.355 CCOc1cc(CO)ccc1OC Amb2796493 [0,1,0,0,0,0|0,0,2]=3 812 B13R1.355 CCOc1cc(CS)ccc1OC Amb32788835 [0,1,0,0,0,0|0,1,1]=3 813 B13R1.355 CCOc1cc(NC)ccc1OC Amb19037545 [0,1,0,0,0,0|2,0,0]=3 814 B13R1.355 CCOc1cc(NN)ccc1C#N Amb28436332 [0,1,0,0,0,0|3,0,0]=4 815 B13R1.355 CCOc1cc(NN)ccc1C=O Amb28323414 [0,1,0,0,0,0|2,0,1]=4 816 B13R1.355 CCOc1cc(NN)ccc1CC Amb25223382 [0,1,0,0,0,0|3,0,0]=4 817 B13R1.355 CCOc1cc(NN)ccc1CCl Amb26988935 [0,1,0,0,0,0|3,0,0]=4 818 B13R1.355 CCOc1cc(NN)ccc1OC Amb24695686 [0,1,0,0,0,0|2,0,0]=3 819 B13R1.355 CCOc1cc(NN)ccc1SC Amb27625290 [0,1,0,0,0,0|2,1,0]=4 820 B13R1.355 CCOc1cc(OC)ccc1C#N Amb5768656 [0,1,0,0,0,0|3,0,0]=4 821 B13R1.355 CCOc1cc(OC)ccc1C=O Amb3939527 [0,1,0,0,0,0|2,0,1]=4 822 B13R1.355 CCOc1cc(OC)ccc1CN Amb5774916 [0,1,0,0,0,0|3,0,0]=4 823 B13R1.355 CCOc1cc(OC)ccc1CO Amb18179268 [0,1,0,0,0,0|2,0,0]=3 824 B13R1.355 CCOc1cc(OC)ccc1NN Amb27642605 [0,1,0,0,0,0|3,0,0]=4 825 B13R1.355 CCOc1cc(SC)ccc1NN Amb27647100 [0,1,0,0,0,0|3,0,0]=4 826 B13R1.355 CCSc1cc(C#N)ccc1OC Amb26519968 [0,1,0,0,0,0|1,1,1]=4 827 B13R1.355 COCc1cc(C=O)ccc1OC Amb6334838 [0,1,0,0,0,0|2,0,0]=3 828 B13R1.355 COc1ccc(C=O)cc1CC#N Amb23559296 [0,1,0,0,0,0|2,0,1]=4 829 B13R1.355 COc1ccc(C=O)cc1CSC Amb18330696 [0,1,0,0,0,0|2,0,0]=3 830 B13R1.355 [C-]#[N+]c1ccc(OC)c(OCC)c1 Amb33315602 [0,1,0,0,0,0|2,0,0]=3 831 B13R1.384 C#CCc1ccc(O)c(OCC)c1 Amb33376110 [0,1,0,0,0,0|1,0,1]=3 832 B13R1.384 CCNc1ccc(C)c(OCC)c1 Amb35689734 [0,1,0,0,0,0|2,0,1]=4 833 B13R1.384 CCNc1ccc(N)c(OCC)c1 Amb27227458 [0,1,0,0,0,0|2,0,1]=4 834 B13R1.384 CCOc1cc(CC#N)ccc1Cl Amb28319357 [0,1,0,0,0,0|2,0,1]=4 835 B13R1.384 CCOc1cc(CC#N)ccc1O Amb2687727 [0,1,0,0,0,0|1,0,1]=3 836 B13R1.384 CCOc1cc(CC=O)ccc1O Amb18116045 [0,1,0,0,0,0|0,0,0]=1 837 B13R1.384 CCOc1cc(CCBr)ccc1O Amb33386434 [0,1,0,0,0,0|1,0,1]=3 838 B13R1.384 CCOc1cc(CCN)ccc1O Amb2697314 [0,1,0,0,0,0|1,0,1]=3 839 B13R1.384 CCOc1cc(CCN)ccc1O Amb6296540 [0,1,0,0,0,0|1,0,1]=3 840 B13R1.384 CCOc1cc(CCO)ccc1O Amb32653015 [0,1,0,0,0,0|0,0,2]=3 841 B13R1.384 CCOc1cc(CCS)ccc1O Amb33375774 [0,1,0,0,0,0|0,1,1]=3 842 B13R1.384 CCOc1cc(CNC)ccc1O Amb1118976 [0,1,0,0,0,0|1,0,1]=3 843 B13R1.384 CCOc1cc(CNN)ccc1O Amb33376392 [0,1,0,0,0,0|1,0,1]=3 844 B13R1.384 CCOc1cc(CNO)ccc1O Amb33474981 [0,1,0,0,0,0|0,0,2]=3 845 B13R1.384 CCOc1cc(CON)ccc1O Amb33376391 [0,1,0,0,0,0|0,0,2]=3 846 B13R1.384 CCOc1cc(N=C=O)ccc1C Amb35690462 [0,1,0,0,0,0|1,0,1]=3 847 B13R1.384 CCOc1cc(N=C=S)ccc1C Amb35690463 [0,1,0,0,0,0|1,1,1]=4 848 B13R1.384 CCOc1cc(NC#N)ccc1C Amb35698143 [0,1,0,0,0,0|2,0,1]=4 849 B13R1.384 CCOc1cc(NC=O)ccc1C Amb35690505 [0,1,0,0,0,0|1,0,0]=2 850 B13R1.384 CCOc1cc(\C=C\Br)ccc1O Amb33134808 [0,1,0,0,0,0|1,0,0]=2 851 B13R1.384 CCOc1cc(\C=N\N)ccc1O Amb27769631 [0,1,0,0,0,0|1,0,0]=2 852 B13R1.384 CCOc1cc(\C=N\O)ccc1O Amb1771018 [0,1,0,0,0,0|0,0,1]=2 853 B13R1.384 CCOc1ccc(C)c(OCC)c1 Amb22348096 [0,1,0,0,0,0|2,0,1]=4 854 B13R1.384 CCOc1ccc(N)c(OCC)c1 Amb17199344 [0,1,0,0,0,0|2,0,1]=4 855 B13R1.384 CCOc1ccc(N)c(OCC)c1 Amb33329026 [0,1,0,0,0,0|2,0,1]=4 856 B13R1.384 C\C=C\c1ccc(O)c(OCC)c1 Amb17594548 [0,1,0,0,0,0|1,0,0]=2 857 B13R1.558 C#CCOc1cc(C=O)ccc1O Amb27794845 [0,1,0,0,0,0|0,0,1]=2 858 B13R1.558 C=CCOc1cc(C=O)ccc1O Amb18128067 [0,1,0,0,0,0|0,0,1]=2 859 B13R1.558 C=CCOc1cc(CO)ccc1O Amb24101153 [0,1,0,0,0,0|0,0,3]=4 860 B13R1.558 CCCOc1cc(C#N)ccc1N Amb27157655 [0,1,0,0,0,0|2,0,1]=4 861 B13R1.558 CCCOc1cc(C=O)ccc1O Amb32410152 [0,1,0,0,0,0|0,0,0]=1 862 B13R1.558 CCCOc1cc(OC)ccc1N Amb33035748 [0,1,0,0,0,0|3,0,0]=4 863 B13R1.558 CCNCc1cc(CN)ccc1O Amb33038830 [0,1,0,0,0,0|2,0,1]=4 864 B13R1.558 CCOCc1cc(C#N)ccc1Br Amb28348712 [0,1,0,0,0,0|2,0,1]=4 865 B13R1.558 CCOCc1cc(C=O)ccc1Br Amb8388136 [0,1,0,0,0,0|1,0,0]=2 866 B13R1.558 CCOCc1cc(OC)ccc1N Amb32659327 [0,1,0,0,0,0|3,0,0]=4 867 B13R1.558 CNCCc1cc(OC)ccc1O Amb32876028 [0,1,0,0,0,0|3,0,0]=4 868 B13R1.558 CO\C=C\c1cc(C=O)ccc1F Amb27641917 [0,1,0,0,0,0|2,0,1]=4 869 B13R1.558 COc1ccc(Br)c(OCCN)c1 Amb33242475 [0,1,0,0,0,0|3,0,0]=4 870 B13R1.558 COc1ccc(N)c(OCCF)c1 Amb32939653 [0,1,0,0,0,0|3,0,0]=4 871 B13R1.558 COc1ccc(N)c(OCCO)c1 Amb33035320 [0,1,0,0,0,0|3,0,0]=4 872 B13R1.558 COc1ccc(O)c(CCCBr)c1 Amb33451158 [0,1,0,0,0,0|3,0,0]=4 873 B13R1.558 COc1ccc(O)c(CCCN)c1 Amb18056049 [0,1,0,0,0,0|3,0,0]=4 874 B13R1.558 COc1ccc(O)c(CCCO)c1 Amb22750279 [0,1,0,0,0,0|3,0,0]=4 875 B13R1.558 COc1ccc(O)c(CCCS)c1 Amb32874795 [0,1,0,0,0,0|3,0,0]=4 876 B13R1.558 COc1ccc(O)c(OCCN)c1 Amb32874802 [0,1,0,0,0,0|2,0,0]=3 877 B13R1.558 Cc1ccc(C#N)cc1OCCO Amb28340825 [0,1,0,0,0,0|2,0,1]=4 878 B13R1.558 N#CCCc1cc(C=O)ccc1S Amb27230864 [0,1,0,0,0,0|1,1,1]=4 879 B13R1.558 N#Cc1ccc(Br)c(OCCN)c1 Amb33006773 [0,1,0,0,0,0|2,0,1]=4 880 B13R1.558 N#Cc1ccc(F)c(OCCO)c1 Amb28455284 [0,1,0,0,0,0|2,0,1]=4 881 B13R1.558 N#Cc1ccc(N)c(OCCO)c1 Amb25819992 [0,1,0,0,0,0|2,0,1]=4 882 B13R1.558 Nc1ccc(C=O)cc1OCCF Amb32939647 [0,1,0,0,0,0|1,0,0]=2 883 B13R1.558 O=Cc1ccc(O)c(OCCF)c1 Amb32410155 [0,1,0,0,0,0|0,0,0]=1 884 B13R1.2431 C=Cc1ccc(O)c(C(=O)OC)c1 Amb25723216 [0,1,0,0,0,0|3,0,0]=4 885 B13R1.2431 C=Cc1ccc(O)c(C(N)CN)c1 Amb28121864 [0,1,0,0,0,0|3,0,0]=4 886 B13R1.2431 C=Cc1ccc(O)c([C@H](N)CN)c1 Amb27596227 [0,1,0,0,0,0|3,0,0]=4 887 B13R1.2431 CCC(=O)c1cc(C=O)ccc1Br Amb25208576 [0,1,0,0,0,0|2,0,0]=3 888 B13R1.2431 CCC(=O)c1cc(C=O)ccc1C Amb26075839 [0,1,0,0,0,0|2,0,0]=3 889 B13R1.2431 CCC(=O)c1cc(C=O)ccc1Cl Amb27844641 [0,1,0,0,0,0|2,0,0]=3 890 B13R1.2431 CCC(=O)c1cc(C=O)ccc1O Amb27259786 [0,1,0,0,0,0|1,0,0]=2 891 B13R1.2431 CCC(=O)c1cc(C=O)ccc1S Amb27441461 [0,1,0,0,0,0|1,1,0]=3 892 B13R1.2431 CCC(=O)c1cc(CC)ccc1O Amb17233426 [0,1,0,0,0,0|2,0,1]=4 893 B13R1.2431 CCC(=O)c1cc(CO)ccc1O Amb27438304 [0,1,0,0,0,0|1,0,2]=4 894 B13R1.2431 CCC(=O)c1cc(OC)ccc1O Amb8427151 [0,1,0,0,0,0|3,0,0]=4 895 B13R1.2431 CCC(C)c1cc(C=O)ccc1O Amb26506691 [0,1,0,0,0,0|1,0,0]=2 896 B13R1.2431 CCC(C)c1cc(CO)ccc1O Amb27164618 [0,1,0,0,0,0|1,0,2]=4 897 B13R1.2431 CCC(C)c1cc(OC)ccc1O Amb28202120 [0,1,0,0,0,0|3,0,0]=4 898 B13R1.2431 CCC(N)c1cc(CO)ccc1O Amb27831463 [0,1,0,0,0,0|1,0,2]=4 899 B13R1.2431 CC[C@@H](N)c1cc(CN)ccc1O Amb28067668 [0,1,0,0,0,0|2,0,1]=4 900 B13R1.2431 CC[C@@H](N)c1cc(CO)ccc1O Amb27413861 [0,1,0,0,0,0|1,0,2]=4 901 B13R1.2431 CCc1ccc(O)c(C(N)CC)c1 Amb25875780 [0,1,0,0,0,0|2,0,1]=4 902 B13R1.2431 CNC(=O)c1cc(C=O)ccc1O Amb18128317 [0,1,0,0,0,0|2,0,0]=3 903 B13R1.2431 COC(=O)c1cc(C=O)ccc1Br Amb24077432 [0,1,0,0,0,0|3,0,0]=4 904 B13R1.2431 COC(=O)c1cc(C=O)ccc1C Amb27624428 [0,1,0,0,0,0|3,0,0]=4 905 B13R1.2431 COC(=O)c1cc(C=O)ccc1Cl Amb25128853 [0,1,0,0,0,0|3,0,0]=4 906 B13R1.2431 COC(=O)c1cc(C=O)ccc1F Amb21927459 [0,1,0,0,0,0|3,0,0]=4 907 B13R1.2431 COC(=O)c1cc(C=O)ccc1N Amb27608622 [0,1,0,0,0,0|3,0,0]=4 908 B13R1.2431 COC(=O)c1cc(C=O)ccc1O Amb6307290 [0,1,0,0,0,0|2,0,0]=3 909 B13R1.2431 COC(=O)c1cc(N=O)ccc1O Amb26497582 [0,1,0,0,0,0|3,0,0]=4 910 B13R1.2900 C=CCc1cc(C=O)c(O)cc1O Amb27798338 [0,1,0,0,0,0|1,0,2]=4 911 B13R1.2900 CCCc1cc(C=O)c(O)cc1O Amb27873475 [0,1,0,0,0,0|1,0,0]=2 912 B13R1.2900 CCCc1cc(CC)c(O)cc1O Amb27229602 [0,1,0,0,0,0|2,0,1]=4 913 B13R1.2900 CCOc1cc(C#N)c(Br)cc1O Amb5722620 [0,1,0,0,0,0|1,0,1]=3 914 B13R1.2900 CCOc1cc(C#N)c(N)cc1C Amb27188200 [0,1,0,0,0,0|2,0,1]=4 915 B13R1.2900 CCOc1cc(C=O)c(Br)cc1Br Amb26363832 [0,1,0,0,0,0|1,0,0]=2 916 B13R1.2900 CCOc1cc(C=O)c(Br)cc1C Amb25956295 [0,1,0,0,0,0|1,0,0]=2 917 B13R1.2900 CCOc1cc(C=O)c(Br)cc1O Amb2220977 [0,1,0,0,0,0|0,0,0]=1 918 B13R1.2900 CCOc1cc(C=O)c(Cl)cc1O Amb8495780 [0,1,0,0,0,0|0,0,0]=1 919 B13R1.2900 CCOc1cc(C=O)c(O)cc1O Amb27169496 [0,1,0,0,0,0|0,0,0]=1 920 B13R1.2900 CCOc1cc(CCl)c(F)cc1C Amb28241054 [0,1,0,0,0,0|2,0,1]=4 921 B13R1.2900 CCOc1cc(CN)c(Br)cc1C Amb32411593 [0,1,0,0,0,0|2,0,1]=4 922 B13R1.2900 CCOc1cc(CO)c(Br)cc1C Amb27158039 [0,1,0,0,0,0|1,0,2]=4 923 B13R1.2900 CCOc1cc(CO)c(Br)cc1O Amb837467 [0,1,0,0,0,0|0,0,2]=3 924 B13R1.2900 CCOc1cc(NC)c(N)cc1Br Amb26639863 [0,1,0,0,0,0|3,0,0]=4 925 B13R1.2900 CCOc1cc(OC)c(C)cc1C Amb27616010 [0,1,0,0,0,0|3,0,0]=4 926 B13R1.2900 CCOc1cc(OC)c(C)cc1N Amb25111813 [0,1,0,0,0,0|3,0,0]=4 927 B13R1.2900 CCOc1cc(OC)c(Cl)cc1N Amb27599967 [0,1,0,0,0,0|3,0,0]=4 928 B13R1.2900 CCOc1cc(OC)c(F)cc1N Amb25246092 [0,1,0,0,0,0|3,0,0]=4 929 B13R1.2900 CCOc1cc(OC)c(I)cc1I Amb27217427 [0,1,0,0,0,0|3,0,0]=4 930 B13R1.2900 CCOc1cc(OC)c(N)cc1C Amb27393587 [0,1,0,0,0,0|3,0,0]=4 931 B13R1.2900 CCOc1cc(OC)c(N)cc1Cl Amb25894410 [0,1,0,0,0,0|3,0,0]=4 932 B13R1.2900 CCOc1cc(OC)c(N)cc1F Amb28047791 [0,1,0,0,0,0|3,0,0]=4 933 B13R1.3981 C#Cc1cc(Br)c(O)c(OCC)c1 Amb33434582 [0,1,0,0,0,0|1,0,1]=3 934 B13R1.3981 C=Cc1cc(Br)c(O)c(OCC)c1 Amb33434596 [0,1,0,0,0,0|1,0,0]=2 935 B13R1.3981 CCCc1cc(C#N)cc(N)c1O Amb28133785 [0,1,0,0,0,0|2,0,1]=4 936 B13R1.3981 CCCc1cc(C=O)cc(Cl)c1O Amb27970170 [0,1,0,0,0,0|1,0,0]=2 937 B13R1.3981 CCCc1cc(CC)cc(C)c1O Amb28351497 [0,1,0,0,0,0|2,0,1]=4 938 B13R1.3981 CCCc1cc(CO)cc(Cl)c1O Amb27974053 [0,1,0,0,0,0|1,0,2]=4 939 B13R1.3981 CCCc1cc(N=O)cc(C)c1O Amb27262971 [0,1,0,0,0,0|2,0,0]=3 940 B13R1.3981 CCOc1cc(C#N)cc(Br)c1O Amb6751780 [0,1,0,0,0,0|1,0,1]=3 941 B13R1.3981 CCOc1cc(C#N)cc(Cl)c1O Amb1651877 [0,1,0,0,0,0|1,0,1]=3 942 B13R1.3981 CCOc1cc(C#N)cc(I)c1O Amb8492800 [0,1,0,0,0,0|1,0,1]=3 943 B13R1.3981 CCOc1cc(C=O)cc(Br)c1O Amb6315534 [0,1,0,0,0,0|0,0,0]=1 944 B13R1.3981 CCOc1cc(C=O)cc(Cl)c1Cl Amb28316775 [0,1,0,0,0,0|1,0,0]=2 945 B13R1.3981 CCOc1cc(C=O)cc(Cl)c1O Amb1209605 [0,1,0,0,0,0|0,0,0]=1 946 B13R1.3981 CCOc1cc(C=O)cc(F)c1F Amb27267860 [0,1,0,0,0,0|1,0,0]=2 947 B13R1.3981 CCOc1cc(C=O)cc(I)c1O Amb1785985 [0,1,0,0,0,0|0,0,0]=1 948 B13R1.3981 CCOc1cc(C=O)cc(N)c1O Amb17208092 [0,1,0,0,0,0|0,0,0]=1 949 B13R1.3981 CCOc1cc(CCl)cc(Br)c1O Amb33434588 [0,1,0,0,0,0|1,0,1]=3 950 B13R1.3981 CCOc1cc(CN)cc(Br)c1O Amb18294995 [0,1,0,0,0,0|1,0,1]=3 951 B13R1.3981 CCOc1cc(CN)cc(F)c1C Amb23556474 [0,1,0,0,0,0|2,0,1]=4 952 B13R1.3981 CCOc1cc(CO)cc(Br)c1O Amb27587766 [0,1,0,0,0,0|0,0,2]=3 953 B13R1.3981 CCOc1cc(CO)cc(Cl)c1O Amb11037483 [0,1,0,0,0,0|0,0,2]=3 954 B13R1.3981 CCOc1cc(CO)cc(F)c1F Amb28400146 [0,1,0,0,0,0|1,0,2]=4 955 B13R1.3981 CCOc1cc(CS)cc(Br)c1O Amb33434614 [0,1,0,0,0,0|0,1,1]=3 956 B13R1.3981 CCOc1cc(NN)cc(Br)c1O Amb33434940 [0,1,0,0,0,0|2,0,0]=3 957 B13R1.3981 CCOc1cc(OC)cc(C)c1C Amb25270371 [0,1,0,0,0,0|3,0,0]=4 958 B13R1.3981 CCOc1cc(OC)cc(I)c1I Amb28347214 [0,1,0,0,0,0|3,0,0]=4 959 B13R1.3981 CCOc1cc(SC)cc(F)c1F Amb27608275 [0,1,0,0,0,0|3,0,0]=4 960 B13R1.4021 CCCc1c(F)ccc(C=O)c1O Amb27799820 [0,1,0,0,0,0|2,0,0]=3 961 B13R1.4021 CCCc1c(O)ccc(C=O)c1Cl Amb27599388 [0,1,0,0,0,0|1,0,0]=2 962 B13R1.4021 CCOc1c(Br)ccc(C#N)c1F Amb27476330 [0,1,0,0,0,0|2,0,1]=4 963 B13R1.4021 CCOc1c(Br)ccc(C=O)c1F Amb27766569 [0,1,0,0,0,0|1,0,0]=2 964 B13R1.4021 CCOc1c(Br)ccc(CCl)c1F Amb27768878 [0,1,0,0,0,0|2,0,1]=4 965 B13R1.4021 CCOc1c(C)ccc(C=O)c1C Amb27830133 [0,1,0,0,0,0|1,0,0]=2 966 B13R1.4021 CCOc1c(F)ccc(C#N)c1F Amb22047623 [0,1,0,0,0,0|2,0,1]=4 967 B13R1.4021 CCOc1c(F)ccc(C=O)c1F Amb22043591 [0,1,0,0,0,0|1,0,0]=2 968 B13R1.4021 CCOc1c(F)ccc(CBr)c1F Amb22047744 [0,1,0,0,0,0|2,0,1]=4 969 B13R1.4021 CCOc1c(F)ccc(CN)c1F Amb22047756 [0,1,0,0,0,0|2,0,1]=4 970 B13R1.4021 CCOc1c(F)ccc(CO)c1F Amb22047766 [0,1,0,0,0,0|1,0,2]=4 971 B13R2.57 BrCc1ccc2c(c1)OCCO2 Amb9211239 [0,0,0,1,0,0|1,0,1]=3 972 B13R2.57 Br[Mg]c1ccc2c(c1)OCCO2 Amb22000586 [0,0,0,1,0,0|2,0,0]=3 973 B13R2.57 C#Cc1ccc2c(c1)CCCO2 Amb28062294 [0,0,0,1,0,0|2,0,1]=4 974 B13R2.57 C#Cc1ccc2c(c1)NCCO2 Amb26847165 [0,0,0,1,0,0|2,0,1]=4 975 B13R2.57 C#Cc1ccc2c(c1)OCCO2 Amb18787945 [0,0,0,1,0,0|1,0,1]=3 976 B13R2.57 C#Cc1cnc2c(c1)OCCO2 Amb25715227 [0,0,0,1,0,0|2,0,1]=4 977 B13R2.57 C=Cc1cc2c(cn1)OCCO2 Amb27974605 [0,0,0,1,0,0|2,0,0]=3 978 B13R2.57 C=Cc1cc2c(nn1)OCCO2 Amb28384921 [0,0,0,1,0,0|3,0,0]=4 979 B13R2.57 C=Cc1ccc2c(c1)NCCC2 Amb27267180 [0,0,0,1,0,0|3,0,0]=4 980 B13R2.57 C=Cc1ccc2c(c1)NCCO2 Amb27196576 [0,0,0,1,0,0|2,0,0]=3 981 B13R2.57 C=Cc1ccc2c(c1)OCCO2 Amb22230100 [0,0,0,1,0,0|1,0,0]=2 982 B13R2.57 C=Cc1cnc2c(c1)OCCO2 Amb27416530 [0,0,0,1,0,0|2,0,0]=3 983 B13R2.57 CCc1ccc2c(c1)CCCO2 Amb28197577 [0,0,0,1,0,0|2,0,1]=4 984 B13R2.57 CCc1ccc2c(c1)NCCO2 Amb17063609 [0,0,0,1,0,0|2,0,1]=4 985 B13R2.57 CCc1ccc2c(c1)OCCC2 Amb27171323 [0,0,0,1,0,0|2,0,1]=4 986 B13R2.57 CCc1ccc2c(c1)OCCN2 Amb27641335 [0,0,0,1,0,0|2,0,1]=4 987 B13R2.57 CNc1ccc2c(c1)CCCO2 Amb18893481 [0,0,0,1,0,0|3,0,0]=4 988 B13R2.57 CNc1ccc2c(c1)OCCO2 Amb2721869 [0,0,0,1,0,0|2,0,0]=3 989 B13R2.57 CNc1ccc2c(c1)OCCO2 Amb33527017 [0,0,0,1,0,0|2,0,0]=3 990 B13R2.57 COc1ccc2c(c1)CCCO2 Amb23536170 [0,0,0,1,0,0|3,0,0]=4 991 B13R2.57 COc1ccc2c(c1)NCCO2 Amb2383448 [0,0,0,1,0,0|3,0,0]=4 992 B13R2.57 COc1ccc2c(c1)OCCN2 Amb22498731 [0,0,0,1,0,0|3,0,0]=4 993 B13R2.57 COc1ccc2c(n1)OCCO2 Amb31378912 [0,0,0,1,0,0|3,0,0]=4 994 B13R2.57 ClCc1ccc2c(c1)OCCN2 Amb27174346 [0,0,0,1,0,0|2,0,1]=4 995 B13R2.57 ClCc1ccc2c(c1)OCCO2 Amb2793723 [0,0,0,1,0,0|1,0,1]=3 996 B13R2.57 ClCc1ccc2c(n1)OCCO2 Amb27207050 [0,0,0,1,0,0|2,0,1]=4 997 B13R2.57 N#Cc1ccc2c(c1)CCCO2 Amb18893423 [0,0,0,1,0,0|2,0,1]=4 998 B13R2.57 N#Cc1ccc2c(c1)NCCO2 Amb22235058 [0,0,0,1,0,0|2,0,1]=4 999 B13R2.57 N#Cc1ccc2c(c1)NCCO2 Amb2383452 [0,0,0,1,0,0|2,0,1]=4 1000 B13R2.57 N#Cc1ccc2c(c1)OCCC2 Amb27410511 [0,0,0,1,0,0|2,0,1]=4 1001 B13R2.57 N#Cc1ccc2c(c1)OCCN2 Amb22001960 [0,0,0,1,0,0|2,0,1]=4 1002 B13R2.57 N#Cc1ccc2c(c1)OCCO2 Amb2726234 [0,0,0,1,0,0|1,0,1]=3 1003 B13R2.57 N#Cc1cnc2c(c1)OCCO2 Amb21959403 [0,0,0,1,0,0|2,0,1]=4 1004 B13R2.57 NCc1cc2c(cn1)OCCO2 Amb23455871 [0,0,0,1,0,0|2,0,1]=4 1005 B13R2.57 NCc1cc2c(cn1)OCCO2 Amb30584923 [0,0,0,1,0,0|2,0,1]=4 1006 B13R2.57 NCc1ccc2c(c1)CCCO2 Amb13949146 [0,0,0,1,0,0|2,0,1]=4 1007 B13R2.57 NCc1ccc2c(c1)CCCO2 Amb2786038 [0,0,0,1,0,0|2,0,1]=4 1008 B13R2.57 NCc1ccc2c(c1)NCCO2 Amb17307411 [0,0,0,1,0,0|2,0,1]=4 1009 B13R2.57 NCc1ccc2c(c1)OCCN2 Amb18101317 [0,0,0,1,0,0|2,0,1]=4 1010 B13R2.57 NCc1ccc2c(c1)OCCN2 Amb33330537 [0,0,0,1,0,0|2,0,1]=4 1011 B13R2.57 NCc1ccc2c(c1)OCCO2 Amb1105285 [0,0,0,1,0,0|1,0,1]=3 1012 B13R2.57 NCc1ccc2c(c1)OCCO2 Amb6891875 [0,0,0,1,0,0|1,0,1]=3 1013 B13R2.57 NCc1ccc2c(n1)OCCO2 Amb28203679 [0,0,0,1,0,0|2,0,1]=4 1014 B13R2.57 NNc1ccc2c(c1)CCCO2 Amb18893490 [0,0,0,1,0,0|3,0,0]=4 1015 B13R2.57 NNc1ccc2c(c1)OCCO2 Amb17622288 [0,0,0,1,0,0|2,0,0]=3 1016 B13R2.57 NNc1ccc2c(c1)OCCO2 Amb17935627 [0,0,0,1,0,0|2,0,0]=3 1017 B13R2.57 NOc1ccc2c(c1)CCCO2 Amb27803620 [0,0,0,1,0,0|3,0,0]=4 1018 B13R2.57 O=Cc1cc2c(cn1)CCCO2 Amb26483139 [0,0,0,1,0,0|2,0,0]=3 1019 B13R2.57 O=Cc1cc2c(cn1)OCCC2 Amb22886672 [0,0,0,1,0,0|2,0,0]=3 1020 B13R2.57 O=Cc1cc2c(cn1)OCCO2 Amb16233624 [0,0,0,1,0,0|1,0,0]=2 1021 B13R2.57 O=Cc1cc2c(nn1)OCCO2 Amb27263870 [0,0,0,1,0,0|2,0,0]=3 1022 B13R2.57 O=Cc1cc2c(nn1)OCCS2 Amb24713372 [0,0,0,1,0,0|2,1,0]=4 1023 B13R2.57 O=Cc1ccc2c(c1)CCCC2 Amb2690550 [0,0,0,1,0,0|2,0,0]=3 1024 B13R2.57 O=Cc1ccc2c(c1)CCCN2 Amb18829946 [0,0,0,1,0,0|2,0,0]=3 1025 B13R2.57 O=Cc1ccc2c(c1)CCCO2 Amb5562405 [0,0,0,1,0,0|1,0,0]=2 1026 B13R2.57 O=Cc1ccc2c(c1)CCNC2 Amb22886438 [0,0,0,1,0,0|3,0,0]=4 1027 B13R2.57 O=Cc1ccc2c(c1)CCNC2 Amb24493646 [0,0,0,1,0,0|3,0,0]=4 1028 B13R2.57 O=Cc1ccc2c(c1)CCOC2 Amb25108583 [0,0,0,1,0,0|3,0,0]=4 1029 B13R2.57 O=Cc1ccc2c(c1)CNCC2 Amb27398832 [0,0,0,1,0,0|3,0,0]=4 1030 B13R2.57 O=Cc1ccc2c(c1)COCC2 Amb18829764 [0,0,0,1,0,0|3,0,0]=4 1031 B13R2.57 O=Cc1ccc2c(c1)COCO2 Amb18829066 [0,0,0,1,0,0|2,0,0]=3 1032 B13R2.57 O=Cc1ccc2c(c1)NC=CO2 Amb27213205 [0,0,0,1,0,0|1,0,2]=4 1033 B13R2.57 O=Cc1ccc2c(c1)NCCC2 Amb18829948 [0,0,0,1,0,0|2,0,0]=3 1034 B13R2.57 O=Cc1ccc2c(c1)NCCO2 Amb18829460 [0,0,0,1,0,0|1,0,0]=2 1035 B13R2.57 O=Cc1ccc2c(c1)NCCS2 Amb25690197 [0,0,0,1,0,0|1,1,0]=3 1036 B13R2.57 O=Cc1ccc2c(c1)NCCS2 Amb33446943 [0,0,0,1,0,0|1,1,0]=3 1037 B13R2.57 O=Cc1ccc2c(c1)OC=CO2 Amb28344164 [0,0,0,1,0,0|0,0,2]=3 1038 B13R2.57 O=Cc1ccc2c(c1)OCCC2 Amb24640311 [0,0,0,1,0,0|1,0,0]=2 1039 B13R2.57 O=Cc1ccc2c(c1)OCCO2 Amb1152780 [0,0,0,1,0,0|0,0,0]=1 1040 B13R2.57 O=Cc1ccc2c(c1)OCOC2 Amb18829064 [0,0,0,1,0,0|2,0,0]=3 1041 B13R2.57 O=Cc1ccc2c(n1)CCCC2 Amb23455028 [0,0,0,1,0,0|3,0,0]=4 1042 B13R2.57 O=Cc1ccc2c(n1)NCCC2 Amb13883755 [0,0,0,1,0,0|3,0,0]=4 1043 B13R2.57 O=Cc1ccc2c(n1)NCCO2 Amb28324507 [0,0,0,1,0,0|2,0,0]=3 1044 B13R2.57 O=Cc1ccc2c(n1)OCCO2 Amb16233625 [0,0,0,1,0,0|1,0,0]=2 1045 B13R2.57 O=Cc1ccc2c(n1)SCCO2 Amb28399340 [0,0,0,1,0,0|1,1,0]=3 1046 B13R2.57 O=Cc1cnc2c(c1)CCCC2 Amb17334528 [0,0,0,1,0,0|3,0,0]=4 1047 B13R2.57 O=Cc1cnc2c(c1)CCCO2 Amb13889666 [0,0,0,1,0,0|2,0,0]=3 1048 B13R2.57 O=Cc1cnc2c(c1)OCCO2 Amb16233626 [0,0,0,1,0,0|1,0,0]=2 1049 B13R2.57 OCc1ccc2c(c1)CCCO2 Amb18862599 [0,0,0,1,0,0|1,0,2]=4 1050 B13R2.57 OCc1ccc2c(c1)NCCO2 Amb10975385 [0,0,0,1,0,0|1,0,2]=4 1051 B13R2.57 OCc1ccc2c(c1)OCCN2 Amb17209391 [0,0,0,1,0,0|1,0,2]=4 1052 B13R2.57 OCc1ccc2c(c1)OCCO2 Amb837280 [0,0,0,1,0,0|0,0,2]=3 1053 B13R2.57 OCc1cnc2c(c1)OCCO2 Amb21959404 [0,0,0,1,0,0|1,0,2]=4 1054 B13R2.57 SCc1ccc2c(c1)CCCO2 Amb25955996 [0,0,0,1,0,0|1,1,1]=4 1055 B13R2.57 SCc1ccc2c(c1)OCCO2 Amb24584570 [0,0,0,1,0,0|0,1,1]=3 1056 B13R2.57 [C-]#[N+]c1ccc2c(c1)OCCO2 Amb8517080 [0,0,0,1,0,0|2,0,0]=3 1057 B13R2.57 [NH3+]Cc1ccc2c(c1)OCCO2 Amb33513041 [0,0,0,1,0,0|1,0,1]=3 1058 B13R2.611 COc1ccc(N)c2c1CCO2 Amb18136197 [0,0,0,1,0,0|3,0,0]=4 1059 B13R2.611 COc1ccc(O)c2c1CCC2 Amb10068721 [0,0,0,1,0,0|3,0,0]=4 1060 B13R2.611 COc1ccc(O)c2c1CCN2 Amb27791161 [0,0,0,1,0,0|3,0,0]=4 1061 B13R2.611 COc1ccc(O)c2c1OCO2 Amb27607169 [0,0,0,1,0,0|3,0,0]=4 1062 B13R2.611 O=Cc1ccc(F)c2occc12 Amb24079019 [0,0,0,1,0,0|1,0,2]=4 1063 B13R2.611 O=Cc1ccc(O)c2sccc12 Amb28247164 [0,0,0,1,0,0|0,1,2]=4 1064 B13R2.2121 C#Cc1ccc2c(c1)CC(C)O2 Amb32881365 [0,0,0,1,0,0|2,0,1]=4 1065 B13R2.2121 C=Cc1ccc2c(c1)CC(C)O2 Amb32880012 [0,0,0,1,0,0|2,0,0]=3 1066 B13R2.2121 CC1Cc2cc(C#N)ccc2O1 Amb7968772 [0,0,0,1,0,0|2,0,1]=4 1067 B13R2.2121 CC1Cc2cc(C=O)ccc2O1 Amb845109 [0,0,0,1,0,0|1,0,0]=2 1068 B13R2.2121 CC1Cc2cc(C=O)ccc2S1 Amb18824846 [0,0,0,1,0,0|1,1,0]=3 1069 B13R2.2121 CC1Cc2cc(CBr)ccc2O1 Amb26474377 [0,0,0,1,0,0|2,0,1]=4 1070 B13R2.2121 CC1Cc2cc(CCl)ccc2O1 Amb8928014 [0,0,0,1,0,0|2,0,1]=4 1071 B13R2.2121 CC1Cc2cc(CN)ccc2O1 Amb845110 [0,0,0,1,0,0|2,0,1]=4 1072 B13R2.2121 CC1Cc2cc(CO)ccc2O1 Amb10782054 [0,0,0,1,0,0|1,0,2]=4 1073 B13R2.2121 CC1Cc2cc(CS)ccc2O1 Amb32878143 [0,0,0,1,0,0|1,1,1]=4 1074 B13R2.2121 CC1Cc2cc(NN)ccc2O1 Amb32879608 [0,0,0,1,0,0|3,0,0]=4 1075 B13R2.2121 CC1Cc2ccc(C=O)cc2C1 Amb27830039 [0,0,0,1,0,0|2,0,0]=3 1076 B13R2.2121 CC1Cc2ccc(C=O)cc2S1 Amb18824841 [0,0,0,1,0,0|1,1,0]=3 1077 B13R2.2121 CC1Cc2ccc(CO)cc2O1 Amb27967445 [0,0,0,1,0,0|1,0,2]=4 1078 B13R2.2121 CC1Oc2ccc(CO)cc2O1 Amb27775445 [0,0,0,1,0,0|0,0,2]=3 1079 B13R2.2121 CN1Cc2ccc(C=O)cc2C1 Amb8009966 [0,0,0,1,0,0|3,0,0]=4 1080 B13R2.2121 Cc1cc2cc(C=O)ccc2s1 Amb18647980 [0,0,0,1,0,0|1,1,1]=4 1081 B13R2.2121 Cc1cc2cc(C=O)ncc2o1 Amb18830102 [0,0,0,1,0,0|2,0,1]=4 1082 B13R2.2121 Cc1nc2cc(C=O)ccc2o1 Amb17470412 [0,0,0,1,0,0|1,0,1]=3 1083 B13R2.2121 Cc1nc2cc(C=O)ccc2s1 Amb341465 [0,0,0,1,0,0|1,1,1]=4 1084 B13R2.2121 Cc1nc2ccc(C=O)cc2o1 Amb18830140 [0,0,0,1,0,0|1,0,1]=3 1085 B13R2.2121 Cc1nc2ccc(C=O)cc2s1 Amb4154455 [0,0,0,1,0,0|1,1,1]=4 1086 B13R2.2121 Cc1nc2ncc(C=O)cc2o1 Amb18829833 [0,0,0,1,0,0|2,0,1]=4 1087 B13R2.2121 Cn1cc2cc(C=O)ccc2n1 Amb24183416 [0,0,0,1,0,0|3,0,0]=4 1088 B13R2.2121 Cn1cc2ccc(C=O)cc2n1 Amb24183990 [0,0,0,1,0,0|3,0,0]=4 1089 B13R2.2121 Cn1nc2ccc(C=O)cc2n1 Amb23402439 [0,0,0,1,0,0|3,0,0]=4 1090 B13R2.2121 N#Cc1ccc2c(c1)OC(Cl)O2 Amb28137957 [0,0,0,1,0,0|2,0,1]=4 1091 B13R2.2121 NC1Cc2ccc(C=O)cc2C1 Amb28243780 [0,0,0,1,0,0|3,0,0]=4 1092 B13R2.2121 O=Cc1ccc2c(c1)NC(=O)O2 Amb18540682 [0,0,0,1,0,0|2,0,1]=4 1093 B13R2.2121 O=Cc1ccc2c(c1)OC(=O)N2 Amb18829558 [0,0,0,1,0,0|2,0,1]=4 1094 B13R2.2121 O=Cc1ccc2c(c1)OC(=O)O2 Amb25758669 [0,0,0,1,0,0|1,0,1]=3 1095 B13R2.2121 O=Cc1ccc2nc(F)oc2c1 Amb27192615 [0,0,0,1,0,0|2,0,1]=4 1096 B13R2.2121 O=Cc1ccc2nc(I)oc2c1 Amb25940871 [0,0,0,1,0,0|2,0,1]=4 1097 B13R2.2121 O=Cc1ccc2nc(S)oc2c1 Amb25249962 [0,0,0,1,0,0|2,0,1]=4 1098 B13R2.2121 O=Cc1ccc2oc(Br)nc2c1 Amb27442035 [0,0,0,1,0,0|2,0,1]=4 1099 B13R2.2121 O=Cc1ccc2oc(Cl)nc2c1 Amb26608362 [0,0,0,1,0,0|2,0,1]=4 1100 B13R2.2121 O=Cc1ccc2oc(I)nc2c1 Amb25922173 [0,0,0,1,0,0|2,0,1]=4 1101 B13R2.2121 O=Cc1ccc2oc(S)nc2c1 Amb26896679 [0,0,0,1,0,0|2,0,1]=4 1102 B13R2.2121 [C-]#[N+]c1ccc2c(c1)CC(C)O2 Amb32881384 [0,0,0,1,0,0|3,0,0]=4 1103 B13R2.2169 Cc1ccc(C=O)cc1C2CC2 Amb25899173 [0,0,0,1,0,0|2,0,0]=3 1104 B13R2.2169 O=Cc1ccc(Cl)c(C2CC2)c1 Amb33098473 [0,0,0,1,0,0|2,0,0]=3 1105 B13R2.2169 O=Cc1ccc(F)c(C2CC2)c1 Amb18800776 [0,0,0,1,0,0|2,0,0]=3 1106 B11R1.185 CCCc1sc(C=O)cc1Br Amb6889639 [0,0,0,0,1,0|3,0,0]=4 1107 B11R1.185 CCOc1oc(C=O)nc1C Amb27210967 [0,0,0,0,1,0|3,0,0]=4 1108 B11R1.303 CCOc1c(C=O)cnn1C Amb25948473 [0,0,0,0,1,0|3,0,0]=4 1109 B10R0.83 COC(=O)\C(O)=C\C=C\C=O Amb17850706 [1,0,1,0,0,0|1,0,0]=3 1110 B10R1.4 CCCc1ccccc1Br Amb26623759 [2,0,0,0,0,0|2,0,0]=4 1111 B10R1.4 CCCc1ccccc1C Amb22227985 [2,0,0,0,0,0|2,0,0]=4 1112 B10R1.4 CCCc1ccccc1Cl Amb28049677 [2,0,0,0,0,0|2,0,0]=4 1113 B10R1.4 CCCc1ccccc1I Amb20622716 [2,0,0,0,0,0|2,0,0]=4 1114 B10R1.4 CCCc1ccccc1N Amb2724372 [2,0,0,0,0,0|2,0,0]=4 1115 B10R1.4 CCCc1ccccc1O Amb2726171 [2,0,0,0,0,0|1,0,0]=3 1116 B10R1.4 CCCc1ccccc1S Amb32688038 [2,0,0,0,0,0|1,1,0]=4 1117 B10R1.4 CCCc1cccnc1O Amb24319273 [2,0,0,0,0,0|2,0,0]=4 1118 B10R1.4 CCCc1cnccc1O Amb33189019 [2,0,0,0,0,0|2,0,0]=4 1119 B10R1.4 CCCc1ncccc1O Amb24320670 [2,0,0,0,0,0|2,0,0]=4 1120 B10R1.4 CCNc1ccccc1Br Amb6696453 [2,0,0,0,0,0|2,0,0]=4 1121 B10R1.4 CCNc1ccccc1C Amb4037021 [2,0,0,0,0,0|2,0,0]=4 1122 B10R1.4 CCNc1ccccc1Cl Amb32651858 [2,0,0,0,0,0|2,0,0]=4 1123 B10R1.4 CCNc1ccccc1Cl Amb4313295 [2,0,0,0,0,0|2,0,0]=4 1124 B10R1.4 CCNc1ccccc1F Amb2688341 [2,0,0,0,0,0|2,0,0]=4 1125 B10R1.4 CCNc1ccccc1I Amb9203660 [2,0,0,0,0,0|2,0,0]=4 1126 B10R1.4 CCNc1ccccc1N Amb29847532 [2,0,0,0,0,0|2,0,0]=4 1127 B10R1.4 CCNc1ccccc1N Amb7767530 [2,0,0,0,0,0|2,0,0]=4 1128 B10R1.4 CCNc1ccccc1O Amb18643152 [2,0,0,0,0,0|1,0,0]=3 1129 B10R1.4 CCNc1cccnc1O Amb30633550 [2,0,0,0,0,0|2,0,0]=4 1130 B10R1.4 CCOC1=CC=CNC1=O Amb18537475 [2,0,0,0,0,0|1,0,1]=4 1131 B10R1.4 CCON1C=CC=CC1=S Amb25257642 [2,0,0,0,0,0|1,1,0]=4 1132 B10R1.4 CCOc1ccccc1Br Amb4010257 [2,0,0,0,0,0|1,0,0]=3 1133 B10R1.4 CCOc1ccccc1C Amb9787457 [2,0,0,0,0,0|1,0,0]=3 1134 B10R1.4 CCOc1ccccc1Cl Amb9787476 [2,0,0,0,0,0|1,0,0]=3 1135 B10R1.4 CCOc1ccccc1F Amb2688288 [2,0,0,0,0,0|1,0,0]=3 1136 B10R1.4 CCOc1ccccc1I Amb19888234 [2,0,0,0,0,0|1,0,0]=3 1137 B10R1.4 CCOc1ccccc1N Amb840072 [2,0,0,0,0,0|1,0,0]=3 1138 B10R1.4 CCOc1ccccc1O Amb3939539 [2,0,0,0,0,0|0,0,0]=2 1139 B10R1.4 CCOc1ccccc1S Amb20242711 [2,0,0,0,0,0|0,1,0]=3 1140 B10R1.4 CCOc1cccnc1Br Amb33547876 [2,0,0,0,0,0|2,0,0]=4 1141 B10R1.4 CCOc1cccnc1C Amb24057152 [2,0,0,0,0,0|2,0,0]=4 1142 B10R1.4 CCOc1cccnc1Cl Amb9175211 [2,0,0,0,0,0|2,0,0]=4 1143 B10R1.4 CCOc1cccnc1F Amb26359800 [2,0,0,0,0,0|2,0,0]=4 1144 B10R1.4 CCOc1cccnc1I Amb25681793 [2,0,0,0,0,0|2,0,0]=4 1145 B10R1.4 CCOc1cccnc1N Amb1102343 [2,0,0,0,0,0|2,0,0]=4 1146 B10R1.4 CCOc1ccncc1Br Amb8438924 [2,0,0,0,0,0|2,0,0]=4 1147 B10R1.4 CCOc1ccncc1F Amb2610080 [2,0,0,0,0,0|2,0,0]=4 1148 B10R1.4 CCOc1ccncc1I Amb24536249 [2,0,0,0,0,0|2,0,0]=4 1149 B10R1.4 CCOc1ccncc1N Amb7765083 [2,0,0,0,0,0|2,0,0]=4 1150 B10R1.4 CCOc1cnccc1C Amb27810354 [2,0,0,0,0,0|2,0,0]=4 1151 B10R1.4 CCOc1cnccc1N Amb21857560 [2,0,0,0,0,0|2,0,0]=4 1152 B10R1.4 CCOc1ncccc1Br Amb20242466 [2,0,0,0,0,0|2,0,0]=4 1153 B10R1.4 CCOc1ncccc1Cl Amb8439534 [2,0,0,0,0,0|2,0,0]=4 1154 B10R1.4 CCOc1ncccc1I Amb6565054 [2,0,0,0,0,0|2,0,0]=4 1155 B10R1.4 CCOc1ncccc1N Amb1136817 [2,0,0,0,0,0|2,0,0]=4 1156 B10R1.4 CCOc1ncccc1O Amb19895105 [2,0,0,0,0,0|1,0,0]=3 1157 B10R1.4 CCPc1ccccc1N Amb27637691 [2,0,0,0,0,0|2,0,0]=4 1158 B10R1.4 CCSc1ccccc1Br Amb20242712 [2,0,0,0,0,0|1,1,0]=4 1159 B10R1.4 CCSc1ccccc1C Amb27259108 [2,0,0,0,0,0|1,1,0]=4 1160 B10R1.4 CCSc1ccccc1Cl Amb26500521 [2,0,0,0,0,0|1,1,0]=4 1161 B10R1.4 CCSc1ccccc1F Amb24480376 [2,0,0,0,0,0|1,1,0]=4 1162 B10R1.4 CCSc1ccccc1N Amb10609429 [2,0,0,0,0,0|1,1,0]=4 1163 B10R1.4 CCSc1ccccc1N Amb6281496 [2,0,0,0,0,0|1,1,0]=4 1164 B10R1.4 CCSc1ccccc1O Amb33529393 [2,0,0,0,0,0|0,1,0]=3 1165 B10R1.4 CCSc1ncccc1O Amb10552831 [2,0,0,0,0,0|1,1,0]=4 1166 B10R1.4 CNCc1ccccc1O Amb1113119 [2,0,0,0,0,0|2,0,0]=4 1167 B10R1.4 CNCc1ccccc1O Amb7969802 [2,0,0,0,0,0|2,0,0]=4 1168 B10R1.4 COCc1ccccc1O Amb22751673 [2,0,0,0,0,0|2,0,0]=4 1169 B10R1.4 CSCc1ccccc1O Amb18125792 [2,0,0,0,0,0|2,0,0]=4 1170 B10R1.4 C\C=C\c1ccccc1O Amb3372048 [2,0,0,0,0,0|1,0,1]=4 1171 B10R1.4 Cc1ccccc1OCCl Amb27494113 [2,0,0,0,0,0|2,0,0]=4 1172 B10R1.4 ClCOc1ccccc1Br Amb26889271 [2,0,0,0,0,0|2,0,0]=4 1173 B10R1.4 ClCOc1ccccc1Cl Amb22227923 [2,0,0,0,0,0|2,0,0]=4 1174 B10R1.4 ClCOc1ccccc1I Amb28187723 [2,0,0,0,0,0|2,0,0]=4 1175 B10R1.4 Fc1ccccc1OCCl Amb25356820 [2,0,0,0,0,0|2,0,0]=4 1176 B10R1.4 NCCc1ccccc1O Amb33549438 [2,0,0,0,0,0|2,0,0]=4 1177 B10R1.4 NCCc1ccccc1O Amb6246475 [2,0,0,0,0,0|2,0,0]=4 1178 B10R1.4 O=COc1ccccc1O Amb17593488 [2,0,0,0,0,0|1,0,1]=4 1179 B10R1.4 OCCc1ccccc1O Amb3940101 [2,0,0,0,0,0|2,0,0]=4 1180 B10R1.4 Oc1ccccc1CCBr Amb33549255 [2,0,0,0,0,0|2,0,0]=4 1181 B10R1.4 Oc1ccccc1CCI Amb25208761 [2,0,0,0,0,0|2,0,0]=4 1182 B10R1.4 Oc1ccccc1CCS Amb24362789 [2,0,0,0,0,0|2,0,0]=4 1183 B10R1.4 Oc1ccccc1SCCl Amb28204207 [2,0,0,0,0,0|1,1,0]=4 1184 B10R1.10 CCCc1cccc(Br)c1 Amb25736130 [2,0,0,0,0,0|2,0,0]=4 1185 B10R1.10 CCCc1cccc(C)c1 Amb22232362 [2,0,0,0,0,0|1,0,1]=4 1186 B10R1.10 CCCc1cccc(Cl)c1 Amb8393606 [2,0,0,0,0,0|2,0,0]=4 1187 B10R1.10 CCCc1cccc(N)c1 Amb18643014 [2,0,0,0,0,0|2,0,0]=4 1188 B10R1.10 CCCc1cccc(N)c1 Amb33172785 [2,0,0,0,0,0|2,0,0]=4 1189 B10R1.10 CCCc1cccc(O)c1 Amb3941016 [2,0,0,0,0,0|1,0,1]=4 1190 B10R1.10 CCNc1cccc(Br)c1 Amb6696674 [2,0,0,0,0,0|2,0,0]=4 1191 B10R1.10 CCNc1cccc(Br)c1 Amb7969585 [2,0,0,0,0,0|2,0,0]=4 1192 B10R1.10 CCNc1cccc(C)c1 Amb4440919 [2,0,0,0,0,0|1,0,1]=4 1193 B10R1.10 CCNc1cccc(C)c1 Amb6540783 [2,0,0,0,0,0|1,0,1]=4 1194 B10R1.10 CCNc1cccc(Cl)c1 Amb6695730 [2,0,0,0,0,0|2,0,0]=4 1195 B10R1.10 CCNc1cccc(F)c1 Amb10609458 [2,0,0,0,0,0|2,0,0]=4 1196 B10R1.10 CCNc1cccc(F)c1 Amb6695887 [2,0,0,0,0,0|2,0,0]=4 1197 B10R1.10 CCNc1cccc(I)c1 Amb9203673 [2,0,0,0,0,0|2,0,0]=4 1198 B10R1.10 CCNc1cccc(N)c1 Amb8825439 [2,0,0,0,0,0|2,0,0]=4 1199 B10R1.10 CCNc1cccc(O)c1 Amb22168804 [2,0,0,0,0,0|1,0,1]=4 1200 B10R1.10 CCNc1cccc(O)c1 Amb6734927 [2,0,0,0,0,0|1,0,1]=4 1201 B10R1.10 CCOC1=CC(=O)NC=N1 Amb24356773 [2,0,0,0,0,0|2,0,0]=4 1202 B10R1.10 CCOc1cc(Br)ccn1 Amb10576613 [2,0,0,0,0,0|2,0,0]=4 1203 B10R1.10 CCOc1cc(C)ccn1 Amb2795401 [2,0,0,0,0,0|1,0,1]=4 1204 B10R1.10 CCOc1cc(Cl)ccn1 Amb19957988 [2,0,0,0,0,0|2,0,0]=4 1205 B10R1.10 CCOc1cc(F)ccn1 Amb24317829 [2,0,0,0,0,0|2,0,0]=4 1206 B10R1.10 CCOc1cc(I)ccn1 Amb22498330 [2,0,0,0,0,0|2,0,0]=4 1207 B10R1.10 CCOc1cc(N)ccn1 Amb2610086 [2,0,0,0,0,0|2,0,0]=4 1208 B10R1.10 CCOc1ccc[n+]([O-])c1 Amb25206359 [2,0,0,0,0,0|1,0,1]=4 1209 B10R1.10 CCOc1cccc(Br)c1 Amb3938998 [2,0,0,0,0,0|1,0,0]=3 1210 B10R1.10 CCOc1cccc(Br)n1 Amb8438959 [2,0,0,0,0,0|2,0,0]=4 1211 B10R1.10 CCOc1cccc(C)n1 Amb2795402 [2,0,0,0,0,0|1,0,1]=4 1212 B10R1.10 CCOc1cccc(Cl)n1 Amb3939997 [2,0,0,0,0,0|2,0,0]=4 1213 B10R1.10 CCOc1cccc(F)c1 Amb2684175 [2,0,0,0,0,0|1,0,0]=3 1214 B10R1.10 CCOc1cccc(F)n1 Amb33537560 [2,0,0,0,0,0|2,0,0]=4 1215 B10R1.10 CCOc1cccc(I)c1 Amb19196001 [2,0,0,0,0,0|1,0,0]=3 1216 B10R1.10 CCOc1cccc(N)c1 Amb1124598 [2,0,0,0,0,0|1,0,0]=3 1217 B10R1.10 CCOc1cccc(N)n1 Amb2609847 [2,0,0,0,0,0|2,0,0]=4 1218 B10R1.10 CCOc1cccc(N)n1 Amb32668102 [2,0,0,0,0,0|2,0,0]=4 1219 B10R1.10 CCOc1cccc(O)c1 Amb2720441 [2,0,0,0,0,0|0,0,1]=3 1220 B10R1.10 CCOc1cccc(O)n1 Amb28049436 [2,0,0,0,0,0|1,0,1]=4 1221 B10R1.10 CCOc1cccc(S)c1 Amb10070967 [2,0,0,0,0,0|0,1,0]=3 1222 B10R1.10 CCOc1ccnc(Br)c1 Amb8438933 [2,0,0,0,0,0|2,0,0]=4 1223 B10R1.10 CCOc1ccnc(C)c1 Amb24687076 [2,0,0,0,0,0|1,0,1]=4 1224 B10R1.10 CCOc1ccnc(Cl)c1 Amb8438934 [2,0,0,0,0,0|2,0,0]=4 1225 B10R1.10 CCOc1ccnc(F)c1 Amb15691032 [2,0,0,0,0,0|2,0,0]=4 1226 B10R1.10 CCOc1ccnc(I)c1 Amb27230249 [2,0,0,0,0,0|2,0,0]=4 1227 B10R1.10 CCOc1ccnc(N)c1 Amb2610118 [2,0,0,0,0,0|2,0,0]=4 1228 B10R1.10 CCOc1ccnc(O)c1 Amb8438990 [2,0,0,0,0,0|1,0,1]=4 1229 B10R1.10 CCOc1cncc(Br)c1 Amb15691049 [2,0,0,0,0,0|2,0,0]=4 1230 B10R1.10 CCOc1cncc(C)c1 Amb24350527 [2,0,0,0,0,0|1,0,1]=4 1231 B10R1.10 CCOc1cncc(I)c1 Amb26504467 [2,0,0,0,0,0|2,0,0]=4 1232 B10R1.10 CCOc1cncc(N)c1 Amb8438993 [2,0,0,0,0,0|2,0,0]=4 1233 B10R1.10 CCOc1cncc(O)c1 Amb23455720 [2,0,0,0,0,0|1,0,1]=4 1234 B10R1.10 CCSc1cccc(Br)c1 Amb10067418 [2,0,0,0,0,0|1,1,0]=4 1235 B10R1.10 CCSc1cccc(C)c1 Amb25328608 [2,0,0,0,0,0|0,1,1]=4 1236 B10R1.10 CCSc1cccc(Cl)c1 Amb26318573 [2,0,0,0,0,0|1,1,0]=4 1237 B10R1.10 CCSc1cccc(F)c1 Amb25063729 [2,0,0,0,0,0|1,1,0]=4 1238 B10R1.10 CCSc1cccc(N)c1 Amb18950176 [2,0,0,0,0,0|1,1,0]=4 1239 B10R1.10 CCSc1cccc(O)c1 Amb18644674 [2,0,0,0,0,0|0,1,1]=4 1240 B10R1.10 Cc1cccc(OCCl)c1 Amb27618304 [2,0,0,0,0,0|1,0,1]=4 1241 B10R1.10 ClCOc1cccc(Br)c1 Amb26977241 [2,0,0,0,0,0|2,0,0]=4 1242 B10R1.10 ClCOc1cccc(Cl)c1 Amb24482267 [2,0,0,0,0,0|2,0,0]=4 1243 B10R1.10 ClCOc1cccc(I)c1 Amb25272062 [2,0,0,0,0,0|2,0,0]=4 1244 B10R1.10 Fc1cccc(OCCl)c1 Amb24401502 [2,0,0,0,0,0|2,0,0]=4 1245 B10R1.30 C=C1C=CC(=O)C(OC)=C1 Amb27948733 [2,0,0,0,0,0|0,0,1]=3 1246 B10R1.30 CCC1=C(C)C=CC(=O)N1 Amb24442332 [2,0,0,0,0,0|2,0,0]=4 1247 B10R1.30 CCC1=CC(=O)C=CC1=O Amb25129510 [2,0,0,0,0,0|0,0,1]=3 1248 B10R1.30 CCc1[nH+]c(C)ccc1O Amb21949341 [2,0,0,0,0,0|1,0,1]=4 1249 B10R1.30 CCc1cc(Br)ccc1Br Amb10071002 [2,0,0,0,0,0|2,0,0]=4 1250 B10R1.30 CCc1cc(Br)ccc1C Amb27451016 [2,0,0,0,0,0|2,0,0]=4 1251 B10R1.30 CCc1cc(Br)ccc1Cl Amb10070784 [2,0,0,0,0,0|2,0,0]=4 1252 B10R1.30 CCc1cc(Br)ccc1F Amb19944149 [2,0,0,0,0,0|2,0,0]=4 1253 B10R1.30 CCc1cc(Br)ccc1I Amb2691839 [2,0,0,0,0,0|2,0,0]=4 1254 B10R1.30 CCc1cc(Br)ccc1N Amb2726207 [2,0,0,0,0,0|2,0,0]=4 1255 B10R1.30 CCc1cc(Br)ccc1N Amb3939781 [2,0,0,0,0,0|2,0,0]=4 1256 B10R1.30 CCc1cc(Br)ccc1O Amb5781634 [2,0,0,0,0,0|1,0,0]=3 1257 B10R1.30 CCc1cc(Br)ccc1S Amb26459874 [2,0,0,0,0,0|1,1,0]=4 1258 B10R1.30 CCc1cc(C)ccc1Br Amb25682377 [2,0,0,0,0,0|1,0,1]=4 1259 B10R1.30 CCc1cc(C)ccc1C Amb17940043 [2,0,0,0,0,0|1,0,1]=4 1260 B10R1.30 CCc1cc(C)ccc1Cl Amb25145606 [2,0,0,0,0,0|1,0,1]=4 1261 B10R1.30 CCc1cc(C)ccc1F Amb25887859 [2,0,0,0,0,0|1,0,1]=4 1262 B10R1.30 CCc1cc(C)ccc1I Amb27263065 [2,0,0,0,0,0|1,0,1]=4 1263 B10R1.30 CCc1cc(C)ccc1N Amb27468670 [2,0,0,0,0,0|1,0,1]=4 1264 B10R1.30 CCc1cc(C)ccc1O Amb18643083 [2,0,0,0,0,0|0,0,1]=3 1265 B10R1.30 CCc1cc(C)cnc1O Amb25189855 [2,0,0,0,0,0|1,0,1]=4 1266 B10R1.30 CCc1cc(C)ncc1O Amb28315822 [2,0,0,0,0,0|1,0,1]=4 1267 B10R1.30 CCc1cc(Cl)ccc1Br Amb19944160 [2,0,0,0,0,0|2,0,0]=4 1268 B10R1.30 CCc1cc(Cl)ccc1Cl Amb27153830 [2,0,0,0,0,0|2,0,0]=4 1269 B10R1.30 CCc1cc(Cl)ccc1F Amb24690233 [2,0,0,0,0,0|2,0,0]=4 1270 B10R1.30 CCc1cc(Cl)ccc1N Amb22587366 [2,0,0,0,0,0|2,0,0]=4 1271 B10R1.30 CCc1cc(Cl)ccc1N Amb8455642 [2,0,0,0,0,0|2,0,0]=4 1272 B10R1.30 CCc1cc(Cl)ccc1S Amb27171206 [2,0,0,0,0,0|1,1,0]=4 1273 B10R1.30 CCc1cc(F)ccc1Br Amb26965508 [2,0,0,0,0,0|2,0,0]=4 1274 B10R1.30 CCc1cc(F)ccc1C Amb24394627 [2,0,0,0,0,0|2,0,0]=4 1275 B10R1.30 CCc1cc(F)ccc1Cl Amb25172157 [2,0,0,0,0,0|2,0,0]=4 1276 B10R1.30 CCc1cc(F)ccc1F Amb25826001 [2,0,0,0,0,0|2,0,0]=4 1277 B10R1.30 CCc1cc(F)ccc1I Amb25170491 [2,0,0,0,0,0|2,0,0]=4 1278 B10R1.30 CCc1cc(F)ccc1N Amb24681016 [2,0,0,0,0,0|2,0,0]=4 1279 B10R1.30 CCc1cc(F)ccc1O Amb2687860 [2,0,0,0,0,0|1,0,0]=3 1280 B10R1.30 CCc1cc(F)ccc1S Amb25716797 [2,0,0,0,0,0|1,1,0]=4 1281 B10R1.30 CCc1cc(I)ccc1Br Amb19944159 [2,0,0,0,0,0|2,0,0]=4 1282 B10R1.30 CCc1cc(I)ccc1C Amb27823243 [2,0,0,0,0,0|2,0,0]=4 1283 B10R1.30 CCc1cc(I)ccc1F Amb25329690 [2,0,0,0,0,0|2,0,0]=4 1284 B10R1.30 CCc1cc(I)ccc1N Amb22588122 [2,0,0,0,0,0|2,0,0]=4 1285 B10R1.30 CCc1cc(I)ccc1N Amb3671609 [2,0,0,0,0,0|2,0,0]=4 1286 B10R1.30 CCc1cc(I)ccc1O Amb27599772 [2,0,0,0,0,0|1,0,0]=3 1287 B10R1.30 CCc1cc(I)ccc1S Amb24368733 [2,0,0,0,0,0|1,1,0]=4 1288 B10R1.30 CCc1cc(N)ccc1Br Amb19889411 [2,0,0,0,0,0|2,0,0]=4 1289 B10R1.30 CCc1cc(N)ccc1C Amb20621237 [2,0,0,0,0,0|2,0,0]=4 1290 B10R1.30 CCc1cc(N)ccc1Cl Amb24710303 [2,0,0,0,0,0|2,0,0]=4 1291 B10R1.30 CCc1cc(N)ccc1F Amb25090985 [2,0,0,0,0,0|2,0,0]=4 1292 B10R1.30 CCc1cc(N)ccc1F Amb32652483 [2,0,0,0,0,0|2,0,0]=4 1293 B10R1.30 CCc1cc(N)ccc1N Amb26603530 [2,0,0,0,0,0|2,0,0]=4 1294 B10R1.30 CCc1cc(N)ccc1O Amb24126341 [2,0,0,0,0,0|1,0,0]=3 1295 B10R1.30 CCc1cc(N)ccc1S Amb25992689 [2,0,0,0,0,0|1,1,0]=4 1296 B10R1.30 CCc1cc(O)ccc1Br Amb22886723 [2,0,0,0,0,0|1,0,1]=4 1297 B10R1.30 CCc1cc(O)ccc1C Amb18124481 [2,0,0,0,0,0|1,0,1]=4 1298 B10R1.30 CCc1cc(O)ccc1Cl Amb3939152 [2,0,0,0,0,0|1,0,1]=4 1299 B10R1.30 CCc1cc(O)ccc1F Amb22229300 [2,0,0,0,0,0|1,0,1]=4 1300 B10R1.30 CCc1cc(O)ccc1N Amb18556011 [2,0,0,0,0,0|1,0,1]=4 1301 B10R1.30 CCc1cc(O)ccc1O Amb6365570 [2,0,0,0,0,0|0,0,1]=3 1302 B10R1.30 CCc1cc(O)ccc1S Amb25715223 [2,0,0,0,0,0|0,1,1]=4 1303 B10R1.30 CCc1cc(S)ccc1Br Amb25342158 [2,0,0,0,0,0|1,1,0]=4 1304 B10R1.30 CCc1cc(S)ccc1C Amb27764041 [2,0,0,0,0,0|1,1,0]=4 1305 B10R1.30 CCc1cc(S)ccc1Cl Amb25947472 [2,0,0,0,0,0|1,1,0]=4 1306 B10R1.30 CCc1cc(S)ccc1I Amb25776088 [2,0,0,0,0,0|1,1,0]=4 1307 B10R1.30 CCc1cc(S)ccc1N Amb25145668 [2,0,0,0,0,0|1,1,0]=4 1308 B10R1.30 CCc1cc(S)ccc1S Amb27867615 [2,0,0,0,0,0|0,2,0]=4 1309 B10R1.30 CCc1nc(Br)ccc1O Amb27406770 [2,0,0,0,0,0|2,0,0]=4 1310 B10R1.30 CCc1nc(C)ccc1O Amb616145 [2,0,0,0,0,0|1,0,1]=4 1311 B10R1.30 CCc1nc(C)ccc1O Amb6337517 [2,0,0,0,0,0|1,0,1]=4 1312 B10R1.30 CCc1nc(C)ccc1O Amb8469816 [2,0,0,0,0,0|1,0,1]=4 1313 B10R1.30 CCc1nc(Cl)ccc1O Amb27803665 [2,0,0,0,0,0|2,0,0]=4 1314 B10R1.30 CNc1cc(Br)ccc1O Amb25123781 [2,0,0,0,0,0|2,0,0]=4 1315 B10R1.30 CNc1cc(C)ccc1O Amb18054014 [2,0,0,0,0,0|1,0,1]=4 1316 B10R1.30 CNc1cc(Cl)ccc1O Amb18940927 [2,0,0,0,0,0|2,0,0]=4 1317 B10R1.30 CNc1cc(F)ccc1O Amb18057749 [2,0,0,0,0,0|2,0,0]=4 1318 B10R1.30 COC1=CC(=O)C=CC1=O Amb6296784 [2,0,0,0,0,0|0,0,1]=3 1319 B10R1.30 COC1=CC(=O)C=CN1C Amb27780836 [2,0,0,0,0,0|2,0,0]=4 1320 B10R1.30 COc1cc(Br)ccc1Br Amb19890937 [2,0,0,0,0,0|2,0,0]=4 1321 B10R1.30 COc1cc(Br)ccc1C Amb19958411 [2,0,0,0,0,0|2,0,0]=4 1322 B10R1.30 COc1cc(Br)ccc1Cl Amb4015845 [2,0,0,0,0,0|2,0,0]=4 1323 B10R1.30 COc1cc(Br)ccc1F Amb10605531 [2,0,0,0,0,0|2,0,0]=4 1324 B10R1.30 COc1cc(Br)ccc1I Amb19888022 [2,0,0,0,0,0|2,0,0]=4 1325 B10R1.30 COc1cc(Br)ccc1N Amb4021792 [2,0,0,0,0,0|2,0,0]=4 1326 B10R1.30 COc1cc(Br)ccc1O Amb2778777 [2,0,0,0,0,0|1,0,0]=3 1327 B10R1.30 COc1cc(Br)ccc1S Amb19887982 [2,0,0,0,0,0|1,1,0]=4 1328 B10R1.30 COc1cc(Br)ncc1O Amb26855456 [2,0,0,0,0,0|2,0,0]=4 1329 B10R1.30 COc1cc(C)ccc1Br Amb8385357 [2,0,0,0,0,0|1,0,1]=4 1330 B10R1.30 COc1cc(C)ccc1C Amb6297215 [2,0,0,0,0,0|1,0,1]=4 1331 B10R1.30 COc1cc(C)ccc1Cl Amb16191917 [2,0,0,0,0,0|1,0,1]=4 1332 B10R1.30 COc1cc(C)ccc1F Amb6296868 [2,0,0,0,0,0|1,0,1]=4 1333 B10R1.30 COc1cc(C)ccc1I Amb19888209 [2,0,0,0,0,0|1,0,1]=4 1334 B10R1.30 COc1cc(C)ccc1N Amb33545802 [2,0,0,0,0,0|1,0,1]=4 1335 B10R1.30 COc1cc(C)ccc1N Amb4303789 [2,0,0,0,0,0|1,0,1]=4 1336 B10R1.30 COc1cc(C)ccc1O Amb2721097 [2,0,0,0,0,0|0,0,1]=3 1337 B10R1.30 COc1cc(C)ncc1O Amb24726190 [2,0,0,0,0,0|1,0,1]=4 1338 B10R1.30 COc1cc(Cl)ccc1Br Amb6366097 [2,0,0,0,0,0|2,0,0]=4 1339 B10R1.30 COc1cc(Cl)ccc1C Amb9786789 [2,0,0,0,0,0|2,0,0]=4 1340 B10R1.30 COc1cc(Cl)ccc1Cl Amb6365648 [2,0,0,0,0,0|2,0,0]=4 1341 B10R1.30 COc1cc(Cl)ccc1I Amb19958758 [2,0,0,0,0,0|2,0,0]=4 1342 B10R1.30 COc1cc(Cl)ccc1N Amb2607777 [2,0,0,0,0,0|2,0,0]=4 1343 B10R1.30 COc1cc(Cl)ccc1N Amb8629181 [2,0,0,0,0,0|2,0,0]=4 1344 B10R1.30 COc1cc(Cl)ccc1O Amb3939206 [2,0,0,0,0,0|1,0,0]=3 1345 B10R1.30 COc1cc(Cl)ccc1S Amb27199189 [2,0,0,0,0,0|1,1,0]=4 1346 B10R1.30 COc1cc(Cl)ccc1[Mg+] Amb30589964 [2,0,0,0,0,0|2,0,0]=4 1347 B10R1.30 COc1cc(Cl)ncc1O Amb25889824 [2,0,0,0,0,0|2,0,0]=4 1348 B10R1.30 COc1cc(F)ccc1Br Amb2685178 [2,0,0,0,0,0|2,0,0]=4 1349 B10R1.30 COc1cc(F)ccc1C Amb10807371 [2,0,0,0,0,0|2,0,0]=4 1350 B10R1.30 COc1cc(F)ccc1Cl Amb6365643 [2,0,0,0,0,0|2,0,0]=4 1351 B10R1.30 COc1cc(F)ccc1F Amb2687041 [2,0,0,0,0,0|2,0,0]=4 1352 B10R1.30 COc1cc(F)ccc1I Amb27225839 [2,0,0,0,0,0|2,0,0]=4 1353 B10R1.30 COc1cc(F)ccc1N Amb10841411 [2,0,0,0,0,0|2,0,0]=4 1354 B10R1.30 COc1cc(F)ccc1N Amb1141067 [2,0,0,0,0,0|2,0,0]=4 1355 B10R1.30 COc1cc(F)ccc1O Amb3939617 [2,0,0,0,0,0|1,0,0]=3 1356 B10R1.30 COc1cc(F)ccc1S Amb24070252 [2,0,0,0,0,0|1,1,0]=4 1357 B10R1.30 COc1cc(F)cnc1O Amb26907883 [2,0,0,0,0,0|2,0,0]=4 1358 B10R1.30 COc1cc(F)ncc1O Amb24537942 [2,0,0,0,0,0|2,0,0]=4 1359 B10R1.30 COc1cc(I)ccc1Br Amb6298288 [2,0,0,0,0,0|2,0,0]=4 1360 B10R1.30 COc1cc(I)ccc1Cl Amb10071359 [2,0,0,0,0,0|2,0,0]=4 1361 B10R1.30 COc1cc(I)ccc1I Amb24321170 [2,0,0,0,0,0|2,0,0]=4 1362 B10R1.30 COc1cc(I)ccc1N Amb22002185 [2,0,0,0,0,0|2,0,0]=4 1363 B10R1.30 COc1cc(I)ccc1N Amb28555587 [2,0,0,0,0,0|2,0,0]=4 1364 B10R1.30 COc1cc(I)ccc1O Amb5717632 [2,0,0,0,0,0|1,0,0]=3 1365 B10R1.30 COc1cc(I)ccc1S Amb25213589 [2,0,0,0,0,0|1,1,0]=4 1366 B10R1.30 COc1cc(N)ccc1Br Amb6366098 [2,0,0,0,0,0|2,0,0]=4 1367 B10R1.30 COc1cc(N)ccc1C Amb33531678 [2,0,0,0,0,0|2,0,0]=4 1368 B10R1.30 COc1cc(N)ccc1Cl Amb10068702 [2,0,0,0,0,0|2,0,0]=4 1369 B10R1.30 COc1cc(N)ccc1F Amb10839685 [2,0,0,0,0,0|2,0,0]=4 1370 B10R1.30 COc1cc(N)ccc1F Amb3941090 [2,0,0,0,0,0|2,0,0]=4 1371 B10R1.30 COc1cc(N)ccc1I Amb10609996 [2,0,0,0,0,0|2,0,0]=4 1372 B10R1.30 COc1cc(N)ccc1I Amb10610092 [2,0,0,0,0,0|2,0,0]=4 1373 B10R1.30 COc1cc(N)ccc1I Amb9677499 [2,0,0,0,0,0|2,0,0]=4 1374 B10R1.30 COc1cc(N)ccc1N Amb16234089 [2,0,0,0,0,0|2,0,0]=4 1375 B10R1.30 COc1cc(N)ccc1N Amb17399832 [2,0,0,0,0,0|2,0,0]=4 1376 B10R1.30 COc1cc(N)ccc1O Amb17608136 [2,0,0,0,0,0|1,0,0]=3 1377 B10R1.30 COc1cc(N)ccc1O Amb6336157 [2,0,0,0,0,0|1,0,0]=3 1378 B10R1.30 COc1cc(N)ccc1S Amb20623558 [2,0,0,0,0,0|1,1,0]=4 1379 B10R1.30 COc1cc(O)ccc1Br Amb3941025 [2,0,0,0,0,0|1,0,1]=4 1380 B10R1.30 COc1cc(O)ccc1C Amb22229347 [2,0,0,0,0,0|1,0,1]=4 1381 B10R1.30 COc1cc(O)ccc1Cl Amb22169622 [2,0,0,0,0,0|1,0,1]=4 1382 B10R1.30 COc1cc(O)ccc1F Amb18643810 [2,0,0,0,0,0|1,0,1]=4 1383 B10R1.30 COc1cc(O)ccc1N Amb17739939 [2,0,0,0,0,0|1,0,1]=4 1384 B10R1.30 COc1cc(O)ccc1N Amb17740010 [2,0,0,0,0,0|1,0,1]=4 1385 B10R1.30 COc1cc(O)ccc1O Amb2725526 [2,0,0,0,0,0|0,0,1]=3 1386 B10R1.30 COc1cc(O)ccc1S Amb27653376 [2,0,0,0,0,0|0,1,1]=4 1387 B10R1.30 COc1cc(S)ccc1Br Amb19890685 [2,0,0,0,0,0|1,1,0]=4 1388 B10R1.30 COc1cc(S)ccc1C Amb26327939 [2,0,0,0,0,0|1,1,0]=4 1389 B10R1.30 COc1cc(S)ccc1Cl Amb26858791 [2,0,0,0,0,0|1,1,0]=4 1390 B10R1.30 COc1cc(S)ccc1F Amb27221665 [2,0,0,0,0,0|1,1,0]=4 1391 B10R1.30 COc1cc(S)ccc1I Amb24479273 [2,0,0,0,0,0|1,1,0]=4 1392 B10R1.30 COc1cc(S)ccc1N Amb27836155 [2,0,0,0,0,0|1,1,0]=4 1393 B10R1.30 COc1cc(S)ccc1O Amb18644820 [2,0,0,0,0,0|0,1,0]=3 1394 B10R1.30 COc1cc(S)ccc1S Amb26921113 [2,0,0,0,0,0|0,2,0]=4 1395 B10R1.30 COc1nc(Br)ccc1O Amb26876575 [2,0,0,0,0,0|2,0,0]=4 1396 B10R1.30 COc1nc(C)ccc1O Amb27945624 [2,0,0,0,0,0|1,0,1]=4 1397 B10R1.30 COc1nc(Cl)ccc1O Amb24606525 [2,0,0,0,0,0|2,0,0]=4 1398 B10R1.30 COc1nc(I)ccc1O Amb25248959 [2,0,0,0,0,0|2,0,0]=4 1399 B10R1.30 CSC1=CC(=O)C=CC1=O Amb24575921 [2,0,0,0,0,0|0,1,1]=4 1400 B10R1.30 CSc1cc(Br)ccc1O Amb24558581 [2,0,0,0,0,0|1,1,0]=4 1401 B10R1.30 CSc1cc(C)ccc1O Amb18644671 [2,0,0,0,0,0|0,1,1]=4 1402 B10R1.30 CSc1cc(F)ccc1O Amb18645013 [2,0,0,0,0,0|1,1,0]=4 1403 B10R1.30 CSc1cc(N)ccc1O Amb18644746 [2,0,0,0,0,0|1,1,0]=4 1404 B10R1.30 CSc1cc(O)ccc1O Amb27969922 [2,0,0,0,0,0|0,1,1]=4 1405 B10R1.30 Cc1ccc(O)c(CBr)c1 Amb24637779 [2,0,0,0,0,0|1,0,1]=4 1406 B10R1.30 Cc1ccc(O)c(CCl)c1 Amb24479174 [2,0,0,0,0,0|1,0,1]=4 1407 B10R1.30 Cc1ccc(O)c(CN)c1 Amb18552747 [2,0,0,0,0,0|1,0,1]=4 1408 B10R1.30 Cc1ccc(O)c(CN)c1 Amb32668326 [2,0,0,0,0,0|1,0,1]=4 1409 B10R1.30 Cc1ccc(O)c(CO)c1 Amb6297670 [2,0,0,0,0,0|1,0,1]=4 1410 B10R1.30 Cc1ccc(O)c(CS)c1 Amb32788774 [2,0,0,0,0,0|1,0,1]=4 1411 B10R1.30 NCc1cc(Br)ccc1O Amb24179182 [2,0,0,0,0,0|2,0,0]=4 1412 B10R1.30 NCc1cc(Br)ccc1O Amb33529460 [2,0,0,0,0,0|2,0,0]=4 1413 B10R1.30 NCc1cc(Cl)ccc1O Amb1120882 [2,0,0,0,0,0|2,0,0]=4 1414 B10R1.30 NCc1cc(Cl)ccc1O Amb13952105 [2,0,0,0,0,0|2,0,0]=4 1415 B10R1.30 NCc1cc(F)ccc1O Amb18555182 [2,0,0,0,0,0|2,0,0]=4 1416 B10R1.30 NCc1cc(F)ccc1O Amb21987752 [2,0,0,0,0,0|2,0,0]=4 1417 B10R1.30 NCc1cc(I)ccc1O Amb27629147 [2,0,0,0,0,0|2,0,0]=4 1418 B10R1.30 NCc1cc(N)ccc1O Amb18643250 [2,0,0,0,0,0|2,0,0]=4 1419 B10R1.30 NCc1cc(N)ccc1O Amb2698234 [2,0,0,0,0,0|2,0,0]=4 1420 B10R1.30 NCc1cc(O)ccc1O Amb24093484 [2,0,0,0,0,0|1,0,1]=4 1421 B10R1.30 NCc1cc(O)ccc1O Amb30359799 [2,0,0,0,0,0|1,0,1]=4 1422 B10R1.30 Nc1ccc(O)c(CO)c1 Amb3428011 [2,0,0,0,0,0|2,0,0]=4 1423 B10R1.30 O=C1C=CC(=O)C(CO)=C1 Amb24644906 [2,0,0,0,0,0|1,0,1]=4 1424 B10R1.30 OCc1cc(Br)ccc1O Amb1152514 [2,0,0,0,0,0|2,0,0]=4 1425 B10R1.30 OCc1cc(Cl)ccc1O Amb2686111 [2,0,0,0,0,0|2,0,0]=4 1426 B10R1.30 OCc1cc(F)ccc1O Amb8946253 [2,0,0,0,0,0|2,0,0]=4 1427 B10R1.30 OCc1cc(I)ccc1O Amb27614877 [2,0,0,0,0,0|2,0,0]=4 1428 B10R1.30 OCc1cc(O)ccc1O Amb16184173 [2,0,0,0,0,0|1,0,1]=4 1429 B10R1.30 Oc1ccc(Br)cc1CBr Amb25053502 [2,0,0,0,0,0|2,0,0]=4 1430 B10R1.30 Oc1ccc(Br)cc1CCl Amb25055240 [2,0,0,0,0,0|2,0,0]=4 1431 B10R1.30 Oc1ccc(Br)cc1CF Amb28435351 [2,0,0,0,0,0|2,0,0]=4 1432 B10R1.30 Oc1ccc(Br)cc1CS Amb32788550 [2,0,0,0,0,0|2,0,0]=4 1433 B10R1.30 Oc1ccc(Cl)cc1CBr Amb24738169 [2,0,0,0,0,0|2,0,0]=4 1434 B10R1.30 Oc1ccc(Cl)cc1CCl Amb26846091 [2,0,0,0,0,0|2,0,0]=4 1435 B10R1.30 Oc1ccc(Cl)cc1CS Amb18647875 [2,0,0,0,0,0|2,0,0]=4 1436 B10R1.30 Oc1ccc(F)cc1CBr Amb27152996 [2,0,0,0,0,0|2,0,0]=4 1437 B10R1.30 Oc1ccc(F)cc1CCl Amb26600917 [2,0,0,0,0,0|2,0,0]=4 1438 B10R1.30 Oc1ccc(F)cc1CS Amb32788543 [2,0,0,0,0,0|2,0,0]=4 1439 B10R1.30 Oc1ccc(O)c(CBr)c1 Amb26629736 [2,0,0,0,0,0|1,0,1]=4 1440 B10R1.30 Oc1ccc(O)c(CCl)c1 Amb27234643 [2,0,0,0,0,0|1,0,1]=4 1441 B10R1.30 Oc1ccc(O)c(CS)c1 Amb22388691 [2,0,0,0,0,0|1,0,1]=4 1442 B10R1.172 C#Cc1cccc(C=O)c1 Amb10070110 [2,0,0,0,0,0|0,0,2]=4 1443 B10R1.172 C#Cc1cccc(CC)c1 Amb19944514 [2,0,0,0,0,0|1,0,1]=4 1444 B10R1.172 C#Cc1cccc(OC)c1 Amb10071341 [2,0,0,0,0,0|1,0,1]=4 1445 B10R1.172 C=Cc1cc(CC)ccn1 Amb24478411 [2,0,0,0,0,0|2,0,0]=4 1446 B10R1.172 C=Cc1cc(OC)ccn1 Amb21857205 [2,0,0,0,0,0|2,0,0]=4 1447 B10R1.172 C=Cc1cccc(C=O)c1 Amb17593386 [2,0,0,0,0,0|0,0,2]=4 1448 B10R1.172 C=Cc1cccc(CBr)c1 Amb28239786 [2,0,0,0,0,0|2,0,0]=4 1449 B10R1.172 C=Cc1cccc(CC)c1 Amb24529283 [2,0,0,0,0,0|1,0,0]=3 1450 B10R1.172 C=Cc1cccc(CC)n1 Amb25335343 [2,0,0,0,0,0|2,0,0]=4 1451 B10R1.172 C=Cc1cccc(CO)c1 Amb24405968 [2,0,0,0,0,0|2,0,0]=4 1452 B10R1.172 C=Cc1cccc(OC)c1 Amb21962858 [2,0,0,0,0,0|1,0,0]=3 1453 B10R1.172 C=Cc1cccc(OC)n1 Amb20621538 [2,0,0,0,0,0|2,0,0]=4 1454 B10R1.172 C=Cc1cccc(SC)c1 Amb33148833 [2,0,0,0,0,0|1,1,0]=4 1455 B10R1.172 C=Cc1ccnc(CC)c1 Amb25710283 [2,0,0,0,0,0|2,0,0]=4 1456 B10R1.172 C=Cc1ccnc(OC)c1 Amb20247859 [2,0,0,0,0,0|2,0,0]=4 1457 B10R1.172 C=Cc1cncc(CC)c1 Amb28182642 [2,0,0,0,0,0|2,0,0]=4 1458 B10R1.172 C=Cc1cncc(OC)c1 Amb27975411 [2,0,0,0,0,0|2,0,0]=4 1459 B10R1.172 CCc1cc(C=O)ccn1 Amb26556373 [2,0,0,0,0,0|1,0,0]=3 1460 B10R1.172 CCc1cccc(C#N)c1 Amb4477450 [2,0,0,0,0,0|1,0,1]=4 1461 B10R1.172 CCc1cccc(C=O)c1 Amb16231764 [2,0,0,0,0,0|0,0,0]=2 1462 B10R1.172 CCc1cccc(C=O)n1 Amb18643004 [2,0,0,0,0,0|1,0,0]=3 1463 B10R1.172 CCc1cccc(CBr)c1 Amb25736273 [2,0,0,0,0,0|1,0,1]=4 1464 B10R1.172 CCc1cccc(CCl)c1 Amb24480579 [2,0,0,0,0,0|1,0,1]=4 1465 B10R1.172 CCc1cccc(CN)c1 Amb25187733 [2,0,0,0,0,0|1,0,1]=4 1466 B10R1.172 CCc1cccc(CN)c1 Amb32664781 [2,0,0,0,0,0|1,0,1]=4 1467 B10R1.172 CCc1cccc(CO)c1 Amb22497287 [2,0,0,0,0,0|0,0,2]=4 1468 B10R1.172 CCc1cccc(CS)c1 Amb32874571 [2,0,0,0,0,0|0,1,1]=4 1469 B10R1.172 CCc1cccc(NC)c1 Amb32663330 [2,0,0,0,0,0|2,0,0]=4 1470 B10R1.172 CCc1cccc(NC)c1 Amb33526958 [2,0,0,0,0,0|2,0,0]=4 1471 B10R1.172 CCc1cccc(NN)c1 Amb6249172 [2,0,0,0,0,0|2,0,0]=4 1472 B10R1.172 CCc1cccc(OC)c1 Amb4035879 [2,0,0,0,0,0|1,0,1]=4 1473 B10R1.172 CCc1cccc(ON)c1 Amb25244767 [2,0,0,0,0,0|2,0,0]=4 1474 B10R1.172 CCc1cccc(SC)c1 Amb27627382 [2,0,0,0,0,0|2,0,0]=4 1475 B10R1.172 CCc1cccc([Mg]Br)c1 Amb7101527 [2,0,0,0,0,0|2,0,0]=4 1476 B10R1.172 CCc1ccnc(C=O)c1 Amb25114155 [2,0,0,0,0,0|1,0,0]=3 1477 B10R1.172 CCc1ccnc(C=O)n1 Amb27437929 [2,0,0,0,0,0|2,0,0]=4 1478 B10R1.172 CCc1cncc(C=O)c1 Amb18832506 [2,0,0,0,0,0|1,0,0]=3 1479 B10R1.172 CCc1nccc(C=O)n1 Amb10608187 [2,0,0,0,0,0|2,0,0]=4 1480 B10R1.172 CNc1cccc(C=O)c1 Amb10571863 [2,0,0,0,0,0|1,0,0]=3 1481 B10R1.172 CNc1cccc(OC)c1 Amb22274077 [2,0,0,0,0,0|2,0,0]=4 1482 B10R1.172 CNc1cccc(OC)c1 Amb6713925 [2,0,0,0,0,0|2,0,0]=4 1483 B10R1.172 COC1=CC=CC(C=O)N1 Amb27469491 [2,0,0,0,0,0|1,0,1]=4 1484 B10R1.172 COc1cc(C=O)ccn1 Amb8010894 [2,0,0,0,0,0|1,0,0]=3 1485 B10R1.172 COc1cc(C=O)ncn1 Amb27476419 [2,0,0,0,0,0|2,0,0]=4 1486 B10R1.172 COc1cccc(C#N)c1 Amb1209415 [2,0,0,0,0,0|1,0,1]=4 1487 B10R1.172 COc1cccc(C=O)c1 Amb2792765 [2,0,0,0,0,0|0,0,0]=2 1488 B10R1.172 COc1cccc(C=O)n1 Amb8010839 [2,0,0,0,0,0|1,0,0]=3 1489 B10R1.172 COc1cccc(CBr)c1 Amb3939737 [2,0,0,0,0,0|1,0,1]=4 1490 B10R1.172 COc1cccc(CCl)c1 Amb1677622 [2,0,0,0,0,0|1,0,1]=4 1491 B10R1.172 COc1cccc(CI)c1 Amb27184036 [2,0,0,0,0,0|1,0,1]=4 1492 B10R1.172 COc1cccc(CN)c1 Amb1212559 [2,0,0,0,0,0|1,0,1]=4 1493 B10R1.172 COc1cccc(CO)c1 Amb1215247 [2,0,0,0,0,0|0,0,2]=4 1494 B10R1.172 COc1cccc(CS)c1 Amb6255516 [2,0,0,0,0,0|0,1,1]=4 1495 B10R1.172 COc1cccc(NN)c1 Amb22489461 [2,0,0,0,0,0|2,0,0]=4 1496 B10R1.172 COc1cccc(NN)c1 Amb33141033 [2,0,0,0,0,0|2,0,0]=4 1497 B10R1.172 COc1cccc(NN)c1 Amb439872 [2,0,0,0,0,0|2,0,0]=4 1498 B10R1.172 COc1cccc(NN)c1 Amb6662802 [2,0,0,0,0,0|2,0,0]=4 1499 B10R1.172 COc1cccc(OC)c1 Amb6296064 [2,0,0,0,0,0|2,0,0]=4 1500 B10R1.172 COc1cccc(SC)c1 Amb2689280 [2,0,0,0,0,0|2,0,0]=4 1501 B10R1.172 COc1cccc([Mg]Br)c1 Amb22000522 [2,0,0,0,0,0|2,0,0]=4 1502 B10R1.172 COc1cccc([Zn]I)c1 Amb6300186 [2,0,0,0,0,0|2,0,0]=4 1503 B10R1.172 COc1ccnc(C=O)c1 Amb18643123 [2,0,0,0,0,0|1,0,0]=3 1504 B10R1.172 COc1ccnc(C=O)n1 Amb22492001 [2,0,0,0,0,0|2,0,0]=4 1505 B10R1.172 COc1cncc(C=O)c1 Amb33546870 [2,0,0,0,0,0|1,0,0]=3 1506 B10R1.172 COc1cncc(C=O)n1 Amb24537941 [2,0,0,0,0,0|2,0,0]=4 1507 B10R1.172 COc1nccc(C=O)n1 Amb19957790 [2,0,0,0,0,0|2,0,0]=4 1508 B10R1.172 CSc1cccc(C=O)c1 Amb10607360 [2,0,0,0,0,0|0,1,0]=3 1509 B10R1.172 CSc1cccc(C=O)n1 Amb24480540 [2,0,0,0,0,0|1,1,0]=4 1510 B10R1.172 CSc1cncc(C=O)c1 Amb27789033 [2,0,0,0,0,0|1,1,0]=4 1511 B10R1.172 N#Cc1cccc(C=O)c1 Amb2686567 [2,0,0,0,0,0|1,0,1]=4 1512 B10R1.172 NCc1cccc(C=O)c1 Amb25255250 [2,0,0,0,0,0|1,0,0]=3 1513 B10R1.172 NCc1cccc(C=O)c1 Amb33734629 [2,0,0,0,0,0|1,0,0]=3 1514 B10R1.172 NCc1cccc(C=O)n1 Amb25771857 [2,0,0,0,0,0|2,0,0]=4 1515 B10R1.172 NCc1ccnc(C=O)c1 Amb27636014 [2,0,0,0,0,0|2,0,0]=4 1516 B10R1.172 NNc1cccc(C=O)c1 Amb25952039 [2,0,0,0,0,0|2,0,0]=4 1517 B10R1.172 O=Cc1cc(CF)ccn1 Amb27793718 [2,0,0,0,0,0|2,0,0]=4 1518 B10R1.172 O=Cc1cc(CO)ccn1 Amb22728305 [2,0,0,0,0,0|2,0,0]=4 1519 B10R1.172 O=Cc1cccc(C=O)c1 Amb6891969 [2,0,0,0,0,0|1,0,1]=4 1520 B10R1.172 O=Cc1cccc(CBr)c1 Amb2724987 [2,0,0,0,0,0|1,0,0]=3 1521 B10R1.172 O=Cc1cccc(CCl)c1 Amb26555106 [2,0,0,0,0,0|1,0,0]=3 1522 B10R1.172 O=Cc1cccc(CF)c1 Amb26010625 [2,0,0,0,0,0|1,0,0]=3 1523 B10R1.172 O=Cc1cccc(CF)n1 Amb20621303 [2,0,0,0,0,0|2,0,0]=4 1524 B10R1.172 O=Cc1cccc(CO)c1 Amb6298249 [2,0,0,0,0,0|1,0,0]=3 1525 B10R1.172 O=Cc1cccc(CO)n1 Amb8010600 [2,0,0,0,0,0|2,0,0]=4 1526 B10R1.172 O=Cc1cccc(N=O)c1 Amb17593427 [2,0,0,0,0,0|2,0,0]=4 1527 B10R1.172 O=Cc1cccc(NO)c1 Amb28047724 [2,0,0,0,0,0|2,0,0]=4 1528 B10R1.172 O=Cc1ccnc(CF)c1 Amb24527580 [2,0,0,0,0,0|2,0,0]=4 1529 B10R1.172 O=Cc1ccnc(CO)c1 Amb25286725 [2,0,0,0,0,0|2,0,0]=4 1530 B10R1.172 O=Cc1cncc(CCl)c1 Amb27249624 [2,0,0,0,0,0|2,0,0]=4 1531 B10R1.172 [C-]#[N+]c1cccc(CC)c1 Amb25836867 [2,0,0,0,0,0|2,0,0]=4 1532 B10R1.172 [C-]#[N+]c1cccc(OC)c1 Amb2234454 [2,0,0,0,0,0|2,0,0]=4 1533 B10R1.176 C#Cc1ccc(O)c(O)c1 Amb24079174 [2,0,0,0,0,0|1,0,1]=4 1534 B10R1.176 C=Cc1cc(C)c(O)cn1 Amb26888850 [2,0,0,0,0,0|2,0,0]=4 1535 B10R1.176 C=Cc1ccc(Br)c(C)c1 Amb26556463 [2,0,0,0,0,0|2,0,0]=4 1536 B10R1.176 C=Cc1ccc(C)c(C)c1 Amb24749575 [2,0,0,0,0,0|2,0,0]=4 1537 B10R1.176 C=Cc1ccc(C)c(O)c1 Amb28401574 [2,0,0,0,0,0|2,0,0]=4 1538 B10R1.176 C=Cc1ccc(Cl)c(C)c1 Amb25857536 [2,0,0,0,0,0|2,0,0]=4 1539 B10R1.176 C=Cc1ccc(F)c(C)c1 Amb24408128 [2,0,0,0,0,0|2,0,0]=4 1540 B10R1.176 C=Cc1ccc(O)c(Br)c1 Amb33388574 [2,0,0,0,0,0|2,0,0]=4 1541 B10R1.176 C=Cc1ccc(O)c(C)n1 Amb24402281 [2,0,0,0,0,0|2,0,0]=4 1542 B10R1.176 C=Cc1ccc(O)c(Cl)c1 Amb24104203 [2,0,0,0,0,0|2,0,0]=4 1543 B10R1.176 C=Cc1ccc(O)c(F)c1 Amb26653938 [2,0,0,0,0,0|2,0,0]=4 1544 B10R1.176 C=Cc1cnc(O)c(O)c1 Amb26357432 [2,0,0,0,0,0|2,0,0]=4 1545 B10R1.176 CC1=CC(C=O)=CNC1=S Amb23446850 [2,0,0,0,0,0|1,1,0]=4 1546 B10R1.176 CCc1ccc(O)c(C)c1 Amb18643084 [2,0,0,0,0,0|1,0,1]=4 1547 B10R1.176 CCc1ccc(O)c(O)c1 Amb6296662 [2,0,0,0,0,0|1,0,1]=4 1548 B10R1.176 CN1C=C(C=O)C=CC1=O Amb18643126 [2,0,0,0,0,0|1,0,1]=4 1549 B10R1.176 CNc1ccc(O)c(C)c1 Amb24079685 [2,0,0,0,0,0|2,0,0]=4 1550 B10R1.176 COc1ccc(O)c(C)c1 Amb16231155 [2,0,0,0,0,0|2,0,0]=4 1551 B10R1.176 COc1ccc(O)c(O)c1 Amb18554833 [2,0,0,0,0,0|2,0,0]=4 1552 B10R1.176 CSc1ccc(O)c(C)c1 Amb3941011 [2,0,0,0,0,0|2,0,0]=4 1553 B10R1.176 CSc1ccc(O)c(O)c1 Amb26062124 [2,0,0,0,0,0|2,0,0]=4 1554 B10R1.176 Cc1cc(C#N)ccc1O Amb13952425 [2,0,0,0,0,0|1,0,1]=4 1555 B10R1.176 Cc1cc(C=O)ccc1Br Amb17337376 [2,0,0,0,0,0|1,0,0]=3 1556 B10R1.176 Cc1cc(C=O)ccc1Cl Amb2686186 [2,0,0,0,0,0|1,0,0]=3 1557 B10R1.176 Cc1cc(C=O)ccc1F Amb2447643 [2,0,0,0,0,0|1,0,0]=3 1558 B10R1.176 Cc1cc(C=O)ccc1I Amb28315672 [2,0,0,0,0,0|1,0,0]=3 1559 B10R1.176 Cc1cc(C=O)ccc1O Amb3939955 [2,0,0,0,0,0|0,0,0]=2 1560 B10R1.176 Cc1cc(C=O)ccc1S Amb27433713 [2,0,0,0,0,0|0,1,0]=3 1561 B10R1.176 Cc1cc(C=O)cnc1Br Amb19959260 [2,0,0,0,0,0|2,0,0]=4 1562 B10R1.176 Cc1cc(C=O)cnc1C Amb22491621 [2,0,0,0,0,0|2,0,0]=4 1563 B10R1.176 Cc1cc(C=O)cnc1Cl Amb10975414 [2,0,0,0,0,0|2,0,0]=4 1564 B10R1.176 Cc1cc(C=O)cnc1F Amb13890583 [2,0,0,0,0,0|2,0,0]=4 1565 B10R1.176 Cc1cc(C=O)cnc1O Amb22411455 [2,0,0,0,0,0|1,0,0]=3 1566 B10R1.176 Cc1cc(C=O)ncc1Br Amb21963620 [2,0,0,0,0,0|2,0,0]=4 1567 B10R1.176 Cc1cc(C=O)ncc1Cl Amb22489905 [2,0,0,0,0,0|2,0,0]=4 1568 B10R1.176 Cc1cc(C=O)ncc1F Amb27476853 [2,0,0,0,0,0|2,0,0]=4 1569 B10R1.176 Cc1cc(C=O)ncc1N Amb18832460 [2,0,0,0,0,0|2,0,0]=4 1570 B10R1.176 Cc1cc(C=O)ncc1O Amb26539701 [2,0,0,0,0,0|1,0,0]=3 1571 B10R1.176 Cc1cc(CBr)ccc1O Amb26938268 [2,0,0,0,0,0|1,0,1]=4 1572 B10R1.176 Cc1cc(CCl)ccc1O Amb26481292 [2,0,0,0,0,0|1,0,1]=4 1573 B10R1.176 Cc1cc(CN)ccc1O Amb18944098 [2,0,0,0,0,0|1,0,1]=4 1574 B10R1.176 Cc1cc(CN)ccc1O Amb33465347 [2,0,0,0,0,0|1,0,1]=4 1575 B10R1.176 Cc1cc(CO)ccc1O Amb6298428 [2,0,0,0,0,0|0,0,2]=4 1576 B10R1.176 Cc1cc(N=O)ccc1O Amb4034439 [2,0,0,0,0,0|1,0,0]=3 1577 B10R1.176 Cc1cc(NN)ccc1O Amb26994035 [2,0,0,0,0,0|2,0,0]=4 1578 B10R1.176 Cc1cc([N+]#N)ccc1O Amb27409609 [2,0,0,0,0,0|2,0,0]=4 1579 B10R1.176 Cc1ccc(C=O)cc1Br Amb837237 [2,0,0,0,0,0|2,0,0]=4 1580 B10R1.176 Cc1ccc(C=O)cc1C Amb2726166 [2,0,0,0,0,0|1,0,0]=3 1581 B10R1.176 Cc1ccc(C=O)cc1Cl Amb6306223 [2,0,0,0,0,0|2,0,0]=4 1582 B10R1.176 Cc1ccc(C=O)cc1F Amb2688178 [2,0,0,0,0,0|2,0,0]=4 1583 B10R1.176 Cc1ccc(C=O)cc1N Amb18832504 [2,0,0,0,0,0|2,0,0]=4 1584 B10R1.176 Cc1ccc(C=O)cc1O Amb6298096 [2,0,0,0,0,0|1,0,0]=3 1585 B10R1.176 Cc1ccc(C=O)nc1C Amb23454934 [2,0,0,0,0,0|2,0,0]=4 1586 B10R1.176 Cc1ccc(C=O)nc1O Amb26895032 [2,0,0,0,0,0|2,0,0]=4 1587 B10R1.176 Cc1ccc(N=O)cc1O Amb24478299 [2,0,0,0,0,0|2,0,0]=4 1588 B10R1.176 Cc1nc(C=O)ccc1Br Amb21864702 [2,0,0,0,0,0|2,0,0]=4 1589 B10R1.176 Cc1nc(C=O)ccc1F Amb20671022 [2,0,0,0,0,0|2,0,0]=4 1590 B10R1.176 Cc1nc(C=O)ccc1N Amb27617075 [2,0,0,0,0,0|2,0,0]=4 1591 B10R1.176 Cc1nc(C=O)ccc1O Amb27191865 [2,0,0,0,0,0|1,0,0]=3 1592 B10R1.176 Cc1ncc(C=O)cc1O Amb18643113 [2,0,0,0,0,0|2,0,0]=4 1593 B10R1.176 N#Cc1ccc(O)c(O)c1 Amb2721313 [2,0,0,0,0,0|1,0,1]=4 1594 B10R1.176 NCc1ccc(O)c(O)c1 Amb1120981 [2,0,0,0,0,0|1,0,1]=4 1595 B10R1.176 NCc1ccc(O)c(O)c1 Amb33549968 [2,0,0,0,0,0|1,0,1]=4 1596 B10R1.176 NCc1ccc(O)c(O)c1 Amb4037111 [2,0,0,0,0,0|1,0,1]=4 1597 B10R1.176 NNc1ccc(O)c(O)c1 Amb26569814 [2,0,0,0,0,0|2,0,0]=4 1598 B10R1.176 Nc1cc(C=O)ccc1Br Amb18187525 [2,0,0,0,0,0|2,0,0]=4 1599 B10R1.176 Nc1cc(C=O)ccc1Cl Amb18830817 [2,0,0,0,0,0|2,0,0]=4 1600 B10R1.176 Nc1cc(C=O)ccc1F Amb8396794 [2,0,0,0,0,0|2,0,0]=4 1601 B10R1.176 Nc1cc(C=O)ccc1I Amb28315752 [2,0,0,0,0,0|2,0,0]=4 1602 B10R1.176 Nc1cc(C=O)ccc1O Amb17208089 [2,0,0,0,0,0|1,0,0]=3 1603 B10R1.176 Nc1cc(C=O)ccc1O Amb24117570 [2,0,0,0,0,0|1,0,0]=3 1604 B10R1.176 Nc1ccc(C=O)cc1Br Amb22753557 [2,0,0,0,0,0|2,0,0]=4 1605 B10R1.176 Nc1ccc(C=O)cc1Cl Amb22059450 [2,0,0,0,0,0|2,0,0]=4 1606 B10R1.176 Nc1ccc(C=O)cc1I Amb28252269 [2,0,0,0,0,0|2,0,0]=4 1607 B10R1.176 Nc1ccc(C=O)cc1O Amb18832405 [2,0,0,0,0,0|1,0,0]=3 1608 B10R1.176 Nc1ccc(C=O)cc1S Amb32671569 [2,0,0,0,0,0|1,1,0]=4 1609 B10R1.176 O=CC1=CC(=O)C(O)=CN1 Amb18643356 [2,0,0,0,0,0|1,0,1]=4 1610 B10R1.176 O=CC1=CC(=O)C(O)=CO1 Amb24309090 [2,0,0,0,0,0|1,0,1]=4 1611 B10R1.176 O=Cc1cc(Br)c(O)cn1 Amb28203630 [2,0,0,0,0,0|2,0,0]=4 1612 B10R1.176 O=Cc1cc(F)c(O)cn1 Amb25842870 [2,0,0,0,0,0|2,0,0]=4 1613 B10R1.176 O=Cc1cc(O)c(F)cn1 Amb25889969 [2,0,0,0,0,0|2,0,0]=4 1614 B10R1.176 O=Cc1ccc(Br)c(Br)c1 Amb3939907 [2,0,0,0,0,0|2,0,0]=4 1615 B10R1.176 O=Cc1ccc(Br)c(Cl)c1 Amb19889375 [2,0,0,0,0,0|2,0,0]=4 1616 B10R1.176 O=Cc1ccc(Br)c(F)c1 Amb8397115 [2,0,0,0,0,0|2,0,0]=4 1617 B10R1.176 O=Cc1ccc(Br)c(I)c1 Amb19889874 [2,0,0,0,0,0|2,0,0]=4 1618 B10R1.176 O=Cc1ccc(Br)c(O)c1 Amb18810383 [2,0,0,0,0,0|1,0,0]=3 1619 B10R1.176 O=Cc1ccc(Br)c(O)n1 Amb27640994 [2,0,0,0,0,0|2,0,0]=4 1620 B10R1.176 O=Cc1ccc(Cl)c(Br)c1 Amb8397295 [2,0,0,0,0,0|2,0,0]=4 1621 B10R1.176 O=Cc1ccc(Cl)c(Cl)c1 Amb17731352 [2,0,0,0,0,0|2,0,0]=4 1622 B10R1.176 O=Cc1ccc(Cl)c(F)c1 Amb2685931 [2,0,0,0,0,0|2,0,0]=4 1623 B10R1.176 O=Cc1ccc(Cl)c(I)c1 Amb5722301 [2,0,0,0,0,0|2,0,0]=4 1624 B10R1.176 O=Cc1ccc(Cl)c(O)c1 Amb18644874 [2,0,0,0,0,0|1,0,0]=3 1625 B10R1.176 O=Cc1ccc(Cl)c(O)n1 Amb27950393 [2,0,0,0,0,0|2,0,0]=4 1626 B10R1.176 O=Cc1ccc(F)c(Br)c1 Amb535691 [2,0,0,0,0,0|2,0,0]=4 1627 B10R1.176 O=Cc1ccc(F)c(Cl)c1 Amb2404868 [2,0,0,0,0,0|2,0,0]=4 1628 B10R1.176 O=Cc1ccc(F)c(F)c1 Amb2404872 [2,0,0,0,0,0|2,0,0]=4 1629 B10R1.176 O=Cc1ccc(F)c(I)c1 Amb9677796 [2,0,0,0,0,0|2,0,0]=4 1630 B10R1.176 O=Cc1ccc(F)c(O)c1 Amb10067009 [2,0,0,0,0,0|1,0,0]=3 1631 B10R1.176 O=Cc1ccc(F)c(O)n1 Amb25238571 [2,0,0,0,0,0|2,0,0]=4 1632 B10R1.176 O=Cc1ccc(I)c(Br)c1 Amb24057222 [2,0,0,0,0,0|2,0,0]=4 1633 B10R1.176 O=Cc1ccc(I)c(F)c1 Amb10603693 [2,0,0,0,0,0|2,0,0]=4 1634 B10R1.176 O=Cc1ccc(I)c(I)c1 Amb24099136 [2,0,0,0,0,0|2,0,0]=4 1635 B10R1.176 O=Cc1ccc(I)c(O)c1 Amb2722896 [2,0,0,0,0,0|1,0,0]=3 1636 B10R1.176 O=Cc1ccc(O)c(Br)c1 Amb1209778 [2,0,0,0,0,0|1,0,0]=3 1637 B10R1.176 O=Cc1ccc(O)c(Br)n1 Amb25271861 [2,0,0,0,0,0|2,0,0]=4 1638 B10R1.176 O=Cc1ccc(O)c(Cl)c1 Amb1056376 [2,0,0,0,0,0|1,0,0]=3 1639 B10R1.176 O=Cc1ccc(O)c(Cl)n1 Amb18830522 [2,0,0,0,0,0|2,0,0]=4 1640 B10R1.176 O=Cc1ccc(O)c(F)c1 Amb2688105 [2,0,0,0,0,0|1,0,0]=3 1641 B10R1.176 O=Cc1ccc(O)c(F)n1 Amb25299189 [2,0,0,0,0,0|2,0,0]=4 1642 B10R1.176 O=Cc1ccc(O)c(I)c1 Amb1794205 [2,0,0,0,0,0|1,0,0]=3 1643 B10R1.176 O=Cc1ccc(O)c(O)c1 Amb1209685 [2,0,0,0,0,0|0,0,0]=2 1644 B10R1.176 O=Cc1ccc(O)c(O)n1 Amb28196603 [2,0,0,0,0,0|1,0,0]=3 1645 B10R1.176 O=Cc1ccc(S)c(Br)c1 Amb27424793 [2,0,0,0,0,0|1,1,0]=4 1646 B10R1.176 O=Cc1ccc(S)c(F)c1 Amb25094350 [2,0,0,0,0,0|1,1,0]=4 1647 B10R1.176 O=Cc1cnc(Br)c(O)c1 Amb25700464 [2,0,0,0,0,0|2,0,0]=4 1648 B10R1.176 O=Cc1cnc(Cl)c(O)c1 Amb25264655 [2,0,0,0,0,0|2,0,0]=4 1649 B10R1.176 O=Cc1cnc(F)c(O)c1 Amb27201292 [2,0,0,0,0,0|2,0,0]=4 1650 B10R1.176 OCc1ccc(O)c(O)c1 Amb6296856 [2,0,0,0,0,0|0,0,2]=4 1651 B10R1.176 Oc1ccc(CBr)cc1O Amb26894887 [2,0,0,0,0,0|1,0,1]=4 1652 B10R1.176 Oc1ccc(CCl)cc1O Amb33256463 [2,0,0,0,0,0|1,0,1]=4 1653 B10R1.176 Oc1ccc(CS)cc1O Amb32788781 [2,0,0,0,0,0|0,1,1]=4 1654 B12R1.40 CCCC1=CC(=O)C=C(C)C1=O Amb27176123 [1,1,0,0,0,0|1,0,1]=4 1655 B12R1.40 CCCc1cc(C)cc(C)c1O Amb27802585 [1,1,0,0,0,0|1,0,1]=4 1656 B12R1.40 CCCc1cc(C)cc(N)c1O Amb28245435 [1,1,0,0,0,0|1,0,1]=4 1657 B12R1.40 CCNc1cc(C)cc(C)c1O Amb18057367 [1,1,0,0,0,0|1,0,1]=4 1658 B12R1.40 CCOC1=CC(=O)C=C(C)C1=O Amb27208833 [1,1,0,0,0,0|0,0,1]=3 1659 B12R1.40 CCOc1cc(Br)cc(Br)c1F Amb19893282 [1,1,0,0,0,0|2,0,0]=4 1660 B12R1.40 CCOc1cc(Br)cc(F)c1F Amb10067188 [1,1,0,0,0,0|2,0,0]=4 1661 B12R1.40 CCOc1cc(Br)cc(F)c1O Amb27482134 [1,1,0,0,0,0|1,0,0]=3 1662 B12R1.40 CCOc1cc(Br)cc(O)c1F Amb26849237 [1,1,0,0,0,0|2,0,0]=4 1663 B12R1.40 CCOc1cc(C)cc(C)c1F Amb27441418 [1,1,0,0,0,0|1,0,1]=4 1664 B12R1.40 CCOc1cc(C)cc(C)c1O Amb24727581 [1,1,0,0,0,0|0,0,1]=3 1665 B12R1.40 CCOc1cc(C)cc(Cl)c1F Amb24595988 [1,1,0,0,0,0|1,0,1]=4 1666 B12R1.40 CCOc1cc(C)cc(F)c1C Amb26424020 [1,1,0,0,0,0|1,0,1]=4 1667 B12R1.40 CCOc1cc(C)cc(F)c1Cl Amb28077313 [1,1,0,0,0,0|1,0,1]=4 1668 B12R1.40 CCOc1cc(C)cc(O)c1C Amb6601581 [1,1,0,0,0,0|1,0,1]=4 1669 B12R1.40 CCOc1cc(Cl)cc(C)c1Cl Amb26557540 [1,1,0,0,0,0|2,0,0]=4 1670 B12R1.40 CCOc1cc(Cl)cc(C)c1F Amb27804158 [1,1,0,0,0,0|2,0,0]=4 1671 B12R1.40 CCOc1cc(Cl)cc(Cl)c1C Amb26568093 [1,1,0,0,0,0|2,0,0]=4 1672 B12R1.40 CCOc1cc(Cl)cc(F)c1C Amb27861035 [1,1,0,0,0,0|2,0,0]=4 1673 B12R1.40 CCOc1cc(Cl)cc(F)c1Cl Amb27636682 [1,1,0,0,0,0|2,0,0]=4 1674 B12R1.40 CCOc1cc(Cl)cc(O)c1Cl Amb27215553 [1,1,0,0,0,0|2,0,0]=4 1675 B12R1.40 CCOc1cc(F)cc(Br)c1Br Amb25238455 [1,1,0,0,0,0|2,0,0]=4 1676 B12R1.40 CCOc1cc(F)cc(Br)c1O Amb26526746 [1,1,0,0,0,0|1,0,0]=3 1677 B12R1.40 CCOc1cc(F)cc(C)c1C Amb26905729 [1,1,0,0,0,0|2,0,0]=4 1678 B12R1.40 CCOc1cc(F)cc(Cl)c1C Amb25212341 [1,1,0,0,0,0|2,0,0]=4 1679 B12R1.40 CCOc1cc(F)cc(Cl)c1F Amb28287004 [1,1,0,0,0,0|2,0,0]=4 1680 B12R1.40 CCOc1cc(F)cc(F)c1C Amb26915091 [1,1,0,0,0,0|2,0,0]=4 1681 B12R1.40 CCOc1cc(F)cc(F)c1N Amb26059893 [1,1,0,0,0,0|2,0,0]=4 1682 B12R1.40 CCOc1cc(F)cc(I)c1I Amb27844424 [1,1,0,0,0,0|2,0,0]=4 1683 B12R1.40 CCOc1cc(F)cc(O)c1Br Amb27238987 [1,1,0,0,0,0|2,0,0]=4 1684 B12R1.40 CCOc1cc(I)cc(F)c1I Amb27882160 [1,1,0,0,0,0|2,0,0]=4 1685 B12R1.40 CCOc1cc(N)cc(Br)c1O Amb23491321 [1,1,0,0,0,0|1,0,0]=3 1686 B12R1.40 CCOc1cc(N)cc(Cl)c1O Amb23491315 [1,1,0,0,0,0|1,0,0]=3 1687 B12R1.40 CCOc1cc(O)cc(Br)c1O Amb33434593 [1,1,0,0,0,0|0,0,1]=3 1688 B12R1.40 CCOc1cc(O)cc(C)c1C Amb27665861 [1,1,0,0,0,0|1,0,1]=4 1689 B12R1.40 CCOc1cc(O)cc(F)c1Br Amb25804297 [1,1,0,0,0,0|1,0,1]=4 1690 B12R1.40 CCOc1cc(O)cc(I)c1I Amb27844496 [1,1,0,0,0,0|1,0,1]=4 1691 B12R1.40 CCOc1cc(S)cc(Br)c1O Amb33434938 [1,1,0,0,0,0|0,1,0]=3 1692 B12R1.40 CCOc1cc(S)cc(F)c1F Amb26053639 [1,1,0,0,0,0|1,1,0]=4 1693 B12R1.40 Cc1cc(C)c(O)c(OCF)c1 Amb27967684 [1,1,0,0,0,0|1,0,1]=4 1694 B12R1.40 Oc1c(Br)cc(F)cc1OCF Amb25249535 [1,1,0,0,0,0|2,0,0]=4 1695 B12R1.127 CC(=O)OC1=CC(=O)C=CC1=N Amb28202322 [1,1,0,0,0,0|1,0,1]=4 1696 B12R1.127 CC(Br)Cc1cc(Cl)ccc1O Amb33477192 [1,1,0,0,0,0|2,0,0]=4 1697 B12R1.127 CC(Br)Cc1cc(F)ccc1O Amb33387870 [1,1,0,0,0,0|2,0,0]=4 1698 B12R1.127 CC(Br)Cc1cc(O)ccc1O Amb33009399 [1,1,0,0,0,0|1,0,1]=4 1699 B12R1.127 CC(C)CC1=CC(=O)C=CC1=O Amb26592964 [1,1,0,0,0,0|1,0,1]=4 1700 B12R1.127 CC(C)Cc1cc(O)ccc1O Amb18646529 [1,1,0,0,0,0|1,0,1]=4 1701 B12R1.127 CC(C)Oc1cc(Br)ccc1Br Amb25252843 [1,1,0,0,0,0|2,0,0]=4 1702 B12R1.127 CC(C)Oc1cc(Br)ccc1Cl Amb23438930 [1,1,0,0,0,0|2,0,0]=4 1703 B12R1.127 CC(C)Oc1cc(Br)ccc1I Amb32412833 [1,1,0,0,0,0|2,0,0]=4 1704 B12R1.127 CC(C)Oc1cc(Br)ccc1N Amb19888304 [1,1,0,0,0,0|2,0,0]=4 1705 B12R1.127 CC(C)Oc1cc(Br)ccc1O Amb27230257 [1,1,0,0,0,0|1,0,0]=3 1706 B12R1.127 CC(C)Oc1cc(Cl)ccc1Cl Amb27164729 [1,1,0,0,0,0|2,0,0]=4 1707 B12R1.127 CC(C)Oc1cc(Cl)ccc1F Amb24701410 [1,1,0,0,0,0|2,0,0]=4 1708 B12R1.127 CC(C)Oc1cc(Cl)ccc1N Amb18285100 [1,1,0,0,0,0|2,0,0]=4 1709 B12R1.127 CC(C)Oc1cc(Cl)ccc1O Amb25282448 [1,1,0,0,0,0|1,0,0]=3 1710 B12R1.127 CC(C)Oc1cc(F)ccc1Br Amb22227907 [1,1,0,0,0,0|2,0,0]=4 1711 B12R1.127 CC(C)Oc1cc(F)ccc1F Amb28252912 [1,1,0,0,0,0|2,0,0]=4 1712 B12R1.127 CC(C)Oc1cc(F)ccc1N Amb1136449 [1,1,0,0,0,0|2,0,0]=4 1713 B12R1.127 CC(C)Oc1cc(F)ccc1N Amb19515933 [1,1,0,0,0,0|2,0,0]=4 1714 B12R1.127 CC(C)Oc1cc(F)ccc1O Amb26359857 [1,1,0,0,0,0|1,0,0]=3 1715 B12R1.127 CC(C)Oc1cc(N)ccc1Br Amb22755253 [1,1,0,0,0,0|2,0,0]=4 1716 B12R1.127 CC(C)Oc1cc(N)ccc1Cl Amb18649208 [1,1,0,0,0,0|2,0,0]=4 1717 B12R1.127 CC(C)Oc1cc(O)ccc1N Amb24091222 [1,1,0,0,0,0|1,0,1]=4 1718 B12R1.127 CC(C)Oc1cc(O)ccc1N Amb32882436 [1,1,0,0,0,0|1,0,1]=4 1719 B12R1.127 CC(C)Oc1nc(Br)ccc1O Amb27807694 [1,1,0,0,0,0|2,0,0]=4 1720 B12R1.127 CC(N)Cc1cc(Br)ccc1O Amb4079301 [1,1,0,0,0,0|2,0,0]=4 1721 B12R1.127 CC(N)Cc1cc(F)ccc1O Amb25891297 [1,1,0,0,0,0|2,0,0]=4 1722 B12R1.127 CC(N)Cc1cc(I)ccc1O Amb28135394 [1,1,0,0,0,0|2,0,0]=4 1723 B12R1.127 CC(N)Cc1cc(N)ccc1O Amb28422928 [1,1,0,0,0,0|2,0,0]=4 1724 B12R1.127 CC(N)Cc1cc(O)ccc1O Amb27254069 [1,1,0,0,0,0|1,0,1]=4 1725 B12R1.127 CC(O)Cc1cc(Br)ccc1O Amb33333243 [1,1,0,0,0,0|2,0,0]=4 1726 B12R1.127 CC(O)Cc1cc(Cl)ccc1O Amb33052617 [1,1,0,0,0,0|2,0,0]=4 1727 B12R1.127 CC(O)Cc1cc(F)ccc1O Amb25347598 [1,1,0,0,0,0|2,0,0]=4 1728 B12R1.127 CC(O)Cc1cc(O)ccc1O Amb33268972 [1,1,0,0,0,0|1,0,1]=4 1729 B12R1.127 C[C@@H](N)Cc1cc(Br)ccc1O Amb27841665 [1,1,0,0,0,0|2,0,0]=4 1730 B12R1.127 C[C@@H](N)Cc1cc(Cl)ccc1O Amb26008222 [1,1,0,0,0,0|2,0,0]=4 1731 B12R1.127 C[C@@H](N)Cc1cc(F)ccc1O Amb28346661 [1,1,0,0,0,0|2,0,0]=4 1732 B12R1.127 C[C@@H](N)Cc1cc(N)ccc1O Amb27467620 [1,1,0,0,0,0|2,0,0]=4 1733 B12R1.127 C[C@@H](N)Cc1cc(O)ccc1O Amb25857903 [1,1,0,0,0,0|1,0,1]=4 1734 B12R1.127 C[C@@H](O)Cc1cc(Br)ccc1O Amb33333272 [1,1,0,0,0,0|2,0,0]=4 1735 B12R1.127 C[C@@H](O)Cc1cc(Cl)ccc1O Amb33052639 [1,1,0,0,0,0|2,0,0]=4 1736 B12R1.127 C[C@@H](O)Cc1cc(F)ccc1O Amb33379908 [1,1,0,0,0,0|2,0,0]=4 1737 B12R1.127 C[C@@H](O)Cc1cc(O)ccc1O Amb33268898 [1,1,0,0,0,0|1,0,1]=4 1738 B12R1.127 C[C@H](N)Cc1cc(Br)ccc1O Amb26373868 [1,1,0,0,0,0|2,0,0]=4 1739 B12R1.127 C[C@H](N)Cc1cc(Cl)ccc1O Amb25240107 [1,1,0,0,0,0|2,0,0]=4 1740 B12R1.127 C[C@H](N)Cc1cc(F)ccc1O Amb27817712 [1,1,0,0,0,0|2,0,0]=4 1741 B12R1.127 C[C@H](N)Cc1cc(O)ccc1O Amb25318074 [1,1,0,0,0,0|1,0,1]=4 1742 B12R1.127 C[C@H](O)Cc1cc(Br)ccc1O Amb33333268 [1,1,0,0,0,0|2,0,0]=4 1743 B12R1.127 C[C@H](O)Cc1cc(Cl)ccc1O Amb33052637 [1,1,0,0,0,0|2,0,0]=4 1744 B12R1.127 C[C@H](O)Cc1cc(F)ccc1O Amb25735123 [1,1,0,0,0,0|2,0,0]=4 1745 B12R1.127 C[C@H](O)Cc1cc(O)ccc1O Amb33268899 [1,1,0,0,0,0|1,0,1]=4 1746 B12R1.127 Cc1ccc(Br)c(OC(C)C)c1 Amb26519101 [1,1,0,0,0,0|1,0,1]=4 1747 B12R1.127 Cc1ccc(C)c(OC(C)C)c1 Amb28045940 [1,1,0,0,0,0|1,0,1]=4 1748 B12R1.127 Cc1ccc(Cl)c(OC(C)C)c1 Amb27465584 [1,1,0,0,0,0|1,0,1]=4 1749 B12R1.127 Cc1ccc(F)c(OC(C)C)c1 Amb27264311 [1,1,0,0,0,0|1,0,1]=4 1750 B12R1.127 Cc1ccc(N)c(OC(C)C)c1 Amb6268196 [1,1,0,0,0,0|1,0,1]=4 1751 B12R1.127 Cc1ccc(N)cc1OC(C)C Amb28555688 [1,1,0,0,0,0|2,0,0]=4 1752 B12R1.127 Cc1ccc(N)cc1OC(C)C Amb9381482 [1,1,0,0,0,0|2,0,0]=4 1753 B12R1.127 Cc1ccc(O)c(CC(C)Br)c1 Amb33009038 [1,1,0,0,0,0|1,0,1]=4 1754 B12R1.127 Cc1ccc(O)c(CC(C)N)c1 Amb24428357 [1,1,0,0,0,0|1,0,1]=4 1755 B12R1.127 Cc1ccc(O)c(CC(C)O)c1 Amb27433078 [1,1,0,0,0,0|1,0,1]=4 1756 B12R1.127 Cc1ccc(O)c(C[C@@H](C)N)c1 Amb25858012 [1,1,0,0,0,0|1,0,1]=4 1757 B12R1.127 Cc1ccc(O)c(C[C@@H](C)O)c1 Amb33268743 [1,1,0,0,0,0|1,0,1]=4 1758 B12R1.127 Cc1ccc(O)c(C[C@H](C)N)c1 Amb26414534 [1,1,0,0,0,0|1,0,1]=4 1759 B12R1.127 Cc1ccc(O)c(C[C@H](C)O)c1 Amb28054327 [1,1,0,0,0,0|1,0,1]=4 1760 B12R1.127 Cc1ccc(O)c(OC(C)C)c1 Amb25258494 [1,1,0,0,0,0|0,0,1]=3 1761 B12R1.127 Cc1ccc(O)c(OC(C)C)n1 Amb32669722 [1,1,0,0,0,0|1,0,1]=4 1762 B12R1.127 Cc1ccc(O)c(OC(F)F)c1 Amb26315397 [1,1,0,0,0,0|1,0,1]=4 1763 B12R1.127 Oc1ccc(Cl)cc1OC(F)F Amb26852214 [1,1,0,0,0,0|2,0,0]=4 1764 B12R1.127 Oc1ccc(F)cc1OC(F)F Amb27597944 [1,1,0,0,0,0|2,0,0]=4 1765 B12R1.268 CCNc1cc(C)ccc1OC Amb6693801 [1,1,0,0,0,0|1,0,1]=4 1766 B12R1.268 CCNc1cc(Cl)ccc1OC Amb6693594 [1,1,0,0,0,0|2,0,0]=4 1767 B12R1.268 CCNc1cc(F)ccc1OC Amb18556394 [1,1,0,0,0,0|2,0,0]=4 1768 B12R1.268 CCOc1cc(Br)ccc1C#N Amb24183614 [1,1,0,0,0,0|2,0,0]=4 1769 B12R1.268 CCOc1cc(Br)ccc1C=O Amb8867564 [1,1,0,0,0,0|1,0,1]=4 1770 B12R1.268 CCOc1cc(Br)ccc1CBr Amb35678473 [1,1,0,0,0,0|2,0,0]=4 1771 B12R1.268 CCOc1cc(Br)ccc1CCl Amb9026022 [1,1,0,0,0,0|2,0,0]=4 1772 B12R1.268 CCOc1cc(Br)ccc1CN Amb32410350 [1,1,0,0,0,0|2,0,0]=4 1773 B12R1.268 CCOc1cc(Br)ccc1CN Amb9025730 [1,1,0,0,0,0|2,0,0]=4 1774 B12R1.268 CCOc1cc(Br)ccc1CO Amb8867741 [1,1,0,0,0,0|1,0,0]=3 1775 B12R1.268 CCOc1cc(Br)ccc1NN Amb3942573 [1,1,0,0,0,0|2,0,0]=4 1776 B12R1.268 CCOc1cc(Br)ccc1OC Amb13883590 [1,1,0,0,0,0|1,0,0]=3 1777 B12R1.268 CCOc1cc(Br)cnc1CO Amb27237078 [1,1,0,0,0,0|2,0,0]=4 1778 B12R1.268 CCOc1cc(C)ccc1C#N Amb18797971 [1,1,0,0,0,0|1,0,1]=4 1779 B12R1.268 CCOc1cc(C)ccc1C=O Amb27212512 [1,1,0,0,0,0|0,0,2]=4 1780 B12R1.268 CCOc1cc(C)ccc1CN Amb18296242 [1,1,0,0,0,0|1,0,1]=4 1781 B12R1.268 CCOc1cc(C)ncc1CO Amb27750948 [1,1,0,0,0,0|1,0,1]=4 1782 B12R1.268 CCOc1cc(Cl)ccc1C#N Amb18791365 [1,1,0,0,0,0|2,0,0]=4 1783 B12R1.268 CCOc1cc(Cl)ccc1C=O Amb28202619 [1,1,0,0,0,0|1,0,1]=4 1784 B12R1.268 CCOc1cc(Cl)ccc1CN Amb19002705 [1,1,0,0,0,0|2,0,0]=4 1785 B12R1.268 CCOc1cc(Cl)ccc1CN Amb33552245 [1,1,0,0,0,0|2,0,0]=4 1786 B12R1.268 CCOc1cc(Cl)ccc1NN Amb25365409 [1,1,0,0,0,0|2,0,0]=4 1787 B12R1.268 CCOc1cc(Cl)cnc1OC Amb19959542 [1,1,0,0,0,0|2,0,0]=4 1788 B12R1.268 CCOc1cc(F)ccc1C=O Amb21954047 [1,1,0,0,0,0|1,0,1]=4 1789 B12R1.268 CCOc1cc(F)ccc1CO Amb26366274 [1,1,0,0,0,0|1,0,0]=3 1790 B12R1.268 CCOc1cc(F)ccc1NC Amb18303226 [1,1,0,0,0,0|2,0,0]=4 1791 B12R1.268 CCOc1cc(F)ccc1NN Amb25350704 [1,1,0,0,0,0|2,0,0]=4 1792 B12R1.268 CCOc1cc(I)ccc1C#N Amb27493080 [1,1,0,0,0,0|2,0,0]=4 1793 B12R1.268 CCOc1cc(I)ccc1C=O Amb27799977 [1,1,0,0,0,0|1,0,1]=4 1794 B12R1.268 CCOc1cc(I)ccc1CBr Amb28254692 [1,1,0,0,0,0|2,0,0]=4 1795 B12R1.268 CCOc1cc(I)ccc1CN Amb27210154 [1,1,0,0,0,0|2,0,0]=4 1796 B12R1.268 CCOc1cc(N)ccc1C#N Amb27797919 [1,1,0,0,0,0|2,0,0]=4 1797 B12R1.268 CCOc1cc(N)ccc1NN Amb27666589 [1,1,0,0,0,0|2,0,0]=4 1798 B12R1.268 CCOc1cc(N)ccc1OC Amb1137219 [1,1,0,0,0,0|1,0,0]=3 1799 B12R1.268 CCOc1cc(O)ccc1CC Amb28435101 [1,1,0,0,0,0|1,0,1]=4 1800 B12R1.268 CCOc1cc(O)ccc1NN Amb25921859 [1,1,0,0,0,0|1,0,1]=4 1801 B12R1.268 CCOc1cc(O)ccc1OC Amb3988315 [1,1,0,0,0,0|0,0,1]=3 1802 B12R1.268 CCOc1cc(S)ccc1NN Amb28134379 [1,1,0,0,0,0|1,1,0]=4 1803 B12R1.268 CCOc1cc(S)ccc1OC Amb27178331 [1,1,0,0,0,0|0,1,0]=3 1804 B12R1.268 CCOc1nc(C)ccc1CO Amb35633957 [1,1,0,0,0,0|1,0,1]=4 1805 B12R1.268 CCOc1nc(I)ccc1OC Amb26373873 [1,1,0,0,0,0|2,0,0]=4 1806 B12R1.268 CCSc1cc(Br)ccc1OC Amb25969070 [1,1,0,0,0,0|1,1,0]=4 1807 B12R1.268 CCSc1cc(C)ccc1OC Amb24487205 [1,1,0,0,0,0|0,1,1]=4 1808 B12R1.268 CCSc1cc(Cl)ccc1OC Amb25195266 [1,1,0,0,0,0|1,1,0]=4 1809 B12R1.268 CCSc1cc(F)ccc1OC Amb25328601 [1,1,0,0,0,0|1,1,0]=4 1810 B12R1.268 CCSc1cc(I)ccc1OC Amb25121323 [1,1,0,0,0,0|1,1,0]=4 1811 B12R1.268 CCSc1cc(N)ccc1OC Amb24403131 [1,1,0,0,0,0|1,1,0]=4 1812 B12R1.268 COc1ccc(Br)cc1OCCl Amb32685634 [1,1,0,0,0,0|2,0,0]=4 1813 B12R1.354 CCC(=O)c1cc(Br)ccc1O Amb1207359 [1,1,0,0,0,0|2,0,0]=4 1814 B12R1.354 CCC(=O)c1cc(C)ccc1O Amb1644482 [1,1,0,0,0,0|1,0,1]=4 1815 B12R1.354 CCC(=O)c1cc(Cl)ccc1O Amb1657775 [1,1,0,0,0,0|2,0,0]=4 1816 B12R1.354 CCC(=O)c1cc(F)ccc1O Amb371596 [1,1,0,0,0,0|2,0,0]=4 1817 B12R1.354 CCC(=O)c1cc(I)ccc1O Amb27770093 [1,1,0,0,0,0|2,0,0]=4 1818 B12R1.354 CCC(=O)c1cc(O)ccc1O Amb2778670 [1,1,0,0,0,0|1,0,1]=4 1819 B12R1.354 CCC(C)c1cc(F)ccc1O Amb28243896 [1,1,0,0,0,0|2,0,0]=4 1820 B12R1.354 CCC(C)c1cc(N)ccc1O Amb27227940 [1,1,0,0,0,0|2,0,0]=4 1821 B12R1.354 CCC(C)c1cc(N)ccc1O Amb33328564 [1,1,0,0,0,0|2,0,0]=4 1822 B12R1.354 CCC(N)c1cc(C)ccc1O Amb18053881 [1,1,0,0,0,0|1,0,1]=4 1823 B12R1.354 CCC(N)c1cc(Cl)ccc1O Amb18115961 [1,1,0,0,0,0|2,0,0]=4 1824 B12R1.354 CCC(N)c1cc(F)ccc1O Amb18057689 [1,1,0,0,0,0|2,0,0]=4 1825 B12R1.354 CCC(N)c1cc(N)ccc1O Amb28128002 [1,1,0,0,0,0|2,0,0]=4 1826 B12R1.354 CCC(O)c1cc(Br)ccc1O Amb1110796 [1,1,0,0,0,0|2,0,0]=4 1827 B12R1.354 CCC(O)c1cc(C)ccc1O Amb2386876 [1,1,0,0,0,0|1,0,1]=4 1828 B12R1.354 CCC(O)c1cc(Cl)ccc1O Amb1111447 [1,1,0,0,0,0|2,0,0]=4 1829 B12R1.354 CCC(O)c1cc(F)ccc1O Amb18057888 [1,1,0,0,0,0|2,0,0]=4 1830 B12R1.354 CCC(S)c1cc(Br)ccc1O Amb7784695 [1,1,0,0,0,0|2,0,0]=4 1831 B12R1.354 CC[C@@H](N)c1cc(I)ccc1O Amb27616811 [1,1,0,0,0,0|2,0,0]=4 1832 B12R1.354 CC[C@H](N)c1cc(C)ccc1O Amb28411407 [1,1,0,0,0,0|1,0,1]=4 1833 B12R1.354 CC[C@H](N)c1cc(Cl)ccc1O Amb27471075 [1,1,0,0,0,0|2,0,0]=4 1834 B12R1.374 BrCCOc1cc(Br)ccc1Br Amb10068285 [1,1,0,0,0,0|2,0,0]=4 1835 B12R1.374 C=CCOC1=CC(=O)C=CC1=O Amb25373844 [1,1,0,0,0,0|0,0,2]=4 1836 B12R1.374 C=CCOc1cc(Br)ccc1O Amb27630363 [1,1,0,0,0,0|1,0,1]=4 1837 B12R1.374 CCCCc1cc(C)ccc1O Amb27973016 [1,1,0,0,0,0|1,0,1]=4 1838 B12R1.374 CCCNc1cc(Cl)ccc1O Amb27164011 [1,1,0,0,0,0|2,0,0]=4 1839 B12R1.374 CCCOc1cc(Br)ccc1F Amb24483694 [1,1,0,0,0,0|2,0,0]=4 1840 B12R1.374 CCCOc1cc(Br)ccc1N Amb24727840 [1,1,0,0,0,0|2,0,0]=4 1841 B12R1.374 CCCOc1cc(C)ccc1Br Amb35663090 [1,1,0,0,0,0|1,0,1]=4 1842 B12R1.374 CCCOc1cc(C)ccc1Cl Amb27466768 [1,1,0,0,0,0|1,0,1]=4 1843 B12R1.374 CCCOc1cc(C)ccc1F Amb21856655 [1,1,0,0,0,0|1,0,1]=4 1844 B12R1.374 CCCOc1cc(C)ccc1N Amb6266710 [1,1,0,0,0,0|1,0,1]=4 1845 B12R1.374 CCCOc1cc(Cl)ccc1N Amb18296228 [1,1,0,0,0,0|2,0,0]=4 1846 B12R1.374 CCCOc1cc(Cl)ccc1O Amb25282670 [1,1,0,0,0,0|1,0,0]=3 1847 B12R1.374 CCCOc1cc(F)ccc1Br Amb27623285 [1,1,0,0,0,0|2,0,0]=4 1848 B12R1.374 CCCOc1cc(F)ccc1N Amb1132322 [1,1,0,0,0,0|2,0,0]=4 1849 B12R1.374 CCCOc1cc(F)ccc1S Amb26651834 [1,1,0,0,0,0|1,1,0]=4 1850 B12R1.374 CCCOc1cc(N)ccc1C Amb9381478 [1,1,0,0,0,0|2,0,0]=4 1851 B12R1.374 CCCOc1cc(N)ccc1Cl Amb18649207 [1,1,0,0,0,0|2,0,0]=4 1852 B12R1.374 CCCOc1cc(N)ccc1N Amb28364725 [1,1,0,0,0,0|2,0,0]=4 1853 B12R1.374 CCCOc1cc(O)ccc1Cl Amb26463653 [1,1,0,0,0,0|1,0,1]=4 1854 B12R1.374 CCCOc1cc(O)ccc1N Amb24461245 [1,1,0,0,0,0|1,0,1]=4 1855 B12R1.374 CCCOc1cc(S)ccc1C Amb28399363 [1,1,0,0,0,0|1,1,0]=4 1856 B12R1.374 CCCOc1cc(S)ccc1F Amb25692041 [1,1,0,0,0,0|1,1,0]=4 1857 B12R1.374 CCCOc1nc(C)ccc1O Amb32669725 [1,1,0,0,0,0|1,0,1]=4 1858 B12R1.374 CCNCc1cc(Br)ccc1O Amb17144307 [1,1,0,0,0,0|2,0,0]=4 1859 B12R1.374 CCNCc1cc(C)ccc1O Amb9776241 [1,1,0,0,0,0|1,0,1]=4 1860 B12R1.374 CCNCc1cc(Cl)ccc1O Amb6261308 [1,1,0,0,0,0|2,0,0]=4 1861 B12R1.374 CCNCc1cc(F)ccc1O Amb18275908 [1,1,0,0,0,0|2,0,0]=4 1862 B12R1.374 CCNCc1cc(N)ccc1O Amb17613931 [1,1,0,0,0,0|2,0,0]=4 1863 B12R1.374 CCOCc1cc(Br)ccc1C Amb27956158 [1,1,0,0,0,0|2,0,0]=4 1864 B12R1.374 CCOCc1cc(Br)ccc1F Amb22900162 [1,1,0,0,0,0|2,0,0]=4 1865 B12R1.374 CCOCc1cc(Cl)ccc1I Amb35697894 [1,1,0,0,0,0|2,0,0]=4 1866 B12R1.374 CCOCc1cc(Cl)ccc1N Amb27483601 [1,1,0,0,0,0|2,0,0]=4 1867 B12R1.374 CCOCc1cc(F)ccc1Br Amb22900140 [1,1,0,0,0,0|2,0,0]=4 1868 B12R1.374 CNCCc1cc(Br)ccc1O Amb33333200 [1,1,0,0,0,0|2,0,0]=4 1869 B12R1.374 CNCCc1cc(C)ccc1O Amb18940457 [1,1,0,0,0,0|1,0,1]=4 1870 B12R1.374 CNCCc1cc(Cl)ccc1O Amb18939315 [1,1,0,0,0,0|2,0,0]=4 1871 B12R1.374 CNCCc1cc(F)ccc1O Amb18275939 [1,1,0,0,0,0|2,0,0]=4 1872 B12R1.374 CNCCc1cc(O)ccc1O Amb27658706 [1,1,0,0,0,0|1,0,1]=4 1873 B12R1.374 COCOc1cc(Br)ccc1C Amb26506766 [1,1,0,0,0,0|2,0,0]=4 1874 B12R1.374 COCOc1cc(Br)ccc1Cl Amb27247650 [1,1,0,0,0,0|2,0,0]=4 1875 B12R1.374 COCOc1cc(Br)ccc1F Amb27255632 [1,1,0,0,0,0|2,0,0]=4 1876 B12R1.374 COCOc1cc(Br)ccc1O Amb35788330 [1,1,0,0,0,0|1,0,0]=3 1877 B12R1.374 COCOc1cc(C)ccc1Br Amb30016168 [1,1,0,0,0,0|1,0,1]=4 1878 B12R1.374 COCOc1cc(Cl)ccc1Cl Amb27948670 [1,1,0,0,0,0|2,0,0]=4 1879 B12R1.374 COCOc1cc(Cl)ccc1F Amb28138338 [1,1,0,0,0,0|2,0,0]=4 1880 B12R1.374 COCOc1cc(Cl)ccc1N Amb27662698 [1,1,0,0,0,0|2,0,0]=4 1881 B12R1.374 COCOc1cc(F)ccc1Br Amb21856392 [1,1,0,0,0,0|2,0,0]=4 1882 B12R1.374 COCOc1cc(F)ccc1C Amb27264425 [1,1,0,0,0,0|2,0,0]=4 1883 B12R1.374 COCOc1cc(F)ccc1Cl Amb26332127 [1,1,0,0,0,0|2,0,0]=4 1884 B12R1.374 COCOc1cc(F)ccc1F Amb10607090 [1,1,0,0,0,0|2,0,0]=4 1885 B12R1.374 COCOc1cc(N)ccc1Br Amb27459422 [1,1,0,0,0,0|2,0,0]=4 1886 B12R1.374 CSCOc1cc(C)ccc1I Amb27261268 [1,1,0,0,0,0|1,0,1]=4 1887 B12R1.374 Cc1ccc(Br)c(OCCBr)c1 Amb35602464 [1,1,0,0,0,0|1,0,1]=4 1888 B12R1.374 Cc1ccc(Br)c(OCCCl)c1 Amb35602463 [1,1,0,0,0,0|1,0,1]=4 1889 B12R1.374 Cc1ccc(Br)c(OCCF)c1 Amb35663354 [1,1,0,0,0,0|1,0,1]=4 1890 B12R1.374 Cc1ccc(Br)c(OCCN)c1 Amb27166651 [1,1,0,0,0,0|1,0,1]=4 1891 B12R1.374 Cc1ccc(Br)c(OCCO)c1 Amb30016163 [1,1,0,0,0,0|1,0,1]=4 1892 B12R1.374 Cc1ccc(Br)c(OCCS)c1 Amb35664907 [1,1,0,0,0,0|1,0,1]=4 1893 B12R1.374 Cc1ccc(Br)cc1OCCN Amb24116411 [1,1,0,0,0,0|2,0,0]=4 1894 B12R1.374 Cc1ccc(C)c(OCCBr)c1 Amb1105545 [1,1,0,0,0,0|1,0,1]=4 1895 B12R1.374 Cc1ccc(C)c(OCCCl)c1 Amb8828431 [1,1,0,0,0,0|1,0,1]=4 1896 B12R1.374 Cc1ccc(C)c(OCCN)c1 Amb1101722 [1,1,0,0,0,0|1,0,1]=4 1897 B12R1.374 Cc1ccc(C)c(OCCO)c1 Amb9370664 [1,1,0,0,0,0|1,0,1]=4 1898 B12R1.374 Cc1ccc(C)c(OCCS)c1 Amb6255873 [1,1,0,0,0,0|1,0,1]=4 1899 B12R1.374 Cc1ccc(Cl)c(OCCBr)c1 Amb8867463 [1,1,0,0,0,0|1,0,1]=4 1900 B12R1.374 Cc1ccc(Cl)c(OCCCl)c1 Amb9025041 [1,1,0,0,0,0|1,0,1]=4 1901 B12R1.374 Cc1ccc(Cl)c(OCCN)c1 Amb21959599 [1,1,0,0,0,0|1,0,1]=4 1902 B12R1.374 Cc1ccc(Cl)c(OCCN)c1 Amb9025059 [1,1,0,0,0,0|1,0,1]=4 1903 B12R1.374 Cc1ccc(Cl)c(OCCO)c1 Amb9274259 [1,1,0,0,0,0|1,0,1]=4 1904 B12R1.374 Cc1ccc(Cl)c(OCCS)c1 Amb17237592 [1,1,0,0,0,0|1,0,1]=4 1905 B12R1.374 Cc1ccc(Cl)cc1OCCCl Amb27641822 [1,1,0,0,0,0|2,0,0]=4 1906 B12R1.374 Cc1ccc(Cl)cc1OCCF Amb27865176 [1,1,0,0,0,0|2,0,0]=4 1907 B12R1.374 Cc1ccc(Cl)cc1OCCN Amb18649214 [1,1,0,0,0,0|2,0,0]=4 1908 B12R1.374 Cc1ccc(F)c(OCCBr)c1 Amb27474666 [1,1,0,0,0,0|1,0,1]=4 1909 B12R1.374 Cc1ccc(F)c(OCCCl)c1 Amb28318027 [1,1,0,0,0,0|1,0,1]=4 1910 B12R1.374 Cc1ccc(F)c(OCCN)c1 Amb27474665 [1,1,0,0,0,0|1,0,1]=4 1911 B12R1.374 Cc1ccc(F)cc1OCCN Amb24682325 [1,1,0,0,0,0|2,0,0]=4 1912 B12R1.374 Cc1ccc(F)cc1OCCS Amb28454492 [1,1,0,0,0,0|2,0,0]=4 1913 B12R1.374 Cc1ccc(I)cc1OCCF Amb28194484 [1,1,0,0,0,0|2,0,0]=4 1914 B12R1.374 Cc1ccc(I)cc1OCCO Amb27973522 [1,1,0,0,0,0|2,0,0]=4 1915 B12R1.374 Cc1ccc(N)c(OCCF)c1 Amb25948544 [1,1,0,0,0,0|1,0,1]=4 1916 B12R1.374 Cc1ccc(N)c(OCCO)c1 Amb6702384 [1,1,0,0,0,0|1,0,1]=4 1917 B12R1.374 Cc1ccc(N)cc1OCCF Amb25063471 [1,1,0,0,0,0|2,0,0]=4 1918 B12R1.374 Cc1ccc(O)c(CCCBr)c1 Amb24558916 [1,1,0,0,0,0|1,0,1]=4 1919 B12R1.374 Cc1ccc(O)c(CCCCl)c1 Amb27200457 [1,1,0,0,0,0|1,0,1]=4 1920 B12R1.374 Cc1ccc(O)c(CCCN)c1 Amb18552860 [1,1,0,0,0,0|1,0,1]=4 1921 B12R1.374 Cc1ccc(O)c(CCCO)c1 Amb18646539 [1,1,0,0,0,0|1,0,1]=4 1922 B12R1.374 Cc1ccc(O)c(CCCS)c1 Amb33269437 [1,1,0,0,0,0|1,0,1]=4 1923 B12R1.374 Cc1ccc(O)c(NCCO)c1 Amb27223975 [1,1,0,0,0,0|1,0,1]=4 1924 B12R1.374 Cc1ccc(O)c(OCCN)c1 Amb33267916 [1,1,0,0,0,0|0,0,1]=3 1925 B12R1.374 ClCCOc1cc(Cl)ccc1Cl Amb8828413 [1,1,0,0,0,0|2,0,0]=4 1926 B12R1.374 Clc1ccc(Cl)c(OCCBr)c1 Amb1106064 [1,1,0,0,0,0|2,0,0]=4 1927 B12R1.374 FCCOc1cc(Br)ccc1F Amb28127586 [1,1,0,0,0,0|2,0,0]=4 1928 B12R1.374 FCCOc1cc(Cl)ccc1Cl Amb27177428 [1,1,0,0,0,0|2,0,0]=4 1929 B12R1.374 FCCOc1cc(Cl)ccc1F Amb27756033 [1,1,0,0,0,0|2,0,0]=4 1930 B12R1.374 FCCOc1cc(F)ccc1Br Amb27753288 [1,1,0,0,0,0|2,0,0]=4 1931 B12R1.374 FCCOc1cc(F)ccc1F Amb28345100 [1,1,0,0,0,0|2,0,0]=4 1932 B12R1.374 Fc1ccc(Br)cc1OCCCl Amb28321297 [1,1,0,0,0,0|2,0,0]=4 1933 B12R1.374 Fc1ccc(Cl)c(OCCCl)c1 Amb27454503 [1,1,0,0,0,0|2,0,0]=4 1934 B12R1.374 Fc1ccc(F)c(OCCBr)c1 Amb24483410 [1,1,0,0,0,0|2,0,0]=4 1935 B12R1.374 Fc1ccc(F)c(OCCS)c1 Amb27834968 [1,1,0,0,0,0|2,0,0]=4 1936 B12R1.374 NCCCc1cc(Br)ccc1O Amb26608950 [1,1,0,0,0,0|2,0,0]=4 1937 B12R1.374 NCCCc1cc(Cl)ccc1O Amb18909512 [1,1,0,0,0,0|2,0,0]=4 1938 B12R1.374 NCCCc1cc(F)ccc1O Amb18556316 [1,1,0,0,0,0|2,0,0]=4 1939 B12R1.374 NCCCc1cc(O)ccc1O Amb26505313 [1,1,0,0,0,0|1,0,1]=4 1940 B12R1.374 NCCOc1cc(Br)ccc1Cl Amb26373500 [1,1,0,0,0,0|2,0,0]=4 1941 B12R1.374 NCCOc1cc(Br)ccc1F Amb28253153 [1,1,0,0,0,0|2,0,0]=4 1942 B12R1.374 NCCOc1cc(Br)ccc1O Amb33333604 [1,1,0,0,0,0|1,0,0]=3 1943 B12R1.374 NCCOc1cc(Cl)ccc1Br Amb25896544 [1,1,0,0,0,0|2,0,0]=4 1944 B12R1.374 NCCOc1cc(Cl)ccc1Cl Amb2446347 [1,1,0,0,0,0|2,0,0]=4 1945 B12R1.374 NCCOc1cc(Cl)ccc1F Amb18243938 [1,1,0,0,0,0|2,0,0]=4 1946 B12R1.374 NCCOc1cc(Cl)ccc1O Amb33261274 [1,1,0,0,0,0|1,0,0]=3 1947 B12R1.374 NCCOc1cc(F)ccc1Br Amb25106321 [1,1,0,0,0,0|2,0,0]=4 1948 B12R1.374 NCCOc1cc(F)ccc1Cl Amb26654322 [1,1,0,0,0,0|2,0,0]=4 1949 B12R1.374 NCCOc1cc(F)ccc1F Amb18243555 [1,1,0,0,0,0|2,0,0]=4 1950 B12R1.374 NCCOc1cc(F)ccc1O Amb33379489 [1,1,0,0,0,0|1,0,0]=3 1951 B12R1.374 NCCOc1cc(O)ccc1Br Amb33387323 [1,1,0,0,0,0|1,0,1]=4 1952 B12R1.374 NCCOc1cc(O)ccc1F Amb27208594 [1,1,0,0,0,0|1,0,1]=4 1953 B12R1.374 NCCOc1cc(O)ccc1O Amb33268161 [1,1,0,0,0,0|0,0,1]=3 1954 B12R1.374 Nc1ccc(Br)c(OCCF)c1 Amb26326461 [1,1,0,0,0,0|2,0,0]=4 1955 B12R1.374 Nc1ccc(Br)cc1OCCF Amb32939658 [1,1,0,0,0,0|2,0,0]=4 1956 B12R1.374 Nc1ccc(Br)cc1OCCO Amb28186664 [1,1,0,0,0,0|2,0,0]=4 1957 B12R1.374 Nc1ccc(Cl)c(OCCF)c1 Amb25844731 [1,1,0,0,0,0|2,0,0]=4 1958 B12R1.374 Nc1ccc(Cl)cc1OCCF Amb24579905 [1,1,0,0,0,0|2,0,0]=4 1959 B12R1.374 Nc1ccc(Cl)cc1OCCO Amb18990920 [1,1,0,0,0,0|2,0,0]=4 1960 B12R1.374 Nc1ccc(F)cc1OCCF Amb25886660 [1,1,0,0,0,0|2,0,0]=4 1961 B12R1.374 Nc1ccc(F)cc1OCCO Amb6702381 [1,1,0,0,0,0|2,0,0]=4 1962 B12R1.374 Nc1ccc(O)c(CCCBr)c1 Amb27616173 [1,1,0,0,0,0|2,0,0]=4 1963 B12R1.374 Nc1ccc(O)c(CCCCl)c1 Amb27209802 [1,1,0,0,0,0|2,0,0]=4 1964 B12R1.374 Nc1ccc(O)cc1OCCF Amb32939657 [1,1,0,0,0,0|1,0,1]=4 1965 B12R1.374 O=C1C=CC(=O)C(CCCO)=C1 Amb27177915 [1,1,0,0,0,0|1,0,1]=4 1966 B12R1.374 O=C1C=CC(=O)C(NCCO)=C1 Amb27230328 [1,1,0,0,0,0|1,0,1]=4 1967 B12R1.374 OCCCc1cc(Br)ccc1O Amb25931046 [1,1,0,0,0,0|2,0,0]=4 1968 B12R1.374 OCCCc1cc(Cl)ccc1O Amb25762478 [1,1,0,0,0,0|2,0,0]=4 1969 B12R1.374 OCCCc1cc(F)ccc1O Amb24377655 [1,1,0,0,0,0|2,0,0]=4 1970 B12R1.374 OCCCc1cc(O)ccc1O Amb26347304 [1,1,0,0,0,0|1,0,1]=4 1971 B12R1.374 OCCOc1cc(Br)ccc1Br Amb23412184 [1,1,0,0,0,0|2,0,0]=4 1972 B12R1.374 OCCOc1cc(Br)ccc1Cl Amb28042623 [1,1,0,0,0,0|2,0,0]=4 1973 B12R1.374 OCCOc1cc(Br)ccc1F Amb24271232 [1,1,0,0,0,0|2,0,0]=4 1974 B12R1.374 OCCOc1cc(Cl)ccc1Cl Amb9245009 [1,1,0,0,0,0|2,0,0]=4 1975 B12R1.374 OCCOc1cc(Cl)ccc1F Amb27451542 [1,1,0,0,0,0|2,0,0]=4 1976 B12R1.374 Oc1ccc(Br)cc1CCCCl Amb27638928 [1,1,0,0,0,0|2,0,0]=4 1977 B12R1.374 Oc1ccc(Br)cc1CCCS Amb33333973 [1,1,0,0,0,0|2,0,0]=4 1978 B12R1.374 Oc1ccc(Cl)cc1CCCBr Amb28286546 [1,1,0,0,0,0|2,0,0]=4 1979 B12R1.374 Oc1ccc(Cl)cc1CCCCl Amb28286547 [1,1,0,0,0,0|2,0,0]=4 1980 B12R1.374 Oc1ccc(Cl)cc1CCCS Amb33261242 [1,1,0,0,0,0|2,0,0]=4 1981 B12R1.374 Oc1ccc(F)cc1CCCBr Amb27423565 [1,1,0,0,0,0|2,0,0]=4 1982 B12R1.374 Oc1ccc(F)cc1CCCCl Amb27423571 [1,1,0,0,0,0|2,0,0]=4 1983 B12R1.374 Oc1ccc(F)cc1CCCS Amb33379205 [1,1,0,0,0,0|2,0,0]=4 1984 B12R1.374 Oc1ccc(F)cc1OCCCl Amb27974242 [1,1,0,0,0,0|1,0,0]=3 1985 B12R1.374 Oc1ccc(I)cc1CCCBr Amb27622483 [1,1,0,0,0,0|2,0,0]=4 1986 B12R1.374 Oc1ccc(O)c(CCCBr)c1 Amb26966089 [1,1,0,0,0,0|1,0,1]=4 1987 B12R1.374 Oc1ccc(O)c(CCCCl)c1 Amb27192380 [1,1,0,0,0,0|1,0,1]=4 1988 B12R1.374 Oc1ccc(O)c(CCCS)c1 Amb33268155 [1,1,0,0,0,0|1,0,1]=4 1989 B12R1.374 SCCOc1cc(Br)ccc1Cl Amb27835576 [1,1,0,0,0,0|2,0,0]=4 1990 B12R1.374 SCCOc1cc(Cl)ccc1Cl Amb17245965 [1,1,0,0,0,0|2,0,0]=4 1991 B12R1.497 CCOc1c(Br)ccc(Br)c1F Amb24537147 [1,1,0,0,0,0|2,0,0]=4 1992 B12R1.497 CCOc1c(Br)ccc(F)c1Br Amb26013982 [1,1,0,0,0,0|2,0,0]=4 1993 B12R1.497 CCOc1c(Br)ccc(F)c1F Amb10067189 [1,1,0,0,0,0|2,0,0]=4 1994 B12R1.497 CCOc1c(Br)ccc(F)c1O Amb22896525 [1,1,0,0,0,0|2,0,0]=4 1995 B12R1.497 CCOc1c(Br)ccc(O)c1F Amb24637068 [1,1,0,0,0,0|1,0,1]=4 1996 B12R1.497 CCOc1c(C)ccc(C)c1C Amb27443853 [1,1,0,0,0,0|1,0,1]=4 1997 B12R1.497 CCOc1c(C)ccc(C)c1F Amb25223307 [1,1,0,0,0,0|1,0,1]=4 1998 B12R1.497 CCOc1c(C)ccc(C)c1N Amb18057009 [1,1,0,0,0,0|1,0,1]=4 1999 B12R1.497 CCOc1c(C)ccc(C)c1O Amb18056817 [1,1,0,0,0,0|1,0,1]=4 2000 B12R1.497 CCOc1c(C)ccc(Cl)c1F Amb28326228 [1,1,0,0,0,0|2,0,0]=4 2001 B12R1.497 CCOc1c(C)ccc(F)c1Cl Amb26064576 [1,1,0,0,0,0|2,0,0]=4 2002 B12R1.497 CCOc1c(C)ccc(F)c1F Amb27636525 [1,1,0,0,0,0|2,0,0]=4 2003 B12R1.497 CCOc1c(Cl)ccc(Br)c1Cl Amb27421504 [1,1,0,0,0,0|2,0,0]=4 2004 B12R1.497 CCOc1c(Cl)ccc(Br)c1F Amb26973057 [1,1,0,0,0,0|2,0,0]=4 2005 B12R1.497 CCOc1c(Cl)ccc(C)c1Cl Amb25981606 [1,1,0,0,0,0|1,0,1]=4 2006 B12R1.497 CCOc1c(Cl)ccc(C)c1F Amb27445560 [1,1,0,0,0,0|1,0,1]=4 2007 B12R1.497 CCOc1c(Cl)ccc(Cl)c1C Amb27971098 [1,1,0,0,0,0|2,0,0]=4 2008 B12R1.497 CCOc1c(Cl)ccc(Cl)c1O Amb27613765 [1,1,0,0,0,0|2,0,0]=4 2009 B12R1.497 CCOc1c(Cl)ccc(O)c1Cl Amb27971097 [1,1,0,0,0,0|1,0,1]=4 2010 B12R1.497 CCOc1c(Cl)ccc(O)c1F Amb28344056 [1,1,0,0,0,0|1,0,1]=4 2011 B12R1.497 CCOc1c(F)ccc(Br)c1F Amb28343849 [1,1,0,0,0,0|2,0,0]=4 2012 B12R1.497 CCOc1c(F)ccc(Br)c1O Amb24754539 [1,1,0,0,0,0|2,0,0]=4 2013 B12R1.497 CCOc1c(F)ccc(C)c1C Amb27259754 [1,1,0,0,0,0|1,0,1]=4 2014 B12R1.497 CCOc1c(F)ccc(C)c1Cl Amb28071317 [1,1,0,0,0,0|1,0,1]=4 2015 B12R1.497 CCOc1c(F)ccc(Cl)c1C Amb27792308 [1,1,0,0,0,0|2,0,0]=4 2016 B12R1.497 CCOc1c(F)ccc(Cl)c1Cl Amb27963067 [1,1,0,0,0,0|2,0,0]=4 2017 B12R1.497 CCOc1c(F)ccc(F)c1C Amb26608361 [1,1,0,0,0,0|2,0,0]=4 2018 B12R1.497 CCOc1c(F)ccc(N)c1F Amb22047593 [1,1,0,0,0,0|2,0,0]=4 2019 B12R1.497 CCOc1c(F)ccc(O)c1Br Amb26458085 [1,1,0,0,0,0|1,0,1]=4 2020 B12R1.497 CCOc1c(F)ccc(O)c1F Amb22047712 [1,1,0,0,0,0|1,0,1]=4 2021 B12R1.497 CCOc1c(I)ccc(F)c1I Amb28347157 [1,1,0,0,0,0|2,0,0]=4 2022 B12R1.497 CCOc1c(I)ccc(I)c1F Amb27787094 [1,1,0,0,0,0|2,0,0]=4 2023 B12R1.497 CCOc1c(I)ccc(I)c1O Amb27625157 [1,1,0,0,0,0|2,0,0]=4 2024 B12R1.497 CCOc1c(N)ccc(Cl)c1C Amb25972303 [1,1,0,0,0,0|2,0,0]=4 2025 B12R1.497 CCOc1c(N)ccc(F)c1Br Amb25229255 [1,1,0,0,0,0|2,0,0]=4 2026 B12R1.497 CCOc1c(N)ccc(F)c1F Amb18286427 [1,1,0,0,0,0|2,0,0]=4 2027 B12R1.497 CCOc1c(O)ccc(Cl)c1Cl Amb27613764 [1,1,0,0,0,0|1,0,0]=3 2028 B12R1.497 CCOc1c(O)ccc(F)c1Br Amb25800264 [1,1,0,0,0,0|1,0,0]=3 2029 B12R1.497 Cc1ccc(O)c(OCF)c1C Amb25234211 [1,1,0,0,0,0|1,0,1]=4 2030 B12R1.497 Oc1ccc(Cl)c(Cl)c1OCF Amb27192294 [1,1,0,0,0,0|2,0,0]=4 2031 B12R1.1123 CCCC1=CC(=O)C(F)=CC1=O Amb24661688 [1,1,0,0,0,0|1,0,1]=4 2032 B12R1.1123 CCCc1cc(C)c(C)cc1O Amb28381184 [1,1,0,0,0,0|1,0,1]=4 2033 B12R1.1123 CCCc1cc(N)c(O)cc1O Amb27442414 [1,1,0,0,0,0|2,0,0]=4 2034 B12R1.1123 CCNc1cc(Cl)c(Cl)cc1O Amb18277297 [1,1,0,0,0,0|2,0,0]=4 2035 B12R1.1123 CCOc1cc(Br)c(Cl)cc1N Amb28041440 [1,1,0,0,0,0|2,0,0]=4 2036 B12R1.1123 CCOc1cc(Br)c(F)cc1Br Amb24537180 [1,1,0,0,0,0|2,0,0]=4 2037 B12R1.1123 CCOc1cc(Br)c(F)cc1F Amb24456963 [1,1,0,0,0,0|2,0,0]=4 2038 B12R1.1123 CCOc1cc(Br)c(F)cc1N Amb25685600 [1,1,0,0,0,0|2,0,0]=4 2039 B12R1.1123 CCOc1cc(C)c(Br)cc1C Amb18897019 [1,1,0,0,0,0|1,0,1]=4 2040 B12R1.1123 CCOc1cc(C)c(Br)cc1Cl Amb18902479 [1,1,0,0,0,0|1,0,1]=4 2041 B12R1.1123 CCOc1cc(C)c(C)cc1Br Amb17248435 [1,1,0,0,0,0|1,0,1]=4 2042 B12R1.1123 CCOc1cc(C)c(C)cc1F Amb27616012 [1,1,0,0,0,0|1,0,1]=4 2043 B12R1.1123 CCOc1cc(C)c(C)cc1N Amb17203651 [1,1,0,0,0,0|1,0,1]=4 2044 B12R1.1123 CCOc1cc(C)c(Cl)cc1Cl Amb27442080 [1,1,0,0,0,0|1,0,1]=4 2045 B12R1.1123 CCOc1cc(C)c(Cl)cc1F Amb28326227 [1,1,0,0,0,0|1,0,1]=4 2046 B12R1.1123 CCOc1cc(C)c(Cl)cc1N Amb17202754 [1,1,0,0,0,0|1,0,1]=4 2047 B12R1.1123 CCOc1cc(C)c(F)cc1C Amb26004225 [1,1,0,0,0,0|1,0,1]=4 2048 B12R1.1123 CCOc1cc(C)c(F)cc1F Amb27844389 [1,1,0,0,0,0|1,0,1]=4 2049 B12R1.1123 CCOc1cc(C)c(F)cc1N Amb26623984 [1,1,0,0,0,0|1,0,1]=4 2050 B12R1.1123 CCOc1cc(C)c(N)cc1Br Amb25231362 [1,1,0,0,0,0|1,0,1]=4 2051 B12R1.1123 CCOc1cc(C)c(N)cc1C Amb17203236 [1,1,0,0,0,0|1,0,1]=4 2052 B12R1.1123 CCOc1cc(C)c(N)cc1Cl Amb18564358 [1,1,0,0,0,0|1,0,1]=4 2053 B12R1.1123 CCOc1cc(C)c(N)cc1F Amb27604362 [1,1,0,0,0,0|1,0,1]=4 2054 B12R1.1123 CCOc1cc(C)c(N)cc1N Amb25053942 [1,1,0,0,0,0|1,0,1]=4 2055 B12R1.1123 CCOc1cc(C)c(O)cc1C Amb17203238 [1,1,0,0,0,0|1,0,1]=4 2056 B12R1.1123 CCOc1cc(C)c(O)cc1Cl Amb18243870 [1,1,0,0,0,0|1,0,1]=4 2057 B12R1.1123 CCOc1cc(C)c(O)cc1N Amb27389185 [1,1,0,0,0,0|1,0,1]=4 2058 B12R1.1123 CCOc1cc(C)c(S)cc1C Amb26452669 [1,1,0,0,0,0|1,0,1]=4 2059 B12R1.1123 CCOc1cc(C)c(S)cc1Cl Amb25871674 [1,1,0,0,0,0|1,0,1]=4 2060 B12R1.1123 CCOc1cc(Cl)c(C)cc1Cl Amb27966201 [1,1,0,0,0,0|2,0,0]=4 2061 B12R1.1123 CCOc1cc(Cl)c(Cl)cc1N Amb18943027 [1,1,0,0,0,0|2,0,0]=4 2062 B12R1.1123 CCOc1cc(Cl)c(F)cc1C Amb27635421 [1,1,0,0,0,0|2,0,0]=4 2063 B12R1.1123 CCOc1cc(Cl)c(F)cc1F Amb27438784 [1,1,0,0,0,0|2,0,0]=4 2064 B12R1.1123 CCOc1cc(Cl)c(F)cc1N Amb26038969 [1,1,0,0,0,0|2,0,0]=4 2065 B12R1.1123 CCOc1cc(Cl)c(N)cc1C Amb25724365 [1,1,0,0,0,0|2,0,0]=4 2066 B12R1.1123 CCOc1cc(Cl)c(N)cc1Cl Amb27462081 [1,1,0,0,0,0|2,0,0]=4 2067 B12R1.1123 CCOc1cc(Cl)c(S)cc1Cl Amb27261947 [1,1,0,0,0,0|2,0,0]=4 2068 B12R1.1123 CCOc1cc(F)c(Br)cc1Br Amb27192297 [1,1,0,0,0,0|2,0,0]=4 2069 B12R1.1123 CCOc1cc(F)c(Br)cc1Cl Amb25160174 [1,1,0,0,0,0|2,0,0]=4 2070 B12R1.1123 CCOc1cc(F)c(Br)cc1F Amb24622688 [1,1,0,0,0,0|2,0,0]=4 2071 B12R1.1123 CCOc1cc(F)c(Br)cc1N Amb26370716 [1,1,0,0,0,0|2,0,0]=4 2072 B12R1.1123 CCOc1cc(F)c(Br)cc1O Amb25804298 [1,1,0,0,0,0|1,0,0]=3 2073 B12R1.1123 CCOc1cc(F)c(C)cc1C Amb26576241 [1,1,0,0,0,0|2,0,0]=4 2074 B12R1.1123 CCOc1cc(F)c(C)cc1Cl Amb25143748 [1,1,0,0,0,0|2,0,0]=4 2075 B12R1.1123 CCOc1cc(F)c(C)cc1O Amb27247483 [1,1,0,0,0,0|1,0,0]=3 2076 B12R1.1123 CCOc1cc(F)c(Cl)cc1N Amb25683065 [1,1,0,0,0,0|2,0,0]=4 2077 B12R1.1123 CCOc1cc(F)c(F)cc1Br Amb22490098 [1,1,0,0,0,0|2,0,0]=4 2078 B12R1.1123 CCOc1cc(F)c(F)cc1F Amb28366302 [1,1,0,0,0,0|2,0,0]=4 2079 B12R1.1123 CCOc1cc(F)c(F)cc1N Amb25895019 [1,1,0,0,0,0|2,0,0]=4 2080 B12R1.1123 CCOc1cc(F)c(I)cc1N Amb27948811 [1,1,0,0,0,0|2,0,0]=4 2081 B12R1.1123 CCOc1cc(F)c(N)cc1Cl Amb27872076 [1,1,0,0,0,0|2,0,0]=4 2082 B12R1.1123 CCOc1cc(F)c(N)cc1F Amb26346255 [1,1,0,0,0,0|2,0,0]=4 2083 B12R1.1123 CCOc1cc(F)c(O)cc1Br Amb26381271 [1,1,0,0,0,0|2,0,0]=4 2084 B12R1.1123 CCOc1cc(F)c(O)cc1F Amb24091468 [1,1,0,0,0,0|2,0,0]=4 2085 B12R1.1123 CCOc1cc(I)c(F)cc1I Amb27203179 [1,1,0,0,0,0|2,0,0]=4 2086 B12R1.1123 CCOc1cc(I)c(I)cc1F Amb27815349 [1,1,0,0,0,0|2,0,0]=4 2087 B12R1.1123 CCOc1cc(I)c(O)cc1I Amb27844495 [1,1,0,0,0,0|2,0,0]=4 2088 B12R1.1123 CCOc1cc(N)c(C)cc1C Amb28397199 [1,1,0,0,0,0|2,0,0]=4 2089 B12R1.1123 CCOc1cc(N)c(C)cc1N Amb32668793 [1,1,0,0,0,0|2,0,0]=4 2090 B12R1.1123 CCOc1cc(N)c(Cl)cc1C Amb28280307 [1,1,0,0,0,0|2,0,0]=4 2091 B12R1.1123 CCOc1cc(N)c(Cl)cc1Cl Amb18655201 [1,1,0,0,0,0|2,0,0]=4 2092 B12R1.1123 CCOc1cc(O)c(Br)cc1F Amb26849236 [1,1,0,0,0,0|1,0,1]=4 2093 B12R1.1123 CCOc1cc(O)c(C)cc1C Amb27476262 [1,1,0,0,0,0|1,0,1]=4 2094 B12R1.1123 CCOc1cc(O)c(F)cc1C Amb27842435 [1,1,0,0,0,0|1,0,1]=4 2095 B12R1.1123 CCOc1cc(O)c(F)cc1F Amb27874492 [1,1,0,0,0,0|1,0,1]=4 2096 B12R1.1123 CCOc1cc(O)c(I)cc1I Amb27844494 [1,1,0,0,0,0|1,0,1]=4 2097 B12R1.1123 CCOc1cc(O)c(N)cc1F Amb24659372 [1,1,0,0,0,0|1,0,1]=4 2098 B12R1.1123 CCOc1cc(S)c(N)cc1F Amb27247977 [1,1,0,0,0,0|1,1,0]=4 2099 B12R1.1123 Cc1cc(O)c(OCF)cc1C Amb27616036 [1,1,0,0,0,0|1,0,1]=4 2100 B12R1.1123 Oc1cc(Br)c(F)cc1OCF Amb28251558 [1,1,0,0,0,0|2,0,0]=4 2101 B12R1.1123 Oc1cc(F)c(Br)cc1OCF Amb26565062 [1,1,0,0,0,0|2,0,0]=4 2102 B12R1.41 C=Cc1cc(N)cc(OCC)n1 Amb25141018 [1,1,0,0,0,0|2,0,0]=4 2103 B12R1.41 CCOc1cc(Br)cc(C#N)c1 Amb26374069 [1,1,0,0,0,0|1,0,1]=4 2104 B12R1.41 CCOc1cc(Br)cc(C=O)c1 Amb25710548 [1,1,0,0,0,0|0,0,0]=2 2105 B12R1.41 CCOc1cc(Br)cc(CCl)c1 Amb28410843 [1,1,0,0,0,0|1,0,1]=4 2106 B12R1.41 CCOc1cc(Br)cc(OC)c1 Amb34911773 [1,1,0,0,0,0|2,0,0]=4 2107 B12R1.41 CCOc1cc(C)cc(NN)c1 Amb25268034 [1,1,0,0,0,0|2,0,0]=4 2108 B12R1.41 CCOc1cc(C)nc(C=O)n1 Amb28196140 [1,1,0,0,0,0|2,0,0]=4 2109 B12R1.41 CCOc1cc(Cl)cc(NN)c1 Amb26896605 [1,1,0,0,0,0|2,0,0]=4 2110 B12R1.41 CCOc1cc(F)cc(C=O)c1 Amb25689848 [1,1,0,0,0,0|0,0,0]=2 2111 B12R1.41 CCOc1cc(F)cc(CBr)c1 Amb27594277 [1,1,0,0,0,0|1,0,1]=4 2112 B12R1.41 CCOc1cc(F)cc(CO)c1 Amb25141606 [1,1,0,0,0,0|0,0,2]=4 2113 B12R1.41 CCOc1cc(F)cc(NN)c1 Amb27211274 [1,1,0,0,0,0|2,0,0]=4 2114 B12R1.41 CCOc1cc(F)cc(SC)c1 Amb27489940 [1,1,0,0,0,0|2,0,0]=4 2115 B12R1.41 CCOc1cc(I)cc(NN)c1 Amb27428161 [1,1,0,0,0,0|2,0,0]=4 2116 B12R1.41 CCOc1cc(N)cc(CC)c1 Amb28056787 [1,1,0,0,0,0|1,0,1]=4 2117 B12R1.41 CCOc1cc(N)cc(NN)c1 Amb25981194 [1,1,0,0,0,0|2,0,0]=4 2118 B12R1.41 CCOc1cc(N)cc(OC)c1 Amb24742430 [1,1,0,0,0,0|2,0,0]=4 2119 B12R1.41 CCOc1cc(O)cc(C=O)c1 Amb22263400 [1,1,0,0,0,0|0,0,0]=2 2120 B12R1.41 CCOc1cc(O)cc(CBr)c1 Amb28203795 [1,1,0,0,0,0|1,0,1]=4 2121 B12R1.41 CCOc1cc(O)cc(NN)c1 Amb24695799 [1,1,0,0,0,0|2,0,0]=4 2122 B12R1.41 COCc1cc(Br)cc(C=O)c1 Amb33728685 [1,1,0,0,0,0|2,0,0]=4 2123 B12R1.278 C#CCc1cccc(OCC)c1 Amb33272714 [1,1,0,0,0,0|1,0,1]=4 2124 B12R1.278 C#NCc1cccc(OCC)c1 Amb31111992 [1,1,0,0,0,0|1,0,1]=4 2125 B12R1.278 CCCc1cccc(\C=C\Br)c1 Amb33135422 [1,1,0,0,0,0|2,0,0]=4 2126 B12R1.278 CCCc1cccc(\C=N\N)c1 Amb27449068 [1,1,0,0,0,0|2,0,0]=4 2127 B12R1.278 CCOc1cc(N=C=O)ccn1 Amb27175722 [1,1,0,0,0,0|1,0,1]=4 2128 B12R1.278 CCOc1cccc(CC#N)c1 Amb2687750 [1,1,0,0,0,0|1,0,1]=4 2129 B12R1.278 CCOc1cccc(CC=O)c1 Amb17089533 [1,1,0,0,0,0|0,0,0]=2 2130 B12R1.278 CCOc1cccc(CCBr)c1 Amb33451085 [1,1,0,0,0,0|1,0,1]=4 2131 B12R1.278 CCOc1cccc(CCN)c1 Amb2687747 [1,1,0,0,0,0|1,0,1]=4 2132 B12R1.278 CCOc1cccc(CCN)c1 Amb35749866 [1,1,0,0,0,0|1,0,1]=4 2133 B12R1.278 CCOc1cccc(CCO)c1 Amb17089520 [1,1,0,0,0,0|0,0,2]=4 2134 B12R1.278 CCOc1cccc(CCS)c1 Amb30593586 [1,1,0,0,0,0|0,1,1]=4 2135 B12R1.278 CCOc1cccc(CNC)c1 Amb6864925 [1,1,0,0,0,0|1,0,1]=4 2136 B12R1.278 CCOc1cccc(CNC)c1 Amb7173566 [1,1,0,0,0,0|1,0,1]=4 2137 B12R1.278 CCOc1cccc(CNN)c1 Amb18792773 [1,1,0,0,0,0|1,0,1]=4 2138 B12R1.278 CCOc1cccc(CNO)c1 Amb33380762 [1,1,0,0,0,0|0,0,2]=4 2139 B12R1.278 CCOc1cccc(CON)c1 Amb33272733 [1,1,0,0,0,0|0,0,2]=4 2140 B12R1.278 CCOc1cccc(N=C=O)c1 Amb22337133 [1,1,0,0,0,0|0,0,1]=3 2141 B12R1.278 CCOc1cccc(N=C=S)c1 Amb18796149 [1,1,0,0,0,0|0,1,1]=4 2142 B12R1.278 CCOc1cccc(OCC)c1 Amb4017979 [1,1,0,0,0,0|1,0,1]=4 2143 B12R1.278 CCOc1cccc(\C=C\Br)c1 Amb33134998 [1,1,0,0,0,0|1,0,0]=3 2144 B12R1.278 CCOc1cncc(\C=C\Br)c1 Amb33135434 [1,1,0,0,0,0|2,0,0]=4 2145 B12R1.278 CCSc1cccc(NC=O)c1 Amb35690508 [1,1,0,0,0,0|0,1,0]=3 2146 B12R1.278 CCSc1cccc(\C=C\Br)c1 Amb33135593 [1,1,0,0,0,0|1,1,0]=4 2147 B12R1.278 COCc1cccc(CC=O)c1 Amb33474080 [1,1,0,0,0,0|2,0,0]=4 2148 B12R1.278 [C-]#[N+]Cc1cccc(OCC)c1 Amb3973088 [1,1,0,0,0,0|1,0,1]=4 2149 B12R1.279 C=C(C)c1cncc(OCC)c1 Amb32641622 [1,1,0,0,0,0|2,0,0]=4 2150 B12R1.279 C=COc1cccc(C(C)=O)c1 Amb25978740 [1,1,0,0,0,0|0,0,2]=4 2151 B12R1.279 CC#Cc1cccc(C(N)=O)c1 Amb27607703 [1,1,0,0,0,0|1,0,1]=4 2152 B12R1.279 CC(=O)c1cccc(CCF)c1 Amb27448409 [1,1,0,0,0,0|2,0,0]=4 2153 B12R1.279 CC(=O)c1cccc(CCN)c1 Amb25149800 [1,1,0,0,0,0|2,0,0]=4 2154 B12R1.279 CC(=O)c1cccc(NCO)c1 Amb27587638 [1,1,0,0,0,0|2,0,0]=4 2155 B12R1.279 CC(=O)c1cccc(OCCl)c1 Amb26859150 [1,1,0,0,0,0|1,0,0]=3 2156 B12R1.279 CC(=O)c1cncc(OCF)c1 Amb27949152 [1,1,0,0,0,0|2,0,0]=4 2157 B12R1.279 CCCc1cc(C(=O)O)ccn1 Amb16229681 [1,1,0,0,0,0|2,0,0]=4 2158 B12R1.279 CCCc1cc(C(N)=O)ccn1 Amb13949981 [1,1,0,0,0,0|2,0,0]=4 2159 B12R1.279 CCCc1cccc(C(=O)O)c1 Amb25221605 [1,1,0,0,0,0|1,0,0]=3 2160 B12R1.279 CCCc1cccc(C(=O)O)n1 Amb18646284 [1,1,0,0,0,0|2,0,0]=4 2161 B12R1.279 CCCc1cccc(C(C)=O)c1 Amb25086711 [1,1,0,0,0,0|1,0,0]=3 2162 B12R1.279 CCCc1cccc(C(C)=O)n1 Amb25915155 [1,1,0,0,0,0|2,0,0]=4 2163 B12R1.279 CCCc1cncc(C(=O)O)c1 Amb26023150 [1,1,0,0,0,0|2,0,0]=4 2164 B12R1.279 CCCc1cncc(C(C)=O)c1 Amb24619636 [1,1,0,0,0,0|2,0,0]=4 2165 B12R1.279 CCNc1cc(C(=O)O)ccn1 Amb33533114 [1,1,0,0,0,0|2,0,0]=4 2166 B12R1.279 CCNc1cccc(C(=O)O)c1 Amb8833318 [1,1,0,0,0,0|1,0,0]=3 2167 B12R1.279 CCNc1cccc(C(C)=O)c1 Amb17306671 [1,1,0,0,0,0|1,0,0]=3 2168 B12R1.279 CCNc1cccc(C(N)=O)n1 Amb18296088 [1,1,0,0,0,0|2,0,0]=4 2169 B12R1.279 CCNc1cccc([N+](=O)[O-])c1 Amb9271751 [1,1,0,0,0,0|2,0,0]=4 2170 B12R1.279 CCNc1ccnc(C(C)=O)c1 Amb28400431 [1,1,0,0,0,0|2,0,0]=4 2171 B12R1.279 CCNc1cncc(C(=O)O)c1 Amb18267343 [1,1,0,0,0,0|2,0,0]=4 2172 B12R1.279 CCNc1cncc(C(C)=O)c1 Amb27218479 [1,1,0,0,0,0|2,0,0]=4 2173 B12R1.279 CCOc1cc(C(=O)Cl)ccn1 Amb27186377 [1,1,0,0,0,0|1,0,0]=3 2174 B12R1.279 CCOc1cc(C(=O)O)ccn1 Amb33532974 [1,1,0,0,0,0|1,0,0]=3 2175 B12R1.279 CCOc1cc(C(=O)O)cnn1 Amb23401893 [1,1,0,0,0,0|2,0,0]=4 2176 B12R1.279 CCOc1cc(C(=O)O)ncn1 Amb24598713 [1,1,0,0,0,0|2,0,0]=4 2177 B12R1.279 CCOc1cc(C(N)=S)ccn1 Amb6280775 [1,1,0,0,0,0|1,1,0]=4 2178 B12R1.279 CCOc1cccc(B(O)O)c1 Amb3939237 [1,1,0,0,0,0|1,0,1]=4 2179 B12R1.279 CCOc1cccc(C(=N)N)c1 Amb2696675 [1,1,0,0,0,0|1,0,0]=3 2180 B12R1.279 CCOc1cccc(C(=N)N)c1 Amb33552237 [1,1,0,0,0,0|1,0,0]=3 2181 B12R1.279 CCOc1cccc(C(=N)N)n1 Amb22277035 [1,1,0,0,0,0|2,0,0]=4 2182 B12R1.279 CCOc1cccc(C(=O)Cl)c1 Amb6298312 [1,1,0,0,0,0|0,0,0]=2 2183 B12R1.279 CCOc1cccc(C(=O)O)c1 Amb6336483 [1,1,0,0,0,0|0,0,0]=2 2184 B12R1.279 CCOc1cccc(C(=O)O)n1 Amb10069919 [1,1,0,0,0,0|1,0,0]=3 2185 B12R1.279 CCOc1cccc(C(C)=O)c1 Amb2221516 [1,1,0,0,0,0|0,0,0]=2 2186 B12R1.279 CCOc1cccc(C(C)=O)n1 Amb22754994 [1,1,0,0,0,0|1,0,0]=3 2187 B12R1.279 CCOc1cccc(C(C)C)c1 Amb26957800 [1,1,0,0,0,0|1,0,1]=4 2188 B12R1.279 CCOc1cccc(C(C)N)c1 Amb33543137 [1,1,0,0,0,0|1,0,1]=4 2189 B12R1.279 CCOc1cccc(C(C)O)c1 Amb9364633 [1,1,0,0,0,0|0,0,2]=4 2190 B12R1.279 CCOc1cccc(C(N)=O)c1 Amb6357760 [1,1,0,0,0,0|0,0,0]=2 2191 B12R1.279 CCOc1cccc(C(N)=O)n1 Amb25707886 [1,1,0,0,0,0|1,0,0]=3 2192 B12R1.279 CCOc1cccc(C(N)=S)c1 Amb403040 [1,1,0,0,0,0|0,1,0]=3 2193 B12R1.279 CCOc1cccc(N(C)C)c1 Amb28283397 [1,1,0,0,0,0|2,0,0]=4 2194 B12R1.279 CCOc1cccc(S(=O)[O-])c1 Amb27796829 [1,1,0,0,0,0|1,0,0]=3 2195 B12R1.279 CCOc1cccc(S(C)=O)n1 Amb27445984 [1,1,0,0,0,0|2,0,0]=4 2196 B12R1.279 CCOc1cccc([C@@H](C)N)c1 Amb16233962 [1,1,0,0,0,0|1,0,1]=4 2197 B12R1.279 CCOc1cccc([C@@H](C)N)c1 Amb22504248 [1,1,0,0,0,0|1,0,1]=4 2198 B12R1.279 CCOc1cccc([C@@H](C)O)c1 Amb26584930 [1,1,0,0,0,0|0,0,2]=4 2199 B12R1.279 CCOc1cccc([C@H](C)N)c1 Amb22298568 [1,1,0,0,0,0|1,0,1]=4 2200 B12R1.279 CCOc1cccc([C@H](C)N)c1 Amb28136225 [1,1,0,0,0,0|1,0,1]=4 2201 B12R1.279 CCOc1cccc([C@H](C)O)c1 Amb25221134 [1,1,0,0,0,0|0,0,2]=4 2202 B12R1.279 CCOc1cccc([N+](=O)[O-])c1 Amb4016525 [1,1,0,0,0,0|1,0,0]=3 2203 B12R1.279 CCOc1cccc([N+](=O)[O-])n1 Amb24628279 [1,1,0,0,0,0|2,0,0]=4 2204 B12R1.279 CCOc1ccnc(C(=N)N)c1 Amb22277034 [1,1,0,0,0,0|2,0,0]=4 2205 B12R1.279 CCOc1ccnc(C(=O)O)c1 Amb8836820 [1,1,0,0,0,0|1,0,0]=3 2206 B12R1.279 CCOc1ccnc(C(=O)O)n1 Amb26612282 [1,1,0,0,0,0|2,0,0]=4 2207 B12R1.279 CCOc1ccnc(C(C)=O)c1 Amb22754989 [1,1,0,0,0,0|1,0,0]=3 2208 B12R1.279 CCOc1ccnc(C(C)=O)n1 Amb25993973 [1,1,0,0,0,0|2,0,0]=4 2209 B12R1.279 CCOc1ccnc(C(N)=O)c1 Amb27452802 [1,1,0,0,0,0|1,0,0]=3 2210 B12R1.279 CCOc1ccnc(C(N)=S)c1 Amb18791443 [1,1,0,0,0,0|1,1,0]=4 2211 B12R1.279 CCOc1cncc(C(=O)O)c1 Amb22752670 [1,1,0,0,0,0|1,0,0]=3 2212 B12R1.279 CCOc1cncc(C(=O)O)n1 Amb24355362 [1,1,0,0,0,0|2,0,0]=4 2213 B12R1.279 CCOc1cncc(C(N)=O)c1 Amb27983524 [1,1,0,0,0,0|1,0,0]=3 2214 B12R1.279 CCOc1cncc(C(N)=O)n1 Amb27878757 [1,1,0,0,0,0|2,0,0]=4 2215 B12R1.279 CCOc1cncc(C(N)=S)c1 Amb27476039 [1,1,0,0,0,0|1,1,0]=4 2216 B12R1.279 CCOc1cncc([N+](=O)[O-])c1 Amb25074495 [1,1,0,0,0,0|2,0,0]=4 2217 B12R1.279 CCOc1nccc(C(=O)O)n1 Amb27657735 [1,1,0,0,0,0|2,0,0]=4 2218 B12R1.279 CCSc1cc(C(=O)O)ccn1 Amb6680239 [1,1,0,0,0,0|1,1,0]=4 2219 B12R1.279 CCSc1cc(C(C)=O)ccn1 Amb27464048 [1,1,0,0,0,0|1,1,0]=4 2220 B12R1.279 CCSc1cc(C(N)=O)ccn1 Amb27258928 [1,1,0,0,0,0|1,1,0]=4 2221 B12R1.279 CCSc1cccc(C(=O)O)c1 Amb18119564 [1,1,0,0,0,0|0,1,0]=3 2222 B12R1.279 CCSc1cccc(C(C)=O)c1 Amb27590483 [1,1,0,0,0,0|0,1,0]=3 2223 B12R1.279 CCSc1cccc(C(C)=O)n1 Amb35733710 [1,1,0,0,0,0|1,1,0]=4 2224 B12R1.279 CCSc1cccc([N+](=O)[O-])c1 Amb8387519 [1,1,0,0,0,0|1,1,0]=4 2225 B12R1.279 CCSc1cncc(C(=O)O)c1 Amb2795672 [1,1,0,0,0,0|1,1,0]=4 2226 B12R1.279 CNCc1cccc(C(=O)O)c1 Amb17309028 [1,1,0,0,0,0|2,0,0]=4 2227 B12R1.279 CNCc1cccc(C(N)=O)c1 Amb10609787 [1,1,0,0,0,0|2,0,0]=4 2228 B12R1.279 CNCc1cccc(C(N)=O)c1 Amb6274563 [1,1,0,0,0,0|2,0,0]=4 2229 B12R1.279 COCc1cccc(C(=O)O)c1 Amb1215305 [1,1,0,0,0,0|2,0,0]=4 2230 B12R1.279 COCc1cccc(C(C)=O)c1 Amb24086537 [1,1,0,0,0,0|2,0,0]=4 2231 B12R1.279 COCc1cccc(C(N)=O)c1 Amb8998267 [1,1,0,0,0,0|2,0,0]=4 2232 B12R1.279 CSCc1cccc(C(=O)O)c1 Amb433836 [1,1,0,0,0,0|2,0,0]=4 2233 B12R1.279 C\C=C\c1cccc(C(C)=O)c1 Amb8394460 [1,1,0,0,0,0|1,0,1]=4 2234 B12R1.279 NCCc1cccc(C(=O)O)c1 Amb33548462 [1,1,0,0,0,0|2,0,0]=4 2235 B12R1.279 NCCc1cccc(C(=O)O)c1 Amb5722065 [1,1,0,0,0,0|2,0,0]=4 2236 B12R1.279 NCCc1cccc(C(N)=O)c1 Amb13952706 [1,1,0,0,0,0|2,0,0]=4 2237 B12R1.279 NCCc1cccc(C(N)=O)c1 Amb9677560 [1,1,0,0,0,0|2,0,0]=4 2238 B12R1.279 O=C(O)c1cccc(CCO)c1 Amb22284366 [1,1,0,0,0,0|2,0,0]=4 2239 B12R1.279 O=C(O)c1cccc(CCS)c1 Amb27878752 [1,1,0,0,0,0|2,0,0]=4 2240 B12R1.279 O=C(O)c1cccc(SCCl)c1 Amb24591530 [1,1,0,0,0,0|1,1,0]=4 2241 B12R1.279 O=[N+]([O-])c1cccc(OCCl)c1 Amb26975687 [1,1,0,0,0,0|2,0,0]=4 2242 B12R1.280 C#Cc1cccc(OCC)c1O Amb33377531 [1,1,0,0,0,0|1,0,1]=4 2243 B12R1.280 C=COc1cccc(C=O)c1Cl Amb27817197 [1,1,0,0,0,0|0,0,2]=4 2244 B12R1.280 C=Cc1cccc(OCC)c1O Amb33377521 [1,1,0,0,0,0|1,0,0]=3 2245 B12R1.280 CCCN1C=CC=C(C=O)C1=S Amb18548451 [1,1,0,0,0,0|2,0,0]=4 2246 B12R1.280 CCOc1cccc(C#N)c1Br Amb23597157 [1,1,0,0,0,0|1,0,1]=4 2247 B12R1.280 CCOc1cccc(C#N)c1F Amb21856394 [1,1,0,0,0,0|1,0,1]=4 2248 B12R1.280 CCOc1cccc(C#N)c1N Amb24472115 [1,1,0,0,0,0|1,0,1]=4 2249 B12R1.280 CCOc1cccc(C#N)c1O Amb23287208 [1,1,0,0,0,0|1,0,1]=4 2250 B12R1.280 CCOc1cccc(C#N)c1S Amb28364436 [1,1,0,0,0,0|1,0,1]=4 2251 B12R1.280 CCOc1cccc(C=N)c1O Amb26338269 [1,1,0,0,0,0|1,0,0]=3 2252 B12R1.280 CCOc1cccc(C=O)c1Br Amb25837927 [1,1,0,0,0,0|0,0,0]=2 2253 B12R1.280 CCOc1cccc(C=O)c1F Amb24757646 [1,1,0,0,0,0|0,0,0]=2 2254 B12R1.280 CCOc1cccc(C=O)c1N Amb27974512 [1,1,0,0,0,0|0,0,0]=2 2255 B12R1.280 CCOc1cccc(C=O)c1O Amb2721321 [1,1,0,0,0,0|0,0,0]=2 2256 B12R1.280 CCOc1cccc(C=O)c1S Amb32688024 [1,1,0,0,0,0|0,0,0]=2 2257 B12R1.280 CCOc1cccc(CBr)c1Br Amb27659112 [1,1,0,0,0,0|1,0,1]=4 2258 B12R1.280 CCOc1cccc(CBr)c1O Amb33388999 [1,1,0,0,0,0|1,0,1]=4 2259 B12R1.280 CCOc1cccc(CC)c1F Amb27652975 [1,1,0,0,0,0|1,0,1]=4 2260 B12R1.280 CCOc1cccc(CC)c1N Amb28044362 [1,1,0,0,0,0|1,0,1]=4 2261 B12R1.280 CCOc1cccc(CC)c1S Amb27630349 [1,1,0,0,0,0|1,0,1]=4 2262 B12R1.280 CCOc1cccc(CCl)c1O Amb33256994 [1,1,0,0,0,0|1,0,1]=4 2263 B12R1.280 CCOc1cccc(CN)c1Br Amb27413704 [1,1,0,0,0,0|1,0,1]=4 2264 B12R1.280 CCOc1cccc(CN)c1F Amb32670079 [1,1,0,0,0,0|1,0,1]=4 2265 B12R1.280 CCOc1cccc(CN)c1O Amb1119211 [1,1,0,0,0,0|1,0,1]=4 2266 B12R1.280 CCOc1cccc(CO)c1O Amb1109914 [1,1,0,0,0,0|0,0,2]=4 2267 B12R1.280 CCOc1cccc(CS)c1O Amb32788014 [1,1,0,0,0,0|0,1,1]=4 2268 B12R1.280 CCOc1cccc(NC)c1N Amb27983381 [1,1,0,0,0,0|2,0,0]=4 2269 B12R1.280 CCOc1cccc(NN)c1Br Amb27613889 [1,1,0,0,0,0|2,0,0]=4 2270 B12R1.280 CCOc1cccc(NN)c1C Amb26896724 [1,1,0,0,0,0|2,0,0]=4 2271 B12R1.280 CCOc1cccc(NN)c1Cl Amb26619966 [1,1,0,0,0,0|2,0,0]=4 2272 B12R1.280 CCOc1cccc(NN)c1F Amb26574966 [1,1,0,0,0,0|2,0,0]=4 2273 B12R1.280 CCOc1cccc(NN)c1I Amb24615851 [1,1,0,0,0,0|2,0,0]=4 2274 B12R1.280 CCOc1cccc(NN)c1N Amb26532762 [1,1,0,0,0,0|2,0,0]=4 2275 B12R1.280 CCOc1cccc(NN)c1O Amb28436305 [1,1,0,0,0,0|2,0,0]=4 2276 B12R1.280 CCOc1cccc(NN)c1S Amb28134376 [1,1,0,0,0,0|2,0,0]=4 2277 B12R1.280 CCOc1cccc(OC)c1Cl Amb28197295 [1,1,0,0,0,0|2,0,0]=4 2278 B12R1.280 CCOc1cccc(OC)c1N Amb18646730 [1,1,0,0,0,0|2,0,0]=4 2279 B12R1.280 CCOc1cccc(OC)c1O Amb28122336 [1,1,0,0,0,0|2,0,0]=4 2280 B12R1.280 CCOc1ccnc(C=O)c1C Amb26602620 [1,1,0,0,0,0|1,0,0]=3 2281 B12R1.280 CCOc1nccc(C=O)c1Cl Amb34911514 [1,1,0,0,0,0|1,0,0]=3 2282 B12R1.280 O=Cc1cccc(OCCl)c1Cl Amb25736740 [1,1,0,0,0,0|1,0,0]=3 2283 B12R1.286 C=Cc1nc(OCC)ccc1N Amb24411782 [1,1,0,0,0,0|2,0,0]=4 2284 B12R1.286 CCCc1ccc(N)c(C=O)c1 Amb27664463 [1,1,0,0,0,0|1,0,0]=3 2285 B12R1.286 CCCc1ccc(O)c(C=O)c1 Amb18798282 [1,1,0,0,0,0|1,0,0]=3 2286 B12R1.286 CCOc1cc(C=O)c(Br)cn1 Amb22490022 [1,1,0,0,0,0|1,0,0]=3 2287 B12R1.286 CCOc1cc(C=O)c(Cl)cn1 Amb34911497 [1,1,0,0,0,0|1,0,0]=3 2288 B12R1.286 CCOc1cc(C=O)c(F)cn1 Amb26598177 [1,1,0,0,0,0|1,0,0]=3 2289 B12R1.286 CCOc1ccc(Br)c(C#N)c1 Amb23597158 [1,1,0,0,0,0|1,0,1]=4 2290 B12R1.286 CCOc1ccc(Br)c(C=O)c1 Amb24065405 [1,1,0,0,0,0|0,0,0]=2 2291 B12R1.286 CCOc1ccc(Br)c(C=O)n1 Amb27841456 [1,1,0,0,0,0|1,0,0]=3 2292 B12R1.286 CCOc1ccc(Br)c(CC)c1 Amb28315295 [1,1,0,0,0,0|1,0,1]=4 2293 B12R1.286 CCOc1ccc(Br)c(CCl)c1 Amb27451725 [1,1,0,0,0,0|1,0,1]=4 2294 B12R1.286 CCOc1ccc(Br)c(CN)c1 Amb28455710 [1,1,0,0,0,0|1,0,1]=4 2295 B12R1.286 CCOc1ccc(Br)c(CO)c1 Amb26373909 [1,1,0,0,0,0|0,0,2]=4 2296 B12R1.286 CCOc1ccc(Br)c(OC)c1 Amb26080922 [1,1,0,0,0,0|2,0,0]=4 2297 B12R1.286 CCOc1ccc(C)c(C=O)c1 Amb24704667 [1,1,0,0,0,0|0,0,0]=2 2298 B12R1.286 CCOc1ccc(C)c(NN)c1 Amb27624809 [1,1,0,0,0,0|2,0,0]=4 2299 B12R1.286 CCOc1ccc(Cl)c(NN)c1 Amb25152278 [1,1,0,0,0,0|2,0,0]=4 2300 B12R1.286 CCOc1ccc(F)c(C#N)c1 Amb25938455 [1,1,0,0,0,0|1,0,1]=4 2301 B12R1.286 CCOc1ccc(F)c(NN)c1 Amb24488538 [1,1,0,0,0,0|2,0,0]=4 2302 B12R1.286 CCOc1ccc(I)c(NN)c1 Amb28323641 [1,1,0,0,0,0|2,0,0]=4 2303 B12R1.286 CCOc1ccc(N)c(C#N)c1 Amb24106147 [1,1,0,0,0,0|1,0,1]=4 2304 B12R1.286 CCOc1ccc(N)c(C=O)c1 Amb25114468 [1,1,0,0,0,0|0,0,0]=2 2305 B12R1.286 CCOc1ccc(N)c(CC)c1 Amb18057251 [1,1,0,0,0,0|1,0,1]=4 2306 B12R1.286 CCOc1ccc(N)c(CCl)c1 Amb27955638 [1,1,0,0,0,0|1,0,1]=4 2307 B12R1.286 CCOc1ccc(N)c(NN)c1 Amb27193288 [1,1,0,0,0,0|2,0,0]=4 2308 B12R1.286 CCOc1ccc(N)c(OC)c1 Amb24440713 [1,1,0,0,0,0|2,0,0]=4 2309 B12R1.286 CCOc1ccc(O)c(C#N)c1 Amb18055385 [1,1,0,0,0,0|1,0,1]=4 2310 B12R1.286 CCOc1ccc(O)c(C=O)c1 Amb415923 [1,1,0,0,0,0|0,0,0]=2 2311 B12R1.286 CCOc1ccc(O)c(CO)c1 Amb22535705 [1,1,0,0,0,0|0,0,2]=4 2312 B12R1.286 CCOc1ccc(O)c(NN)c1 Amb25921924 [1,1,0,0,0,0|2,0,0]=4 2313 B12R1.286 CCOc1ccc(S)c(NN)c1 Amb28436175 [1,1,0,0,0,0|2,0,0]=4 2314 B12R1.286 O=Cc1cc(CCO)ccc1Cl Amb26063079 [1,1,0,0,0,0|2,0,0]=4 2315 B12R1.286 O=Cc1cc(CCS)ccc1O Amb28246512 [1,1,0,0,0,0|2,0,0]=4 2316 B12R1.382 C#CCOc1cccc(C=O)c1 Amb3509752 [1,1,0,0,0,0|0,0,1]=3 2317 B12R1.382 C#Cc1cccc(OCCC)c1 Amb25997337 [1,1,0,0,0,0|1,0,1]=4 2318 B12R1.382 C#Cc1cccc(OCCN)c1 Amb32875602 [1,1,0,0,0,0|1,0,1]=4 2319 B12R1.382 C#Cc1cccc(OCOC)c1 Amb27466461 [1,1,0,0,0,0|1,0,1]=4 2320 B12R1.382 C=CCCc1cccc(C=O)c1 Amb24085224 [1,1,0,0,0,0|1,0,1]=4 2321 B12R1.382 C=CCNc1cccc(C=O)c1 Amb27251573 [1,1,0,0,0,0|1,0,1]=4 2322 B12R1.382 C=CCOc1cccc(C=O)c1 Amb1227717 [1,1,0,0,0,0|0,0,1]=3 2323 B12R1.382 CCCCc1cc(C=O)ccn1 Amb33068351 [1,1,0,0,0,0|2,0,0]=4 2324 B12R1.382 CCCCc1cncc(C=O)c1 Amb32751640 [1,1,0,0,0,0|2,0,0]=4 2325 B12R1.382 CCCOc1cccc(C#N)c1 Amb5761029 [1,1,0,0,0,0|1,0,1]=4 2326 B12R1.382 CCCOc1cccc(C=O)c1 Amb2589523 [1,1,0,0,0,0|0,0,0]=2 2327 B12R1.382 CCCOc1cccc(CBr)c1 Amb33528737 [1,1,0,0,0,0|1,0,1]=4 2328 B12R1.382 CCCOc1cccc(CN)c1 Amb10201546 [1,1,0,0,0,0|1,0,1]=4 2329 B12R1.382 CCCOc1cccc(CN)c1 Amb1135599 [1,1,0,0,0,0|1,0,1]=4 2330 B12R1.382 CCCOc1cccc(CO)c1 Amb3548881 [1,1,0,0,0,0|0,0,2]=4 2331 B12R1.382 CCCOc1cccc(CS)c1 Amb32788744 [1,1,0,0,0,0|0,1,1]=4 2332 B12R1.382 CCCOc1cccc(NN)c1 Amb17232618 [1,1,0,0,0,0|2,0,0]=4 2333 B12R1.382 CCCOc1cncc(C=O)c1 Amb32669061 [1,1,0,0,0,0|1,0,0]=3 2334 B12R1.382 CCOCc1cccc(CN)c1 Amb10609741 [1,1,0,0,0,0|1,0,1]=4 2335 B12R1.382 CCOCc1cccc(CN)c1 Amb1138303 [1,1,0,0,0,0|1,0,1]=4 2336 B12R1.382 CCc1cccc(OCCBr)c1 Amb1657338 [1,1,0,0,0,0|1,0,1]=4 2337 B12R1.382 CCc1cccc(OCCCl)c1 Amb8828481 [1,1,0,0,0,0|1,0,1]=4 2338 B12R1.382 CCc1cccc(OCCN)c1 Amb5358358 [1,1,0,0,0,0|1,0,1]=4 2339 B12R1.382 CCc1cccc(OCCO)c1 Amb9370543 [1,1,0,0,0,0|1,0,1]=4 2340 B12R1.382 CCc1cccc(OCCS)c1 Amb17233942 [1,1,0,0,0,0|1,0,1]=4 2341 B12R1.382 COc1cccc(OCCBr)c1 Amb836270 [1,1,0,0,0,0|2,0,0]=4 2342 B12R1.382 COc1cccc(OCCCl)c1 Amb8828422 [1,1,0,0,0,0|2,0,0]=4 2343 B12R1.382 COc1cccc(OCCN)c1 Amb1135524 [1,1,0,0,0,0|2,0,0]=4 2344 B12R1.382 COc1cccc(OCCN)c1 Amb4021768 [1,1,0,0,0,0|2,0,0]=4 2345 B12R1.382 COc1cccc(OCCO)c1 Amb2209352 [1,1,0,0,0,0|2,0,0]=4 2346 B12R1.382 COc1cccc(OCCS)c1 Amb2794984 [1,1,0,0,0,0|2,0,0]=4 2347 B12R1.382 CSc1cccc(OCCN)c1 Amb33148192 [1,1,0,0,0,0|2,0,0]=4 2348 B12R1.382 FCCOc1cccc(CBr)c1 Amb23580156 [1,1,0,0,0,0|1,0,1]=4 2349 B12R1.382 FCCOc1cccc(CCl)c1 Amb31207831 [1,1,0,0,0,0|1,0,1]=4 2350 B12R1.382 N#CCOc1cccc(C=O)c1 Amb6275383 [1,1,0,0,0,0|0,0,1]=3 2351 B12R1.382 N#Cc1cccc(OCCBr)c1 Amb6254993 [1,1,0,0,0,0|1,0,1]=4 2352 B12R1.382 N#Cc1cccc(OCCN)c1 Amb17562051 [1,1,0,0,0,0|1,0,1]=4 2353 B12R1.382 N#Cc1cccc(OCCO)c1 Amb6280681 [1,1,0,0,0,0|1,0,1]=4 2354 B12R1.382 N#Cc1cccc(OCCS)c1 Amb27652646 [1,1,0,0,0,0|1,0,1]=4 2355 B12R1.382 NCCOc1cccc(CO)c1 Amb18182646 [1,1,0,0,0,0|0,0,2]=4 2356 B12R1.382 NCc1cccc(OCCF)c1 Amb23580157 [1,1,0,0,0,0|1,0,1]=4 2357 B12R1.382 O=Cc1cccc(C#CCO)c1 Amb836607 [1,1,0,0,0,0|1,0,1]=4 2358 B12R1.382 O=Cc1cccc(OCCBr)c1 Amb535884 [1,1,0,0,0,0|0,0,0]=2 2359 B12R1.382 O=Cc1cccc(OCCF)c1 Amb23579958 [1,1,0,0,0,0|0,0,0]=2 2360 B12R1.382 O=Cc1cccc(OCCO)c1 Amb857578 [1,1,0,0,0,0|0,0,0]=2 2361 B12R1.382 O=Cc1cccc(\C=C\CO)c1 Amb27980713 [1,1,0,0,0,0|1,0,1]=4 2362 B12R1.382 OCCOc1cccc(CO)c1 Amb6705986 [1,1,0,0,0,0|0,0,2]=4 2363 B12R1.382 OCc1cccc(OCCF)c1 Amb23580003 [1,1,0,0,0,0|0,0,2]=4 2364 B12R1.435 C=Cc1cccc(C(=O)CC)c1 Amb27175868 [1,1,0,0,0,0|2,0,0]=4 2365 B12R1.435 C=Cc1cccc([C@@H](N)CC)c1 Amb27425328 [1,1,0,0,0,0|2,0,0]=4 2366 B12R1.435 CCC(=O)c1cccc(C=O)c1 Amb17334555 [1,1,0,0,0,0|1,0,0]=3 2367 B12R1.435 CCC(C)c1cc(C=O)ccn1 Amb28386482 [1,1,0,0,0,0|2,0,0]=4 2368 B12R1.435 CCC(C)c1cncc(C=O)c1 Amb18829232 [1,1,0,0,0,0|2,0,0]=4 2369 B12R1.435 CCC(N)c1cccc(C=O)n1 Amb28341770 [1,1,0,0,0,0|2,0,0]=4 2370 B12R1.435 CC[C@@H](N)c1cncc(C=O)c1 Amb27668804 [1,1,0,0,0,0|2,0,0]=4 2371 B12R1.435 CNC(=O)c1cccc(C=O)c1 Amb19943944 [1,1,0,0,0,0|2,0,0]=4 2372 B12R1.435 COC(=N)c1cccc(C=O)c1 Amb24669051 [1,1,0,0,0,0|2,0,0]=4 2373 B12R1.435 COC(=O)c1cccc(C=O)c1 Amb3941035 [1,1,0,0,0,0|2,0,0]=4 2374 B12R1.435 O=Cc1cccc(C(O)CO)c1 Amb28063910 [1,1,0,0,0,0|2,0,0]=4 2375 B12R1.435 O=Cc1cccc([C@@H](O)CO)c1 Amb28292203 [1,1,0,0,0,0|2,0,0]=4 2376 B12R1.438 C#Cc1cccc(OC(C)C)c1 Amb19944534 [1,1,0,0,0,0|1,0,1]=4 2377 B12R1.438 C=Cc1cc(OC(C)C)ccn1 Amb26632739 [1,1,0,0,0,0|2,0,0]=4 2378 B12R1.438 C=Cc1cccc(CC(C)N)c1 Amb27461368 [1,1,0,0,0,0|2,0,0]=4 2379 B12R1.438 C=Cc1cccc(C[C@H](C)N)c1 Amb27225879 [1,1,0,0,0,0|2,0,0]=4 2380 B12R1.438 C=Cc1cccc(OC(C)C)n1 Amb26934923 [1,1,0,0,0,0|2,0,0]=4 2381 B12R1.438 C=Cc1cccc(OC(F)F)c1 Amb33405214 [1,1,0,0,0,0|2,0,0]=4 2382 B12R1.438 C=Cc1cncc(OC(C)C)c1 Amb24731819 [1,1,0,0,0,0|2,0,0]=4 2383 B12R1.438 CC(=O)Cc1cccc(C=O)c1 Amb27795055 [1,1,0,0,0,0|1,0,1]=4 2384 B12R1.438 CC(=O)Nc1cccc(C=O)c1 Amb18645817 [1,1,0,0,0,0|1,0,1]=4 2385 B12R1.438 CC(=O)Oc1cccc(C=O)c1 Amb2684204 [1,1,0,0,0,0|0,0,1]=3 2386 B12R1.438 CC(C)Cc1cc(C=O)ccn1 Amb24725304 [1,1,0,0,0,0|2,0,0]=4 2387 B12R1.438 CC(C)Cc1cccc(C=O)c1 Amb24483552 [1,1,0,0,0,0|1,0,0]=3 2388 B12R1.438 CC(C)Cc1cncc(C=O)c1 Amb18829233 [1,1,0,0,0,0|2,0,0]=4 2389 B12R1.438 CC(C)Nc1cccc(C=O)c1 Amb27652606 [1,1,0,0,0,0|1,0,0]=3 2390 B12R1.438 CC(C)Nc1cncc(C=O)c1 Amb27863222 [1,1,0,0,0,0|2,0,0]=4 2391 B12R1.438 CC(C)Oc1cc(C=O)ccn1 Amb25078078 [1,1,0,0,0,0|1,0,0]=3 2392 B12R1.438 CC(C)Oc1cccc(C#N)c1 Amb6262581 [1,1,0,0,0,0|1,0,1]=4 2393 B12R1.438 CC(C)Oc1cccc(C=O)c1 Amb1058857 [1,1,0,0,0,0|0,0,0]=2 2394 B12R1.438 CC(C)Oc1cccc(CBr)c1 Amb8835673 [1,1,0,0,0,0|1,0,1]=4 2395 B12R1.438 CC(C)Oc1cccc(CN)c1 Amb10767236 [1,1,0,0,0,0|1,0,1]=4 2396 B12R1.438 CC(C)Oc1cccc(CN)c1 Amb1130741 [1,1,0,0,0,0|1,0,1]=4 2397 B12R1.438 CC(C)Oc1cccc(CO)c1 Amb6706058 [1,1,0,0,0,0|0,0,2]=4 2398 B12R1.438 CC(C)Oc1cccc(CS)c1 Amb24487512 [1,1,0,0,0,0|0,1,1]=4 2399 B12R1.438 CC(C)Oc1cccc(NN)c1 Amb17232619 [1,1,0,0,0,0|2,0,0]=4 2400 B12R1.438 CC(C)Oc1ccnc(C=O)c1 Amb27851603 [1,1,0,0,0,0|1,0,0]=3 2401 B12R1.438 CC(C)Oc1ccnc(C=O)n1 Amb27642679 [1,1,0,0,0,0|2,0,0]=4 2402 B12R1.438 CC(C)Oc1cncc(C=O)c1 Amb25831649 [1,1,0,0,0,0|1,0,0]=3 2403 B12R1.438 CN(C)Cc1cccc(C=O)c1 Amb10607671 [1,1,0,0,0,0|2,0,0]=4 2404 B12R1.438 CSc1cccc(OC(C)C)c1 Amb24487356 [1,1,0,0,0,0|2,0,0]=4 2405 B12R1.438 C[C@@H](O)Cc1cccc(C=O)c1 Amb22896919 [1,1,0,0,0,0|1,0,0]=3 2406 B12R1.438 O=Cc1cc(OC(F)F)ccn1 Amb27434857 [1,1,0,0,0,0|2,0,0]=4 2407 B12R1.438 O=Cc1cccc(OC(=O)Cl)c1 Amb27408638 [1,1,0,0,0,0|1,0,1]=4 2408 B12R1.438 O=Cc1cccc(OC(F)F)c1 Amb33528351 [1,1,0,0,0,0|1,0,0]=3 2409 B12R1.438 O=Cc1cccc(OC(F)F)n1 Amb28135785 [1,1,0,0,0,0|2,0,0]=4 2410 B12R1.438 O=Cc1ccnc(OC(F)F)c1 Amb22236381 [1,1,0,0,0,0|2,0,0]=4 2411 B12R1.56 CC(=O)c1ccc(Cl)c(CN)c1 Amb27851458 [1,1,0,0,0,0|2,0,0]=4 2412 B12R1.56 CC(=O)c1ccc(O)c(C=O)c1 Amb18645957 [1,1,0,0,0,0|1,0,1]=4 2413 B12R1.56 CC(=O)c1ccc(O)c(CCl)c1 Amb1103706 [1,1,0,0,0,0|1,0,0]=3 2414 B12R1.56 CC(=O)c1ccc(O)c(CN)c1 Amb27947395 [1,1,0,0,0,0|1,0,0]=3 2415 B12R1.56 CC(=O)c1ccc(O)c(CO)c1 Amb1109886 [1,1,0,0,0,0|1,0,0]=3 2416 B12R1.56 CC(=O)c1ccc(O)c(N=O)c1 Amb25917951 [1,1,0,0,0,0|2,0,0]=4 2417 B12R1.56 CCN1C=C(C(=O)Cl)C=CC1=O Amb25097038 [1,1,0,0,0,0|1,0,1]=4 2418 B12R1.56 CCN1C=C(C(=O)O)C=CC1=O Amb18281013 [1,1,0,0,0,0|1,0,1]=4 2419 B12R1.56 CCN1C=C(C(N)=O)C=CC1=O Amb25299167 [1,1,0,0,0,0|1,0,1]=4 2420 B12R1.56 CCc1cc(B(O)O)ccc1O Amb25959059 [1,1,0,0,0,0|1,0,1]=4 2421 B12R1.56 CCc1cc(C(=O)Cl)ccc1Cl Amb26608893 [1,1,0,0,0,0|1,0,0]=3 2422 B12R1.56 CCc1cc(C(=O)Cl)ccc1F Amb27874713 [1,1,0,0,0,0|1,0,0]=3 2423 B12R1.56 CCc1cc(C(=O)O)ccc1Br Amb33549090 [1,1,0,0,0,0|1,0,0]=3 2424 B12R1.56 CCc1cc(C(=O)O)ccc1C Amb26611442 [1,1,0,0,0,0|1,0,0]=3 2425 B12R1.56 CCc1cc(C(=O)O)ccc1Cl Amb19892756 [1,1,0,0,0,0|1,0,0]=3 2426 B12R1.56 CCc1cc(C(=O)O)ccc1F Amb16233181 [1,1,0,0,0,0|1,0,0]=3 2427 B12R1.56 CCc1cc(C(=O)O)ccc1I Amb25351541 [1,1,0,0,0,0|1,0,0]=3 2428 B12R1.56 CCc1cc(C(=O)O)ccc1N Amb2697546 [1,1,0,0,0,0|1,0,0]=3 2429 B12R1.56 CCc1cc(C(=O)O)ccc1O Amb9828624 [1,1,0,0,0,0|0,0,0]=2 2430 B12R1.56 CCc1cc(C(=O)O)ccc1S Amb24367707 [1,1,0,0,0,0|0,1,0]=3 2431 B12R1.56 CCc1cc(C(=O)O)ncc1Cl Amb18822253 [1,1,0,0,0,0|2,0,0]=4 2432 B12R1.56 CCc1cc(C(=O)O)nnc1O Amb26883745 [1,1,0,0,0,0|2,0,0]=4 2433 B12R1.56 CCc1cc(C(C)=O)ccc1C Amb26992472 [1,1,0,0,0,0|1,0,0]=3 2434 B12R1.56 CCc1cc(C(C)=O)ccc1Cl Amb24573695 [1,1,0,0,0,0|1,0,0]=3 2435 B12R1.56 CCc1cc(C(C)=O)ccc1F Amb27762492 [1,1,0,0,0,0|1,0,0]=3 2436 B12R1.56 CCc1cc(C(N)=O)ccc1Cl Amb28399114 [1,1,0,0,0,0|1,0,0]=3 2437 B12R1.56 CCc1cc(C(N)=O)ccc1I Amb32685340 [1,1,0,0,0,0|1,0,0]=3 2438 B12R1.56 CCc1cc([N+](=O)[O-])ccc1Br Amb23577601 [1,1,0,0,0,0|2,0,0]=4 2439 B12R1.56 CCc1cc([N+](=O)[O-])ccc1C Amb26604726 [1,1,0,0,0,0|2,0,0]=4 2440 B12R1.56 CCc1cc([N+](=O)[O-])ccc1Cl Amb23577595 [1,1,0,0,0,0|2,0,0]=4 2441 B12R1.56 CCc1cc([N+](=O)[O-])ccc1F Amb22284847 [1,1,0,0,0,0|2,0,0]=4 2442 B12R1.56 CCc1cc([N+](=O)[O-])ccc1I Amb26318838 [1,1,0,0,0,0|2,0,0]=4 2443 B12R1.56 CCc1cc([N+](=O)[O-])ccc1N Amb27439354 [1,1,0,0,0,0|2,0,0]=4 2444 B12R1.56 CCc1cc([N+](=O)[O-])ccc1S Amb25699015 [1,1,0,0,0,0|1,1,0]=4 2445 B12R1.56 CCc1nc(C(=O)O)ccc1F Amb27175581 [1,1,0,0,0,0|2,0,0]=4 2446 B12R1.56 CNc1cc(C(=O)O)ccc1Br Amb27255324 [1,1,0,0,0,0|2,0,0]=4 2447 B12R1.56 CNc1cc(C(=O)O)ccc1F Amb18288737 [1,1,0,0,0,0|2,0,0]=4 2448 B12R1.56 CNc1cc(C(=O)O)ccc1N Amb22498830 [1,1,0,0,0,0|2,0,0]=4 2449 B12R1.56 CNc1cc(C(=O)O)ccc1O Amb16229666 [1,1,0,0,0,0|1,0,0]=3 2450 B12R1.56 CNc1cc(C(C)=O)ccc1Cl Amb18267388 [1,1,0,0,0,0|2,0,0]=4 2451 B12R1.56 CNc1cc(C(C)=O)ccc1F Amb18267393 [1,1,0,0,0,0|2,0,0]=4 2452 B12R1.56 CNc1cc(C(C)=O)ccc1O Amb26994873 [1,1,0,0,0,0|1,0,0]=3 2453 B12R1.56 CNc1cc(C(N)=O)ccc1N Amb22500933 [1,1,0,0,0,0|2,0,0]=4 2454 B12R1.56 CNc1cc([N+](=O)[O-])ccc1O Amb28366230 [1,1,0,0,0,0|2,0,0]=4 2455 B12R1.56 COC1=CC(C(C)=O)=CCC1=S Amb27416356 [1,1,0,0,0,0|0,1,1]=4 2456 B12R1.56 CON1C=C(C(=O)O)C=CC1=O Amb28343136 [1,1,0,0,0,0|1,0,1]=4 2457 B12R1.56 COc1cc(B(O)O)ccc1O Amb20171349 [1,1,0,0,0,0|1,0,1]=4 2458 B12R1.56 COc1cc(C(=N)N)ccc1Br Amb33337622 [1,1,0,0,0,0|2,0,0]=4 2459 B12R1.56 COc1cc(C(=N)N)ccc1C Amb21984595 [1,1,0,0,0,0|2,0,0]=4 2460 B12R1.56 COc1cc(C(=N)N)ccc1C Amb26374214 [1,1,0,0,0,0|2,0,0]=4 2461 B12R1.56 COc1cc(C(=N)N)ccc1Cl Amb33407745 [1,1,0,0,0,0|2,0,0]=4 2462 B12R1.56 COc1cc(C(=N)N)ccc1F Amb25808757 [1,1,0,0,0,0|2,0,0]=4 2463 B12R1.56 COc1cc(C(=N)N)ccc1O Amb13883010 [1,1,0,0,0,0|1,0,0]=3 2464 B12R1.56 COc1cc(C(=N)N)ccc1O Amb2696250 [1,1,0,0,0,0|1,0,0]=3 2465 B12R1.56 COc1cc(C(=O)Cl)ccc1Br Amb26056298 [1,1,0,0,0,0|1,0,0]=3 2466 B12R1.56 COc1cc(C(=O)Cl)ccc1Cl Amb26043134 [1,1,0,0,0,0|1,0,0]=3 2467 B12R1.56 COc1cc(C(=O)Cl)ccc1F Amb10841633 [1,1,0,0,0,0|1,0,0]=3 2468 B12R1.56 COc1cc(C(=O)Cl)ccc1I Amb28286699 [1,1,0,0,0,0|1,0,0]=3 2469 B12R1.56 COc1cc(C(=O)Cl)ccc1N Amb26590907 [1,1,0,0,0,0|1,0,0]=3 2470 B12R1.56 COc1cc(C(=O)Cl)ccc1O Amb25230620 [1,1,0,0,0,0|0,0,0]=2 2471 B12R1.56 COc1cc(C(=O)Cl)cnc1Cl Amb27229123 [1,1,0,0,0,0|2,0,0]=4 2472 B12R1.56 COc1cc(C(=O)O)ccc1Br Amb10072104 [1,1,0,0,0,0|1,0,0]=3 2473 B12R1.56 COc1cc(C(=O)O)ccc1C Amb1229907 [1,1,0,0,0,0|1,0,0]=3 2474 B12R1.56 COc1cc(C(=O)O)ccc1Cl Amb6335836 [1,1,0,0,0,0|1,0,0]=3 2475 B12R1.56 COc1cc(C(=O)O)ccc1F Amb2688151 [1,1,0,0,0,0|1,0,0]=3 2476 B12R1.56 COc1cc(C(=O)O)ccc1I Amb10975711 [1,1,0,0,0,0|1,0,0]=3 2477 B12R1.56 COc1cc(C(=O)O)ccc1N Amb2721337 [1,1,0,0,0,0|1,0,0]=3 2478 B12R1.56 COc1cc(C(=O)O)ccc1O Amb2613984 [1,1,0,0,0,0|0,0,0]=2 2479 B12R1.56 COc1cc(C(=O)O)ccc1S Amb25946250 [1,1,0,0,0,0|0,1,0]=3 2480 B12R1.56 COc1cc(C(=O)O)cnc1Br Amb25148780 [1,1,0,0,0,0|2,0,0]=4 2481 B12R1.56 COc1cc(C(=O)O)cnc1Cl Amb19895310 [1,1,0,0,0,0|2,0,0]=4 2482 B12R1.56 COc1cc(C(=O)O)cnc1F Amb26966945 [1,1,0,0,0,0|2,0,0]=4 2483 B12R1.56 COc1cc(C(=O)O)cnc1N Amb27460181 [1,1,0,0,0,0|2,0,0]=4 2484 B12R1.56 COc1cc(C(=O)O)cnc1O Amb13889895 [1,1,0,0,0,0|1,0,0]=3 2485 B12R1.56 COc1cc(C(=O)O)ncc1Br Amb25317914 [1,1,0,0,0,0|2,0,0]=4 2486 B12R1.56 COc1cc(C(=O)O)ncc1C Amb20248032 [1,1,0,0,0,0|2,0,0]=4 2487 B12R1.56 COc1cc(C(=O)O)ncc1C Amb20622842 [1,1,0,0,0,0|2,0,0]=4 2488 B12R1.56 COc1cc(C(=O)O)ncc1F Amb27471840 [1,1,0,0,0,0|2,0,0]=4 2489 B12R1.56 COc1cc(C(=O)[O-])ccc1Cl Amb33513200 [1,1,0,0,0,0|1,0,0]=3 2490 B12R1.56 COc1cc(C(C)=O)ccc1Br Amb22500454 [1,1,0,0,0,0|1,0,0]=3 2491 B12R1.56 COc1cc(C(C)=O)ccc1C Amb26582917 [1,1,0,0,0,0|1,0,0]=3 2492 B12R1.56 COc1cc(C(C)=O)ccc1Cl Amb17335724 [1,1,0,0,0,0|1,0,0]=3 2493 B12R1.56 COc1cc(C(C)=O)ccc1F Amb2688142 [1,1,0,0,0,0|1,0,0]=3 2494 B12R1.56 COc1cc(C(C)=O)ccc1I Amb23437509 [1,1,0,0,0,0|1,0,0]=3 2495 B12R1.56 COc1cc(C(C)=O)ccc1N Amb2608648 [1,1,0,0,0,0|1,0,0]=3 2496 B12R1.56 COc1cc(C(C)=O)ccc1O Amb2608866 [1,1,0,0,0,0|0,0,0]=2 2497 B12R1.56 COc1cc(C(C)=O)ccc1S Amb26939468 [1,1,0,0,0,0|0,1,0]=3 2498 B12R1.56 COc1cc(C(C)=O)cnc1Br Amb25933741 [1,1,0,0,0,0|2,0,0]=4 2499 B12R1.56 COc1cc(C(C)=O)ncc1Br Amb28119179 [1,1,0,0,0,0|2,0,0]=4 2500 B12R1.56 COc1cc(C(C)=O)ncc1F Amb24514191 [1,1,0,0,0,0|2,0,0]=4 2501 B12R1.56 COc1cc(C(C)Br)ccc1O Amb28288471 [1,1,0,0,0,0|1,0,1]=4 2502 B12R1.56 COc1cc(C(C)C)ccc1O Amb18893522 [1,1,0,0,0,0|1,0,1]=4 2503 B12R1.56 COc1cc(C(C)O)ccc1O Amb1110981 [1,1,0,0,0,0|0,0,2]=4 2504 B12R1.56 COc1cc(C(C)S)ccc1O Amb7784718 [1,1,0,0,0,0|0,1,1]=4 2505 B12R1.56 COc1cc(C(F)F)ccc1O Amb26315417 [1,1,0,0,0,0|1,0,1]=4 2506 B12R1.56 COc1cc(C(N)=O)ccc1Br Amb10068105 [1,1,0,0,0,0|1,0,0]=3 2507 B12R1.56 COc1cc(C(N)=O)ccc1C Amb6297122 [1,1,0,0,0,0|1,0,0]=3 2508 B12R1.56 COc1cc(C(N)=O)ccc1Cl Amb22501141 [1,1,0,0,0,0|1,0,0]=3 2509 B12R1.56 COc1cc(C(N)=O)ccc1F Amb22738942 [1,1,0,0,0,0|1,0,0]=3 2510 B12R1.56 COc1cc(C(N)=O)ccc1I Amb23437518 [1,1,0,0,0,0|1,0,0]=3 2511 B12R1.56 COc1cc(C(N)=O)ccc1N Amb21926663 [1,1,0,0,0,0|1,0,0]=3 2512 B12R1.56 COc1cc(C(N)=O)ccc1O Amb17594165 [1,1,0,0,0,0|0,0,0]=2 2513 B12R1.56 COc1cc(C(N)=O)ccc1S Amb28141901 [1,1,0,0,0,0|0,1,0]=3 2514 B12R1.56 COc1cc(C(N)=O)cnc1Cl Amb26893953 [1,1,0,0,0,0|2,0,0]=4 2515 B12R1.56 COc1cc(C(N)=O)ncc1Br Amb25095456 [1,1,0,0,0,0|2,0,0]=4 2516 B12R1.56 COc1cc(C(N)=S)ccc1Br Amb33337621 [1,1,0,0,0,0|1,1,0]=4 2517 B12R1.56 COc1cc(C(N)=S)ccc1C Amb25069476 [1,1,0,0,0,0|1,1,0]=4 2518 B12R1.56 COc1cc(C(N)=S)ccc1Cl Amb22901095 [1,1,0,0,0,0|1,1,0]=4 2519 B12R1.56 COc1cc(C(N)=S)ccc1F Amb27770222 [1,1,0,0,0,0|1,1,0]=4 2520 B12R1.56 COc1cc(C(N)=S)ccc1N Amb27264831 [1,1,0,0,0,0|1,1,0]=4 2521 B12R1.56 COc1cc(C(N)=S)ccc1O Amb1121242 [1,1,0,0,0,0|0,1,0]=3 2522 B12R1.56 COc1cc(N(=O)=O)ccc1Br Amb6365680 [1,1,0,0,0,0|2,0,0]=4 2523 B12R1.56 COc1cc(N(=O)=O)ccc1Cl Amb20620771 [1,1,0,0,0,0|2,0,0]=4 2524 B12R1.56 COc1cc(N(=O)=O)ccc1F Amb20621290 [1,1,0,0,0,0|2,0,0]=4 2525 B12R1.56 COc1cc(N(=O)=O)ccc1I Amb20621470 [1,1,0,0,0,0|2,0,0]=4 2526 B12R1.56 COc1cc(N(=O)=O)ccc1N Amb6357360 [1,1,0,0,0,0|2,0,0]=4 2527 B12R1.56 COc1cc(N(=O)=O)ccc1O Amb6357122 [1,1,0,0,0,0|1,0,0]=3 2528 B12R1.56 COc1cc(N(C)C)ccc1O Amb24648652 [1,1,0,0,0,0|2,0,0]=4 2529 B12R1.56 COc1cc(S(=O)[O-])ccc1Br Amb27608706 [1,1,0,0,0,0|2,0,0]=4 2530 B12R1.56 COc1cc(S(=O)[O-])ccc1Cl Amb32755519 [1,1,0,0,0,0|2,0,0]=4 2531 B12R1.56 COc1cc(S(=O)[O-])ccc1F Amb32754713 [1,1,0,0,0,0|2,0,0]=4 2532 B12R1.56 COc1cc(S(C)=O)ccc1N Amb27654140 [1,1,0,0,0,0|2,0,0]=4 2533 B12R1.56 COc1cc(S(C)=O)ccc1O Amb27240741 [1,1,0,0,0,0|1,0,0]=3 2534 B12R1.56 COc1cc([C@@H](C)N)ccc1O Amb24076217 [1,1,0,0,0,0|1,0,1]=4 2535 B12R1.56 COc1cc([C@@H](C)O)ccc1O Amb28385288 [1,1,0,0,0,0|0,0,2]=4 2536 B12R1.56 COc1cc([C@H](C)N)ccc1O Amb26034834 [1,1,0,0,0,0|1,0,1]=4 2537 B12R1.56 COc1cc([C@H](C)O)ccc1O Amb27218675 [1,1,0,0,0,0|0,0,2]=4 2538 B12R1.56 COc1cc([N+](=O)[O-])ccc1Br Amb6298858 [1,1,0,0,0,0|2,0,0]=4 2539 B12R1.56 COc1cc([N+](=O)[O-])ccc1C Amb2582782 [1,1,0,0,0,0|2,0,0]=4 2540 B12R1.56 COc1cc([N+](=O)[O-])ccc1Cl Amb2686278 [1,1,0,0,0,0|2,0,0]=4 2541 B12R1.56 COc1cc([N+](=O)[O-])ccc1F Amb6296551 [1,1,0,0,0,0|2,0,0]=4 2542 B12R1.56 COc1cc([N+](=O)[O-])ccc1I Amb2688862 [1,1,0,0,0,0|2,0,0]=4 2543 B12R1.56 COc1cc([N+](=O)[O-])ccc1N Amb2613527 [1,1,0,0,0,0|2,0,0]=4 2544 B12R1.56 COc1cc([N+](=O)[O-])ccc1O Amb6335799 [1,1,0,0,0,0|1,0,0]=3 2545 B12R1.56 COc1cc([N+](=O)[O-])ccc1S Amb24084554 [1,1,0,0,0,0|1,1,0]=4 2546 B12R1.56 COc1cc([N+](=O)[O-])cnc1O Amb19958892 [1,1,0,0,0,0|2,0,0]=4 2547 B12R1.56 COc1nc(C(=O)O)ccc1Br Amb21857409 [1,1,0,0,0,0|2,0,0]=4 2548 B12R1.56 COc1nc(C(=O)O)ccc1C Amb26517449 [1,1,0,0,0,0|2,0,0]=4 2549 B12R1.56 COc1nc(C(=O)O)ccc1Cl Amb19958651 [1,1,0,0,0,0|2,0,0]=4 2550 B12R1.56 COc1nc(C(=O)O)ccc1F Amb27840417 [1,1,0,0,0,0|2,0,0]=4 2551 B12R1.56 COc1nc(C(=O)O)ccc1I Amb22751238 [1,1,0,0,0,0|2,0,0]=4 2552 B12R1.56 COc1nc(C(=O)O)ccc1N Amb22751240 [1,1,0,0,0,0|2,0,0]=4 2553 B12R1.56 COc1nc(C(=O)O)ccc1O Amb28254865 [1,1,0,0,0,0|1,0,0]=3 2554 B12R1.56 COc1nc(C(C)=O)ccc1Br Amb26911312 [1,1,0,0,0,0|2,0,0]=4 2555 B12R1.56 COc1nc(C(C)=O)ccc1Cl Amb24725575 [1,1,0,0,0,0|2,0,0]=4 2556 B12R1.56 COc1nc(C(C)=O)ccc1F Amb27777437 [1,1,0,0,0,0|2,0,0]=4 2557 B12R1.56 COc1nc(C(C)=O)ccc1O Amb27847548 [1,1,0,0,0,0|1,0,0]=3 2558 B12R1.56 COc1nc(C(N)=O)ccc1C Amb27586410 [1,1,0,0,0,0|2,0,0]=4 2559 B12R1.56 COc1nc(C(N)=O)ccc1N Amb26359409 [1,1,0,0,0,0|2,0,0]=4 2560 B12R1.56 CS(=O)c1ccc(O)c(CO)c1 Amb27974051 [1,1,0,0,0,0|2,0,0]=4 2561 B12R1.56 CSc1cc(C(=O)O)ccc1Br Amb25260798 [1,1,0,0,0,0|1,1,0]=4 2562 B12R1.56 CSc1cc(C(=O)O)ccc1C Amb18636742 [1,1,0,0,0,0|1,1,0]=4 2563 B12R1.56 CSc1cc(C(=O)O)ccc1Cl Amb10808713 [1,1,0,0,0,0|1,1,0]=4 2564 B12R1.56 CSc1cc(C(=O)O)ccc1F Amb22059712 [1,1,0,0,0,0|1,1,0]=4 2565 B12R1.56 CSc1cc(C(=O)O)ccc1I Amb26630396 [1,1,0,0,0,0|1,1,0]=4 2566 B12R1.56 CSc1cc(C(=O)O)ccc1N Amb110778 [1,1,0,0,0,0|1,1,0]=4 2567 B12R1.56 CSc1cc(C(=O)O)ccc1N Amb2371588 [1,1,0,0,0,0|1,1,0]=4 2568 B12R1.56 CSc1cc(C(=O)O)ccc1O Amb27624208 [1,1,0,0,0,0|0,1,0]=3 2569 B12R1.56 CSc1cc(C(N)=O)ccc1F Amb28054108 [1,1,0,0,0,0|1,1,0]=4 2570 B12R1.56 CSc1cc([N+](=O)[O-])ccc1O Amb24558362 [1,1,0,0,0,0|1,1,0]=4 2571 B12R1.56 Cc1ccc(C(=O)O)cc1CBr Amb32679498 [1,1,0,0,0,0|2,0,0]=4 2572 B12R1.56 Cc1ccc(C(=O)O)cc1CCl Amb28436922 [1,1,0,0,0,0|2,0,0]=4 2573 B12R1.56 Cc1ccc(C(=O)O)cc1CN Amb24713723 [1,1,0,0,0,0|2,0,0]=4 2574 B12R1.56 Cc1ccc(C(=O)O)cc1CN Amb33172765 [1,1,0,0,0,0|2,0,0]=4 2575 B12R1.56 Cc1ccc(C(=O)O)cc1CO Amb23437467 [1,1,0,0,0,0|2,0,0]=4 2576 B12R1.56 N#Cc1cc(C(=O)O)ccc1O Amb10068292 [1,1,0,0,0,0|1,0,1]=4 2577 B12R1.56 N#Cc1cc(C(N)=O)ccc1O Amb27954715 [1,1,0,0,0,0|1,0,1]=4 2578 B12R1.56 NC(=O)c1ccc(Br)c(CBr)c1 Amb26934748 [1,1,0,0,0,0|2,0,0]=4 2579 B12R1.56 NC(=O)c1ccc(F)c(CBr)c1 Amb27817492 [1,1,0,0,0,0|2,0,0]=4 2580 B12R1.56 NCc1cc(C(=O)O)ccc1Cl Amb17594794 [1,1,0,0,0,0|2,0,0]=4 2581 B12R1.56 NCc1cc(C(=O)O)ccc1F Amb25149912 [1,1,0,0,0,0|2,0,0]=4 2582 B12R1.56 NCc1cc(C(=O)O)ccc1F Amb28872398 [1,1,0,0,0,0|2,0,0]=4 2583 B12R1.56 NCc1cc(C(=O)O)ccc1O Amb6369524 [1,1,0,0,0,0|1,0,0]=3 2584 B12R1.56 NCc1cc(C(=O)O)ccc1O Amb6872193 [1,1,0,0,0,0|1,0,0]=3 2585 B12R1.56 NCc1cc([N+](=O)[O-])ccc1O Amb2370822 [1,1,0,0,0,0|2,0,0]=4 2586 B12R1.56 NCc1cc([N+](=O)[O-])ccc1O Amb404772 [1,1,0,0,0,0|2,0,0]=4 2587 B12R1.56 Nc1ccc(C(=O)O)cc1CO Amb23437483 [1,1,0,0,0,0|2,0,0]=4 2588 B12R1.56 Nc1ccc(C(=O)O)cc1CS Amb27481772 [1,1,0,0,0,0|2,0,0]=4 2589 B12R1.56 O=C(Cl)c1ccc(Br)c(CBr)c1 Amb27244095 [1,1,0,0,0,0|2,0,0]=4 2590 B12R1.56 O=C(Cl)c1ccc(Cl)c(CI)c1 Amb27416529 [1,1,0,0,0,0|2,0,0]=4 2591 B12R1.56 O=C(O)c1ccc(Br)c(CBr)c1 Amb22735820 [1,1,0,0,0,0|2,0,0]=4 2592 B12R1.56 O=C(O)c1ccc(Br)c(CO)c1 Amb22233767 [1,1,0,0,0,0|2,0,0]=4 2593 B12R1.56 O=C(O)c1ccc(Cl)c(CBr)c1 Amb22735956 [1,1,0,0,0,0|2,0,0]=4 2594 B12R1.56 O=C(O)c1ccc(Cl)c(CO)c1 Amb23437474 [1,1,0,0,0,0|2,0,0]=4 2595 B12R1.56 O=C(O)c1ccc(F)c(CBr)c1 Amb22735642 [1,1,0,0,0,0|2,0,0]=4 2596 B12R1.56 O=C(O)c1ccc(F)c(CCl)c1 Amb26478511 [1,1,0,0,0,0|2,0,0]=4 2597 B12R1.56 O=C(O)c1ccc(F)c(CO)c1 Amb18967401 [1,1,0,0,0,0|2,0,0]=4 2598 B12R1.56 O=C(O)c1ccc(F)c(CS)c1 Amb18967403 [1,1,0,0,0,0|2,0,0]=4 2599 B12R1.56 O=C(O)c1ccc(I)c(CCl)c1 Amb27856385 [1,1,0,0,0,0|2,0,0]=4 2600 B12R1.56 O=C(O)c1ccc(I)c(CO)c1 Amb23437472 [1,1,0,0,0,0|2,0,0]=4 2601 B12R1.56 O=C(O)c1ccc(O)c(CO)c1 Amb18646841 [1,1,0,0,0,0|1,0,0]=3 2602 B12R1.56 O=Cc1cc(C(=O)O)ccc1O Amb6296672 [1,1,0,0,0,0|1,0,1]=4 2603 B12R1.56 O=N(=O)c1ccc(O)c(CBr)c1 Amb20620520 [1,1,0,0,0,0|2,0,0]=4 2604 B12R1.56 O=[N+]([O-])c1ccc(O)c(CBr)c1 Amb3939719 [1,1,0,0,0,0|2,0,0]=4 2605 B12R1.56 O=[N+]([O-])c1ccc(O)c(CCl)c1 Amb375606 [1,1,0,0,0,0|2,0,0]=4 2606 B12R1.56 O=[N+]([O-])c1ccc(O)c(CO)c1 Amb837526 [1,1,0,0,0,0|2,0,0]=4 2607 B12R1.56 O=[N+]([O-])c1ccc(O)c(CS)c1 Amb33429831 [1,1,0,0,0,0|2,0,0]=4 2608 B12R1.78 C#Cc1ccc(C=O)nc1OC Amb27951627 [1,1,0,0,0,0|2,0,0]=4 2609 B12R1.78 C#Cc1ccc(OC)c(CC)c1 Amb25675704 [1,1,0,0,0,0|1,0,1]=4 2610 B12R1.78 C#Cc1ccc(OC)c(OC)c1 Amb8390522 [1,1,0,0,0,0|1,0,1]=4 2611 B12R1.78 C#Cc1cnc(C=O)cc1OC Amb25990596 [1,1,0,0,0,0|2,0,0]=4 2612 B12R1.78 C=Cc1cc(C=O)ccc1OC Amb32682039 [1,1,0,0,0,0|0,0,2]=4 2613 B12R1.78 C=Cc1ccc(C=O)nc1OC Amb27770669 [1,1,0,0,0,0|2,0,0]=4 2614 B12R1.78 C=Cc1ccc(OC)c(CN)c1 Amb27434091 [1,1,0,0,0,0|2,0,0]=4 2615 B12R1.78 C=Cc1ccc(OC)c(OC)c1 Amb17613145 [1,1,0,0,0,0|1,0,0]=3 2616 B12R1.78 C=Cc1cnc(C=O)cc1OC Amb25329652 [1,1,0,0,0,0|2,0,0]=4 2617 B12R1.78 C=Cc1cnc(CO)c(OC)c1 Amb27198449 [1,1,0,0,0,0|2,0,0]=4 2618 B12R1.78 C=Cc1cnc(OC)c(CC)c1 Amb27867482 [1,1,0,0,0,0|2,0,0]=4 2619 B12R1.78 C=Cc1cnc(OC)c(OC)c1 Amb26374699 [1,1,0,0,0,0|2,0,0]=4 2620 B12R1.78 CCc1cc(C=O)ccc1C#N Amb24084026 [1,1,0,0,0,0|1,0,0]=3 2621 B12R1.78 CCc1cc(C=O)ccc1NN Amb24651365 [1,1,0,0,0,0|1,0,0]=3 2622 B12R1.78 CCc1cc(C=O)ccc1OC Amb10807959 [1,1,0,0,0,0|0,0,0]=2 2623 B12R1.78 CCc1cc(CCl)ccc1OC Amb18863112 [1,1,0,0,0,0|1,0,1]=4 2624 B12R1.78 CCc1cc(CN)ccc1OC Amb18563701 [1,1,0,0,0,0|1,0,1]=4 2625 B12R1.78 CCc1cc(CO)ccc1OC Amb18862664 [1,1,0,0,0,0|0,0,2]=4 2626 B12R1.78 CCc1cc(CS)ccc1OC Amb17400955 [1,1,0,0,0,0|0,1,1]=4 2627 B12R1.78 CCc1cc(NC)ccc1OC Amb18563702 [1,1,0,0,0,0|2,0,0]=4 2628 B12R1.78 CCc1cc(NN)ccc1OC Amb18893528 [1,1,0,0,0,0|2,0,0]=4 2629 B12R1.78 CCc1cc(OC)ccc1CO Amb27865985 [1,1,0,0,0,0|2,0,0]=4 2630 B12R1.78 CCc1cc(OC)ccc1OC Amb1096582 [1,1,0,0,0,0|2,0,0]=4 2631 B12R1.78 CCc1cc(SC)ccc1CO Amb25720948 [1,1,0,0,0,0|2,0,0]=4 2632 B12R1.78 CCc1ccc(CO)c(CC)c1 Amb26519061 [1,1,0,0,0,0|1,0,1]=4 2633 B12R1.78 CCc1ccc(OC)c(OC)c1 Amb20242487 [1,1,0,0,0,0|1,0,1]=4 2634 B12R1.78 CCc1cnc(C=O)cc1OC Amb27803865 [1,1,0,0,0,0|2,0,0]=4 2635 B12R1.78 CNc1ccc(C=O)cc1OC Amb27813329 [1,1,0,0,0,0|1,0,0]=3 2636 B12R1.78 CNc1ccc(N=O)cc1OC Amb27392087 [1,1,0,0,0,0|2,0,0]=4 2637 B12R1.78 CNc1ccc(OC)c(OC)c1 Amb10610446 [1,1,0,0,0,0|2,0,0]=4 2638 B12R1.78 CNc1ccc(OC)c(OC)c1 Amb6710041 [1,1,0,0,0,0|2,0,0]=4 2639 B12R1.78 COc1cc(C#N)ccc1CO Amb25079658 [1,1,0,0,0,0|1,0,1]=4 2640 B12R1.78 COc1cc(C=O)ccc1C#N Amb22490052 [1,1,0,0,0,0|1,0,0]=3 2641 B12R1.78 COc1cc(C=O)ccc1NN Amb26621061 [1,1,0,0,0,0|1,0,0]=3 2642 B12R1.78 COc1cc(C=O)ccc1SC Amb13951518 [1,1,0,0,0,0|0,1,0]=3 2643 B12R1.78 COc1cc(C=O)cnc1OC Amb8426323 [1,1,0,0,0,0|1,0,0]=3 2644 B12R1.78 COc1cc(NN)ccc1CO Amb27793931 [1,1,0,0,0,0|2,0,0]=4 2645 B12R1.78 COc1cc(SC)ccc1CO Amb28137767 [1,1,0,0,0,0|2,0,0]=4 2646 B12R1.78 COc1ccc(C#N)cc1OC Amb6355881 [1,1,0,0,0,0|1,0,1]=4 2647 B12R1.78 COc1ccc(C=O)cc1C#N Amb19375054 [1,1,0,0,0,0|1,0,1]=4 2648 B12R1.78 COc1ccc(C=O)cc1C=O Amb2781469 [1,1,0,0,0,0|1,0,1]=4 2649 B12R1.78 COc1ccc(C=O)cc1CCl Amb6335565 [1,1,0,0,0,0|1,0,0]=3 2650 B12R1.78 COc1ccc(C=O)cc1CN Amb17666426 [1,1,0,0,0,0|1,0,0]=3 2651 B12R1.78 COc1ccc(C=O)cc1CO Amb534039 [1,1,0,0,0,0|1,0,0]=3 2652 B12R1.78 COc1ccc(C=O)cc1NN Amb26569353 [1,1,0,0,0,0|2,0,0]=4 2653 B12R1.78 COc1ccc(C=O)cc1OC Amb1873766 [1,1,0,0,0,0|0,0,0]=2 2654 B12R1.78 COc1ccc(C=O)cc1SC Amb19515075 [1,1,0,0,0,0|0,1,0]=3 2655 B12R1.78 COc1ccc(CBr)cc1OC Amb8395256 [1,1,0,0,0,0|1,0,1]=4 2656 B12R1.78 COc1ccc(CCl)cc1OC Amb6717224 [1,1,0,0,0,0|1,0,1]=4 2657 B12R1.78 COc1ccc(CN)cc1OC Amb1215005 [1,1,0,0,0,0|1,0,1]=4 2658 B12R1.78 COc1ccc(CN)cc1OC Amb2222274 [1,1,0,0,0,0|1,0,1]=4 2659 B12R1.78 COc1ccc(CO)c(OC)c1 Amb837424 [1,1,0,0,0,0|2,0,0]=4 2660 B12R1.78 COc1ccc(CO)cc1OC Amb3939320 [1,1,0,0,0,0|0,0,2]=4 2661 B12R1.78 COc1ccc(CS)cc1OC Amb17401033 [1,1,0,0,0,0|0,1,1]=4 2662 B12R1.78 COc1ccc(C[Zn+])cc1OC Amb22349187 [1,1,0,0,0,0|1,0,1]=4 2663 B12R1.78 COc1ccc(NN)cc1OC Amb10070256 [1,1,0,0,0,0|2,0,0]=4 2664 B12R1.78 COc1ccc(NN)cc1OC Amb17138629 [1,1,0,0,0,0|2,0,0]=4 2665 B12R1.78 COc1ccc(OC)c(OC)c1 Amb6357331 [1,1,0,0,0,0|2,0,0]=4 2666 B12R1.78 COc1ccc(SC)cc1OC Amb2687432 [1,1,0,0,0,0|2,0,0]=4 2667 B12R1.78 COc1ccc([Mg]Br)cc1OC Amb6300360 [1,1,0,0,0,0|2,0,0]=4 2668 B12R1.78 COc1cnc(C=O)cc1OC Amb18827380 [1,1,0,0,0,0|1,0,0]=3 2669 B12R1.78 COc1ncc(C=O)nc1OC Amb27799767 [1,1,0,0,0,0|2,0,0]=4 2670 B12R1.78 CSc1cc(C=O)ccc1NN Amb28323443 [1,1,0,0,0,0|1,1,0]=4 2671 B12R1.78 N#Cc1ccc(C=O)cc1CBr Amb27828668 [1,1,0,0,0,0|2,0,0]=4 2672 B12R1.78 NNc1ccc(C=O)cc1CBr Amb25267989 [1,1,0,0,0,0|2,0,0]=4 2673 B12R1.78 NNc1ccc(C=O)cc1CCl Amb27782176 [1,1,0,0,0,0|2,0,0]=4 2674 B12R1.78 [C-]#[N+]c1ccc(OC)c(OC)c1 Amb2687398 [1,1,0,0,0,0|2,0,0]=4 2675 B12R1.300 C#Cc1cc(Br)c(O)c(OC)c1 Amb27397304 [1,1,0,0,0,0|1,0,1]=4 2676 B12R1.300 C#Cc1cc(O)c(O)c(OC)c1 Amb33372193 [1,1,0,0,0,0|1,0,1]=4 2677 B12R1.300 C=Cc1cc(Br)c(O)c(OC)c1 Amb33336177 [1,1,0,0,0,0|1,0,0]=3 2678 B12R1.300 C=Cc1cc(O)c(O)c(OC)c1 Amb25667446 [1,1,0,0,0,0|1,0,0]=3 2679 B12R1.300 CCc1cc(Br)c(O)c(OC)c1 Amb25069463 [1,1,0,0,0,0|1,0,1]=4 2680 B12R1.300 CCc1cc(C#N)cc(C)c1O Amb28322014 [1,1,0,0,0,0|1,0,1]=4 2681 B12R1.300 CCc1cc(C)c(O)c(OC)c1 Amb22752216 [1,1,0,0,0,0|1,0,1]=4 2682 B12R1.300 CCc1cc(C=O)cc(C)c1O Amb28251170 [1,1,0,0,0,0|0,0,0]=2 2683 B12R1.300 CCc1cc(CCl)cc(C)c1O Amb27396305 [1,1,0,0,0,0|1,0,1]=4 2684 B12R1.300 CCc1cc(I)c(O)c(OC)c1 Amb26362909 [1,1,0,0,0,0|1,0,1]=4 2685 B12R1.300 CCc1cc(N)c(O)c(CC)c1 Amb28384726 [1,1,0,0,0,0|1,0,1]=4 2686 B12R1.300 CCc1cc(O)c(O)c(OC)c1 Amb25981146 [1,1,0,0,0,0|1,0,1]=4 2687 B12R1.300 COc1cc(Br)c(O)c(OC)c1 Amb33008684 [1,1,0,0,0,0|2,0,0]=4 2688 B12R1.300 COc1cc(C#N)cc(Br)c1O Amb2519387 [1,1,0,0,0,0|1,0,1]=4 2689 B12R1.300 COc1cc(C#N)cc(C)c1O Amb26843143 [1,1,0,0,0,0|1,0,1]=4 2690 B12R1.300 COc1cc(C#N)cc(Cl)c1O Amb1154259 [1,1,0,0,0,0|1,0,1]=4 2691 B12R1.300 COc1cc(C#N)cc(F)c1O Amb27830666 [1,1,0,0,0,0|1,0,1]=4 2692 B12R1.300 COc1cc(C#N)cc(I)c1O Amb6888418 [1,1,0,0,0,0|1,0,1]=4 2693 B12R1.300 COc1cc(C#N)cc(N)c1O Amb20243468 [1,1,0,0,0,0|1,0,1]=4 2694 B12R1.300 COc1cc(C#N)cc(N)c1O Amb24117557 [1,1,0,0,0,0|1,0,1]=4 2695 B12R1.300 COc1cc(C#N)cc(O)c1O Amb33804260 [1,1,0,0,0,0|1,0,1]=4 2696 B12R1.300 COc1cc(C)c(O)c(OC)c1 Amb18126503 [1,1,0,0,0,0|2,0,0]=4 2697 B12R1.300 COc1cc(C=O)cc(Br)c1O Amb1395836 [1,1,0,0,0,0|0,0,0]=2 2698 B12R1.300 COc1cc(C=O)cc(Br)c1S Amb32688026 [1,1,0,0,0,0|0,1,0]=3 2699 B12R1.300 COc1cc(C=O)cc(C)c1F Amb33998133 [1,1,0,0,0,0|1,0,0]=3 2700 B12R1.300 COc1cc(C=O)cc(C)c1O Amb2408165 [1,1,0,0,0,0|0,0,0]=2 2701 B12R1.300 COc1cc(C=O)cc(Cl)c1O Amb1033070 [1,1,0,0,0,0|0,0,0]=2 2702 B12R1.300 COc1cc(C=O)cc(F)c1F Amb8385497 [1,1,0,0,0,0|1,0,0]=3 2703 B12R1.300 COc1cc(C=O)cc(F)c1O Amb6297568 [1,1,0,0,0,0|0,0,0]=2 2704 B12R1.300 COc1cc(C=O)cc(I)c1I Amb28428663 [1,1,0,0,0,0|1,0,0]=3 2705 B12R1.300 COc1cc(C=O)cc(I)c1O Amb6335581 [1,1,0,0,0,0|0,0,0]=2 2706 B12R1.300 COc1cc(C=O)cc(N)c1O Amb17208090 [1,1,0,0,0,0|0,0,0]=2 2707 B12R1.300 COc1cc(C=O)cc(N)c1O Amb24117560 [1,1,0,0,0,0|0,0,0]=2 2708 B12R1.300 COc1cc(C=O)cc(O)c1C Amb27268411 [1,1,0,0,0,0|1,0,0]=3 2709 B12R1.300 COc1cc(C=O)cc(O)c1O Amb403042 [1,1,0,0,0,0|0,0,0]=2 2710 B12R1.300 COc1cc(CBr)cc(O)c1O Amb33336073 [1,1,0,0,0,0|1,0,1]=4 2711 B12R1.300 COc1cc(CCl)cc(Br)c1O Amb25270087 [1,1,0,0,0,0|1,0,1]=4 2712 B12R1.300 COc1cc(CCl)cc(N)c1O Amb17477791 [1,1,0,0,0,0|1,0,1]=4 2713 B12R1.300 COc1cc(CN)cc(Br)c1O Amb1118564 [1,1,0,0,0,0|1,0,1]=4 2714 B12R1.300 COc1cc(CN)cc(Br)c1O Amb24117551 [1,1,0,0,0,0|1,0,1]=4 2715 B12R1.300 COc1cc(CN)cc(N)c1O Amb17477778 [1,1,0,0,0,0|1,0,1]=4 2716 B12R1.300 COc1cc(CN)cc(N)c1O Amb24117556 [1,1,0,0,0,0|1,0,1]=4 2717 B12R1.300 COc1cc(CN)cc(O)c1O Amb25866409 [1,1,0,0,0,0|1,0,1]=4 2718 B12R1.300 COc1cc(CO)cc(Br)c1O Amb2781541 [1,1,0,0,0,0|0,0,2]=4 2719 B12R1.300 COc1cc(CO)cc(F)c1O Amb25710198 [1,1,0,0,0,0|0,0,2]=4 2720 B12R1.300 COc1cc(CO)cc(I)c1O Amb1111381 [1,1,0,0,0,0|0,0,2]=4 2721 B12R1.300 COc1cc(CO)cc(N)c1O Amb17477788 [1,1,0,0,0,0|0,0,2]=4 2722 B12R1.300 COc1cc(CO)cc(O)c1O Amb25111982 [1,1,0,0,0,0|0,0,2]=4 2723 B12R1.300 COc1cc(CS)cc(Br)c1O Amb32788684 [1,1,0,0,0,0|0,1,1]=4 2724 B12R1.300 COc1cc(CS)cc(O)c1O Amb33427875 [1,1,0,0,0,0|0,1,1]=4 2725 B12R1.300 COc1cc(F)c(O)c(OC)c1 Amb27642821 [1,1,0,0,0,0|2,0,0]=4 2726 B12R1.300 COc1cc(NN)cc(Br)c1O Amb33334828 [1,1,0,0,0,0|2,0,0]=4 2727 B12R1.300 COc1cc(NN)cc(O)c1O Amb33427871 [1,1,0,0,0,0|2,0,0]=4 2728 B12R1.300 COc1cc(O)c(O)c(OC)c1 Amb28243895 [1,1,0,0,0,0|2,0,0]=4 2729 B12R1.300 COc1nc(C=O)cc(Br)c1C Amb27219516 [1,1,0,0,0,0|2,0,0]=4 2730 B12R1.300 Cc1cc(C=O)cc(C=O)c1O Amb2610700 [1,1,0,0,0,0|1,0,1]=4 2731 B12R1.300 N#Cc1cc(C=O)cc(N)c1O Amb24117590 [1,1,0,0,0,0|1,0,1]=4 2732 B12R1.300 NCc1cc(C=O)cc(Br)c1O Amb23559336 [1,1,0,0,0,0|1,0,0]=3 2733 B12R1.300 NCc1cc(C=O)cc(Br)c1O Amb24117579 [1,1,0,0,0,0|1,0,0]=3 2734 B12R1.300 NCc1cc(C=O)cc(N)c1O Amb24117582 [1,1,0,0,0,0|1,0,0]=3 2735 B12R1.300 NCc1cc(C=O)cc(O)c1O Amb23559333 [1,1,0,0,0,0|1,0,0]=3 2736 B12R1.300 NCc1cc(C=O)cc(O)c1O Amb24117576 [1,1,0,0,0,0|1,0,0]=3 2737 B12R1.300 Nc1cc(C=O)cc(CCl)c1O Amb24117575 [1,1,0,0,0,0|1,0,0]=3 2738 B12R1.300 O=Cc1cc(Br)c(O)c(C=O)c1 Amb17596283 [1,1,0,0,0,0|1,0,1]=4 2739 B12R1.300 O=Cc1cc(Cl)c(O)c(C=O)c1 Amb27851496 [1,1,0,0,0,0|1,0,1]=4 2740 B12R1.300 O=Cc1cc(F)c(O)c(C=O)c1 Amb26517441 [1,1,0,0,0,0|1,0,1]=4 2741 B12R1.300 O=Cc1cc(O)c(O)c(C=O)c1 Amb24418038 [1,1,0,0,0,0|1,0,1]=4 2742 B12R1.449 C#Cc1cc(OC)c(O)cc1Br Amb33333668 [1,1,0,0,0,0|1,0,1]=4 2743 B12R1.449 C=Cc1cc(OC)c(O)cc1Br Amb33333678 [1,1,0,0,0,0|1,0,0]=3 2744 B12R1.449 C=Cc1cc(OC)c(O)cc1C Amb28243955 [1,1,0,0,0,0|1,0,0]=3 2745 B12R1.449 CCc1cc(C=O)c(C)cc1O Amb27616890 [1,1,0,0,0,0|0,0,0]=2 2746 B12R1.449 CCc1cc(C=O)c(F)cc1Cl Amb28069416 [1,1,0,0,0,0|1,0,0]=3 2747 B12R1.449 CCc1cc(C=O)c(N)nc1C Amb27590225 [1,1,0,0,0,0|2,0,0]=4 2748 B12R1.449 CCc1cc(C=O)c(O)cc1O Amb22495489 [1,1,0,0,0,0|0,0,0]=2 2749 B12R1.449 CCc1cc(CC)c(O)cc1O Amb25684174 [1,1,0,0,0,0|1,0,1]=4 2750 B12R1.449 CCc1cc(CN)c(O)cc1O Amb28062527 [1,1,0,0,0,0|1,0,1]=4 2751 B12R1.449 CCc1cc(CO)c(O)cc1O Amb27186629 [1,1,0,0,0,0|0,0,2]=4 2752 B12R1.449 CCc1cc(N=O)c(O)cc1O Amb28243845 [1,1,0,0,0,0|1,0,0]=3 2753 B12R1.449 CCc1cc(OC)c(O)cc1F Amb10839866 [1,1,0,0,0,0|1,0,1]=4 2754 B12R1.449 COc1cc(C#N)c(Br)cc1O Amb2692194 [1,1,0,0,0,0|1,0,1]=4 2755 B12R1.449 COc1cc(C#N)c(C)cc1O Amb33309542 [1,1,0,0,0,0|1,0,1]=4 2756 B12R1.449 COc1cc(C#N)c(F)cc1O Amb27211008 [1,1,0,0,0,0|1,0,1]=4 2757 B12R1.449 COc1cc(C=O)c(Br)cc1Br Amb26472292 [1,1,0,0,0,0|1,0,0]=3 2758 B12R1.449 COc1cc(C=O)c(Br)cc1C Amb18135043 [1,1,0,0,0,0|1,0,0]=3 2759 B12R1.449 COc1cc(C=O)c(Br)cc1Cl Amb27186096 [1,1,0,0,0,0|1,0,0]=3 2760 B12R1.449 COc1cc(C=O)c(Br)cc1F Amb25969437 [1,1,0,0,0,0|1,0,0]=3 2761 B12R1.449 COc1cc(C=O)c(Br)cc1O Amb2220976 [1,1,0,0,0,0|0,0,0]=2 2762 B12R1.449 COc1cc(C=O)c(Br)cc1S Amb32688042 [1,1,0,0,0,0|0,1,0]=3 2763 B12R1.449 COc1cc(C=O)c(C)cc1C Amb27446617 [1,1,0,0,0,0|1,0,0]=3 2764 B12R1.449 COc1cc(C=O)c(Cl)cc1C Amb18649026 [1,1,0,0,0,0|1,0,0]=3 2765 B12R1.449 COc1cc(C=O)c(Cl)cc1Cl Amb19892761 [1,1,0,0,0,0|1,0,0]=3 2766 B12R1.449 COc1cc(C=O)c(Cl)cc1O Amb2002357 [1,1,0,0,0,0|0,0,0]=2 2767 B12R1.449 COc1cc(C=O)c(F)cc1Br Amb24531536 [1,1,0,0,0,0|1,0,0]=3 2768 B12R1.449 COc1cc(C=O)c(F)cc1C Amb27389166 [1,1,0,0,0,0|1,0,0]=3 2769 B12R1.449 COc1cc(C=O)c(F)cc1Cl Amb10844949 [1,1,0,0,0,0|1,0,0]=3 2770 B12R1.449 COc1cc(C=O)c(F)cc1F Amb26853203 [1,1,0,0,0,0|1,0,0]=3 2771 B12R1.449 COc1cc(C=O)c(F)cc1O Amb18825814 [1,1,0,0,0,0|0,0,0]=2 2772 B12R1.449 COc1cc(C=O)c(I)cc1I Amb27798961 [1,1,0,0,0,0|1,0,0]=3 2773 B12R1.449 COc1cc(C=O)c(N)cc1C Amb26573610 [1,1,0,0,0,0|1,0,0]=3 2774 B12R1.449 COc1cc(C=O)c(O)cc1Br Amb18660821 [1,1,0,0,0,0|1,0,0]=3 2775 B12R1.449 COc1cc(C=O)c(O)cc1C Amb2692065 [1,1,0,0,0,0|1,0,0]=3 2776 B12R1.449 COc1cc(C=O)c(O)cc1Cl Amb26355931 [1,1,0,0,0,0|1,0,0]=3 2777 B12R1.449 COc1cc(C=O)c(O)cc1O Amb6374190 [1,1,0,0,0,0|0,0,0]=2 2778 B12R1.449 COc1cc(CCl)c(Br)cc1O Amb33335238 [1,1,0,0,0,0|1,0,1]=4 2779 B12R1.449 COc1cc(CCl)c(F)cc1O Amb28245605 [1,1,0,0,0,0|1,0,1]=4 2780 B12R1.449 COc1cc(CN)c(Br)cc1O Amb32664433 [1,1,0,0,0,0|1,0,1]=4 2781 B12R1.449 COc1cc(CN)c(Br)cc1O Amb6298748 [1,1,0,0,0,0|1,0,1]=4 2782 B12R1.449 COc1cc(CN)c(F)cc1O Amb18198680 [1,1,0,0,0,0|1,0,1]=4 2783 B12R1.449 COc1cc(CO)c(Br)cc1O Amb837449 [1,1,0,0,0,0|0,0,2]=4 2784 B12R1.449 COc1cc(CO)c(Cl)cc1O Amb23541418 [1,1,0,0,0,0|0,0,2]=4 2785 B12R1.449 COc1cc(CS)c(Br)cc1O Amb33333287 [1,1,0,0,0,0|0,1,1]=4 2786 B12R1.449 COc1cc(NN)c(Br)cc1O Amb33333008 [1,1,0,0,0,0|2,0,0]=4 2787 B12R1.449 COc1cc(OC)c(Cl)cc1O Amb17199620 [1,1,0,0,0,0|2,0,0]=4 2788 B12R1.449 COc1cc(OC)c(F)cc1O Amb25053357 [1,1,0,0,0,0|2,0,0]=4 2789 B12R1.449 COc1cc(OC)c(S)cc1O Amb26519062 [1,1,0,0,0,0|2,0,0]=4 2790 B12R1.449 COc1cc(SC)c(N)cc1O Amb27390973 [1,1,0,0,0,0|2,0,0]=4 2791 B12R1.449 COc1nc(C=O)c(C)cc1C Amb27250901 [1,1,0,0,0,0|2,0,0]=4 2792 B12R1.449 O=Cc1cc(C=O)c(O)cc1O Amb17779766 [1,1,0,0,0,0|1,0,1]=4 2793 B12R1.453 C=C(C)c1cc(C=O)ccc1F Amb27390158 [1,1,0,0,0,0|1,0,1]=4 2794 B12R1.453 C=Cc1ccc(O)c(C(C)=O)c1 Amb25249774 [1,1,0,0,0,0|1,0,1]=4 2795 B12R1.453 C=Cc1cnc(O)c([C@@H](C)N)c1 Amb24445284 [1,1,0,0,0,0|2,0,0]=4 2796 B12R1.453 C=Cc1cnc(O)c([C@H](C)N)c1 Amb24471618 [1,1,0,0,0,0|2,0,0]=4 2797 B12R1.453 CC(=O)c1cc(C=O)ccc1O Amb27454923 [1,1,0,0,0,0|0,0,1]=3 2798 B12R1.453 CC(C)N1C=C(C=O)C=CC1=O Amb27847573 [1,1,0,0,0,0|1,0,1]=4 2799 B12R1.453 CC(C)c1cc(C#N)ccc1O Amb18555079 [1,1,0,0,0,0|1,0,1]=4 2800 B12R1.453 CC(C)c1cc(C=O)ccc1Cl Amb19892757 [1,1,0,0,0,0|1,0,0]=3 2801 B12R1.453 CC(C)c1cc(C=O)ccc1O Amb22229788 [1,1,0,0,0,0|0,0,0]=2 2802 B12R1.453 CC(C)c1cc(CN)ccc1O Amb18056253 [1,1,0,0,0,0|1,0,1]=4 2803 B12R1.453 CC(C)c1cc(N=O)ccc1O Amb28243945 [1,1,0,0,0,0|1,0,0]=3 2804 B12R1.453 CC(F)c1cc(CO)ccc1O Amb27441295 [1,1,0,0,0,0|0,0,2]=4 2805 B12R1.453 CC(N)c1cc(C#N)ccc1O Amb28397519 [1,1,0,0,0,0|1,0,1]=4 2806 B12R1.453 CC(N)c1cc(CF)ccc1O Amb27793677 [1,1,0,0,0,0|1,0,1]=4 2807 B12R1.453 CC(N)c1cc(CO)ccc1O Amb28397282 [1,1,0,0,0,0|0,0,2]=4 2808 B12R1.453 CCc1ccc(O)c(C(C)C)c1 Amb27442454 [1,1,0,0,0,0|1,0,1]=4 2809 B12R1.453 CCc1ccc(O)c(C(C)N)c1 Amb26367059 [1,1,0,0,0,0|1,0,1]=4 2810 B12R1.453 CN(C)c1cc(C=O)ccc1I Amb27623964 [1,1,0,0,0,0|2,0,0]=4 2811 B12R1.453 CNc1ccc(O)c(C(C)C)c1 Amb18056353 [1,1,0,0,0,0|2,0,0]=4 2812 B12R1.453 COc1ccc(O)c(C(C)C)c1 Amb17203999 [1,1,0,0,0,0|2,0,0]=4 2813 B12R1.453 COc1ccc(O)c(C(C)N)c1 Amb9705528 [1,1,0,0,0,0|2,0,0]=4 2814 B12R1.453 COc1ccc(O)c(C(C)O)c1 Amb1111456 [1,1,0,0,0,0|2,0,0]=4 2815 B12R1.453 COc1ccc(O)c(C(C)S)c1 Amb7784722 [1,1,0,0,0,0|2,0,0]=4 2816 B12R1.453 COc1ccc(O)c([C@@H](C)N)c1 Amb25149821 [1,1,0,0,0,0|2,0,0]=4 2817 B12R1.453 COc1ccc(O)c([C@@H](C)O)c1 Amb26992494 [1,1,0,0,0,0|2,0,0]=4 2818 B12R1.453 COc1ccc(O)c([C@H](C)N)c1 Amb24076209 [1,1,0,0,0,0|2,0,0]=4 2819 B12R1.453 COc1ccc(O)c([C@H](C)O)c1 Amb32876026 [1,1,0,0,0,0|2,0,0]=4 2820 B12R1.453 C[C@@H](N)c1cc(C#N)ccc1O Amb28366594 [1,1,0,0,0,0|1,0,1]=4 2821 B12R1.453 C[C@H](N)c1cc(CO)ccc1O Amb27850541 [1,1,0,0,0,0|0,0,2]=4 2822 B12R1.453 Cc1ccc(C=O)cc1C(F)F Amb27958620 [1,1,0,0,0,0|2,0,0]=4 2823 B12R1.453 NC(=O)c1cc(C=O)ccc1O Amb27242081 [1,1,0,0,0,0|1,0,1]=4 2824 B12R1.453 O=Cc1ccc(O)c(B(O)O)c1 Amb34163880 [1,1,0,0,0,0|2,0,0]=4 2825 B12R1.453 O=Cc1ccc(O)c(C(=O)Cl)c1 Amb24071404 [1,1,0,0,0,0|1,0,1]=4 2826 B12R1.453 O=Cc1ccc(O)c(C(=O)O)c1 Amb1486640 [1,1,0,0,0,0|1,0,1]=4 2827 B12R1.453 O=Cc1ccc(O)c(C(F)F)n1 Amb25056714 [1,1,0,0,0,0|2,0,0]=4 2828 B12R1.453 O=Cc1ccc(O)c([N+](=O)[O-])c1 Amb2688773 [1,1,0,0,0,0|2,0,0]=4 2829 B12R1.453 O=Cc1cnc(O)c(C(F)F)c1 Amb25955636 [1,1,0,0,0,0|2,0,0]=4 2830 B12R1.654 CCc1c(C)cnc(C=O)c1C Amb18829266 [1,1,0,0,0,0|2,0,0]=4 2831 B12R1.654 CCc1ccc(O)c(CC)c1Br Amb27861016 [1,1,0,0,0,0|1,0,1]=4 2832 B12R1.654 COc1c(Br)ccc(C=O)c1F Amb28244330 [1,1,0,0,0,0|1,0,0]=3 2833 B12R1.654 COc1c(Br)cnc(C=O)c1C Amb27224272 [1,1,0,0,0,0|2,0,0]=4 2834 B12R1.654 COc1c(C)ccc(C=O)c1Br Amb27442134 [1,1,0,0,0,0|1,0,0]=3 2835 B12R1.654 COc1c(C)ccc(C=O)c1F Amb27592596 [1,1,0,0,0,0|1,0,0]=3 2836 B12R1.654 COc1c(C)ccc(C=O)c1N Amb27407730 [1,1,0,0,0,0|1,0,0]=3 2837 B12R1.654 COc1c(C)cnc(C=O)c1C Amb13883477 [1,1,0,0,0,0|2,0,0]=4 2838 B12R1.654 COc1c(C)cnc(C=O)c1Cl Amb18822256 [1,1,0,0,0,0|2,0,0]=4 2839 B12R1.654 COc1c(Cl)cnc(C=O)c1C Amb18822255 [1,1,0,0,0,0|2,0,0]=4 2840 B12R1.654 COc1c(F)ccc(C=O)c1F Amb10605759 [1,1,0,0,0,0|1,0,0]=3 2841 B12R1.654 COc1c(I)ccc(C=O)c1I Amb27192407 [1,1,0,0,0,0|1,0,0]=3 2842 B12R1.654 COc1c(N)ccc(C=O)c1N Amb27790785 [1,1,0,0,0,0|1,0,0]=3 2843 B12R1.654 COc1c(O)ccc(C=N)c1O Amb28386576 [1,1,0,0,0,0|1,0,0]=3 2844 B12R1.654 COc1c(O)ccc(C=O)c1C Amb27605772 [1,1,0,0,0,0|0,0,0]=2 2845 B12R1.654 COc1c(O)ccc(C=O)c1Cl Amb24106546 [1,1,0,0,0,0|0,0,0]=2 2846 B12R1.654 COc1c(O)ccc(C=O)c1O Amb17594194 [1,1,0,0,0,0|0,0,0]=2 2847 B12R1.654 COc1ccc(O)c(OC)c1Br Amb27653832 [1,1,0,0,0,0|2,0,0]=4 2848 B12R1.654 COc1ccc(O)c(OC)c1C Amb18646894 [1,1,0,0,0,0|2,0,0]=4 2849 B12R1.654 COc1ccc(O)c(OC)c1O Amb28461234 [1,1,0,0,0,0|2,0,0]=4 2850 B12R1.654 O=Cc1ccc(Br)c(CBr)c1F Amb24057321 [1,1,0,0,0,0|2,0,0]=4 2851 B12R1.654 O=Cc1ccc(F)c(CBr)c1Cl Amb27480773 [1,1,0,0,0,0|2,0,0]=4 2852 B12R1.654 O=Cc1ccc(O)c(C=O)c1O Amb8392180 [1,1,0,0,0,0|1,0,1]=4 2853 B12R1.274 CCOc1oc(C(=O)O)cc1Br Amb29860900 [0,1,0,0,1,0|2,0,0]=4 2854 B12R1.489 CCOc1c(Br)csc1C(=O)O Amb23509750 [0,1,0,0,1,0|2,0,0]=4 2855 B12R1.489 CCOc1c(C(=O)O)csc1Br Amb18137052 [0,1,0,0,1,0|2,0,0]=4 2856 B14R1.489 CN(C)Cc1cc(CC=O)ccc1O Amb32874422 [0,2,0,0,0,0|2,0,0]=4 2857 B14R1.489 Cc1ccc(CC=O)cc1OC(F)F Amb32750439 [0,2,0,0,0,0|2,0,0]=4 2858 B14R1.578 CN(C)Cc1cc(C=O)cc(Br)c1O Amb24117585 [0,2,0,0,0,0|2,0,0]=4 2859 B14R1.578 CN(C)Cc1cc(C=O)cc(N)c1O Amb24117588 [0,2,0,0,0,0|2,0,0]=4 2860 B14R1.578 CN(C)Cc1cc(C=O)cc(O)c1O Amb23559342 [0,2,0,0,0,0|2,0,0]=4 2861 B14R1.578 CN(C)Cc1cc(C=O)cc(O)c1O Amb24117584 [0,2,0,0,0,0|2,0,0]=4 2862 B14R1.578 O=Cc1cc(Br)c(Br)c(OC(F)F)c1 Amb24574346 [0,2,0,0,0,0|2,0,0]=4 2863 B14R1.676 CC(=N)Cc1cc(C(C)=O)ccc1O Amb28324411 [0,2,0,0,0,0|1,0,1]=4 2864 B14R1.676 CC(=O)Nc1cc(C(=O)O)ccc1O Amb22735768 [0,2,0,0,0,0|1,0,1]=4 2865 B14R1.676 CC(=O)Nc1cc(C(C)=O)ccc1O Amb19831739 [0,2,0,0,0,0|1,0,1]=4 2866 B14R1.676 CC(=O)Oc1cc(C(=O)O)ccc1C Amb16231601 [0,2,0,0,0,0|1,0,1]=4 2867 B14R1.676 CC(=O)Oc1cc(C(=O)O)ccc1F Amb20247154 [0,2,0,0,0,0|1,0,1]=4 2868 B14R1.676 CC(=O)c1ccc(C)c(OC(F)F)c1 Amb33407301 [0,2,0,0,0,0|2,0,0]=4 2869 B14R1.676 CC(=O)c1ccc(F)c(NC(C)C)c1 Amb18930333 [0,2,0,0,0,0|2,0,0]=4 2870 B14R1.676 CC(=O)c1ccc(O)c(CN(C)C)c1 Amb9283585 [0,2,0,0,0,0|2,0,0]=4 2871 B14R1.676 CC(Br)Cc1cc([N+](=O)[O-])ccc1O Amb33477222 [0,2,0,0,0,0|2,0,0]=4 2872 B14R1.676 CC(C)Cc1cc(C(=O)O)ccc1F Amb27870648 [0,2,0,0,0,0|2,0,0]=4 2873 B14R1.676 CC(C)Cc1cc(C(=O)O)ccc1N Amb32697407 [0,2,0,0,0,0|2,0,0]=4 2874 B14R1.676 CC(C)Cc1cc(C(N)=O)ccc1I Amb32685328 [0,2,0,0,0,0|2,0,0]=4 2875 B14R1.676 CC(C)Nc1cc(C(=O)O)ccc1N Amb26017398 [0,2,0,0,0,0|2,0,0]=4 2876 B14R1.676 CC(C)Oc1cc(C(=O)O)ccc1Br Amb26326990 [0,2,0,0,0,0|1,0,0]=3 2877 B14R1.676 CC(C)Oc1cc(C(=O)O)ccc1Cl Amb22001199 [0,2,0,0,0,0|1,0,0]=3 2878 B14R1.676 CC(C)Oc1cc(C(=O)O)ccc1F Amb26446255 [0,2,0,0,0,0|1,0,0]=3 2879 B14R1.676 CC(C)Oc1cc(C(=O)O)ccc1N Amb8963178 [0,2,0,0,0,0|1,0,0]=3 2880 B14R1.676 CC(C)Oc1cc(C(=O)O)cnc1F Amb27762578 [0,2,0,0,0,0|2,0,0]=4 2881 B14R1.676 CC(C)Oc1cc(C(=O)O)ncc1Br Amb32418352 [0,2,0,0,0,0|2,0,0]=4 2882 B14R1.676 CC(C)Oc1cc(C(N)=O)ccc1N Amb24666414 [0,2,0,0,0,0|1,0,0]=3 2883 B14R1.676 CC(C)Oc1cc(C(N)=O)ccc1N Amb32663719 [0,2,0,0,0,0|1,0,0]=3 2884 B14R1.676 CC(C)Oc1cc(C(N)=O)ccc1O Amb27419392 [0,2,0,0,0,0|0,0,0]=2 2885 B14R1.676 CC(C)Oc1cc(N(C)C)ccc1O Amb27632343 [0,2,0,0,0,0|2,0,0]=4 2886 B14R1.676 CC(C)Oc1cc([N+](=O)[O-])ccc1Br Amb27664403 [0,2,0,0,0,0|2,0,0]=4 2887 B14R1.676 CC(C)Oc1cc([N+](=O)[O-])ccc1Cl Amb21856264 [0,2,0,0,0,0|2,0,0]=4 2888 B14R1.676 CC(C)Oc1cc([N+](=O)[O-])ccc1F Amb25185919 [0,2,0,0,0,0|2,0,0]=4 2889 B14R1.676 CC(C)Oc1cc([N+](=O)[O-])ccc1O Amb25716897 [0,2,0,0,0,0|1,0,0]=3 2890 B14R1.676 CC(C)Oc1nc(C(N)=O)ccc1N Amb25049224 [0,2,0,0,0,0|2,0,0]=4 2891 B14R1.676 CC(C)Sc1cc(C(=O)O)ccc1Br Amb32672616 [0,2,0,0,0,0|1,1,0]=4 2892 B14R1.676 CC(C)Sc1cc(C(=O)O)ccc1Cl Amb4023361 [0,2,0,0,0,0|1,1,0]=4 2893 B14R1.676 CC(N)Cc1cc(C(=O)O)ccc1Br Amb27841679 [0,2,0,0,0,0|2,0,0]=4 2894 B14R1.676 CC(N)Cc1cc(C(=O)O)ccc1O Amb26589022 [0,2,0,0,0,0|1,0,0]=3 2895 B14R1.676 CC(O)Cc1cc([N+](=O)[O-])ccc1O Amb33474739 [0,2,0,0,0,0|2,0,0]=4 2896 B14R1.676 CN(C)Cc1cc(C(=O)O)ccc1O Amb23559310 [0,2,0,0,0,0|2,0,0]=4 2897 B14R1.676 CN(C)Cc1cc(C(=O)O)ccc1O Amb24117547 [0,2,0,0,0,0|2,0,0]=4 2898 B14R1.676 CS(=O)Nc1cc(C(=O)O)ccc1O Amb27634427 [0,2,0,0,0,0|2,0,0]=4 2899 B14R1.676 C[C@@H](N)Cc1cc([N+](=O)[O-])ccc1O Amb25104330 [0,2,0,0,0,0|2,0,0]=4 2900 B14R1.676 C[C@@H](O)Cc1cc([N+](=O)[O-])ccc1O Amb33378104 [0,2,0,0,0,0|2,0,0]=4 2901 B14R1.676 C[C@H](N)Cc1cc(C(=O)O)ccc1Br Amb28324537 [0,2,0,0,0,0|2,0,0]=4 2902 B14R1.676 C[C@H](N)Cc1cc(C(N)=O)ccc1O Amb27224896 [0,2,0,0,0,0|1,0,0]=3 2903 B14R1.676 C[C@H](N)Cc1cc([N+](=O)[O-])ccc1O Amb25328516 [0,2,0,0,0,0|2,0,0]=4 2904 B14R1.676 C[C@H](O)Cc1cc([N+](=O)[O-])ccc1O Amb33378105 [0,2,0,0,0,0|2,0,0]=4 2905 B14R1.676 Cc1ccc(C(=N)N)cc1OC(C)C Amb28186127 [0,2,0,0,0,0|2,0,0]=4 2906 B14R1.676 Cc1ccc(C(=O)O)cc1CC(C)N Amb27759286 [0,2,0,0,0,0|2,0,0]=4 2907 B14R1.676 Cc1ccc(C(=O)O)cc1OC(C)C Amb17483557 [0,2,0,0,0,0|1,0,0]=3 2908 B14R1.676 Cc1ccc(C(=O)O)cc1OC(F)F Amb18977440 [0,2,0,0,0,0|2,0,0]=4 2909 B14R1.676 Cc1ccc(C(N)=O)cc1NC(C)C Amb24625216 [0,2,0,0,0,0|2,0,0]=4 2910 B14R1.676 Cc1ccc([N+](=O)[O-])cc1OC(C)C Amb28187464 [0,2,0,0,0,0|2,0,0]=4 2911 B14R1.676 NC(=O)c1ccc(F)c(OC(F)F)c1 Amb25951725 [0,2,0,0,0,0|2,0,0]=4 2912 B14R1.676 Nc1ccc(C(=O)O)cc1OC(F)F Amb8963176 [0,2,0,0,0,0|2,0,0]=4 2913 B14R1.676 O=C(Cl)c1ccc(Cl)c(OC(F)F)c1 Amb27876770 [0,2,0,0,0,0|2,0,0]=4 2914 B14R1.676 O=C(O)c1ccc(Br)c(OC(F)F)c1 Amb26379286 [0,2,0,0,0,0|2,0,0]=4 2915 B14R1.676 O=C(O)c1ccc(F)c(OC(F)F)c1 Amb27231575 [0,2,0,0,0,0|2,0,0]=4 2916 B14R1.676 O=C(O)c1ccc(I)c(OC(F)F)c1 Amb26462025 [0,2,0,0,0,0|2,0,0]=4 2917 B14R1.881 CC(=O)Nc1cc(C=O)c(O)cc1O Amb27488208 [0,2,0,0,0,0|1,0,1]=4 2918 B14R1.881 O=Cc1cc(OC(F)F)c(Cl)cc1Cl Amb25961882 [0,2,0,0,0,0|2,0,0]=4 2919 B14R1.2318 CC(C)Oc1c(F)ccc(C=O)c1F Amb26016170 [0,2,0,0,0,0|1,0,0]=3 2920 B14R1.2336 CNc1ccc(O)c(OC(C)(C)C)c1 Amb28254480 [0,2,0,0,0,0|2,0,0]=4 2921 B14R1.2336 COc1ccc(O)c(OC(C)(C)C)c1 Amb27417565 [0,2,0,0,0,0|2,0,0]=4 2922 B14R1.2336 CS(=O)(=O)Cc1cc(C=O)ccc1O Amb18131698 [0,2,0,0,0,0|2,0,0]=4 2923 B14R1.2336 CS(=O)(=O)Nc1cc(C=O)ccc1O Amb27638663 [0,2,0,0,0,0|2,0,0]=4 2924 B14R1.2336 CS(=O)(=O)Oc1cc(C=O)ccc1O Amb27612709 [0,2,0,0,0,0|1,0,0]=3 2925 B14R1.2336 Nc1ccc(C=O)cc1OC(F)(F)F Amb26988754 [0,2,0,0,0,0|2,0,0]=4 2926 B14R1.2336 O=Cc1ccc(Br)c(OC(F)(F)F)c1 Amb19894503 [0,2,0,0,0,0|2,0,0]=4 2927 B14R1.2336 O=Cc1ccc(Cl)c(OC(F)(F)F)c1 Amb19944086 [0,2,0,0,0,0|2,0,0]=4 2928 B14R1.2336 O=Cc1ccc(F)c(OC(F)(F)F)c1 Amb10807809 [0,2,0,0,0,0|2,0,0]=4 2929 B14R1.2336 O=Cc1ccc(O)c(OC(F)(F)F)c1 Amb2684191 [0,2,0,0,0,0|1,0,0]=3 2930 B14R1.2336 O=Cc1ccc(O)c(OC(F)(F)F)n1 Amb28188383 [0,2,0,0,0,0|2,0,0]=4 2931 B14R1.2340 C=Cc1ccc(O)c(C(N)C(C)O)c1 Amb27859003 [0,2,0,0,0,0|2,0,0]=4 2932 B14R1.2340 C=Cc1ccc(O)c([C@@H](N)C(C)C)c1 Amb27748305 [0,2,0,0,0,0|2,0,0]=4 2933 B14R1.2340 C=Cc1ccc(O)c([C@H](N)[C@@H](C)O)c1 Amb27398500 [0,2,0,0,0,0|2,0,0]=4 2934 B14R1.2340 C=Cc1ccc(O)c([C@H](N)[C@H](C)O)c1 Amb27759475 [0,2,0,0,0,0|2,0,0]=4 2935 B14R1.2340 CC(=O)C(Br)c1cc(C=O)ccc1O Amb27964625 [0,2,0,0,0,0|1,0,1]=4 2936 B14R1.2340 CC(Br)C(=O)c1cc(C=O)ccc1Br Amb28436404 [0,2,0,0,0,0|2,0,0]=4 2937 B14R1.2340 CC(Br)C(=O)c1cc(C=O)ccc1Cl Amb27633976 [0,2,0,0,0,0|2,0,0]=4 2938 B14R1.2340 CC(Cl)C(=O)c1cc(C=O)ccc1Br Amb27665840 [0,2,0,0,0,0|2,0,0]=4 2939 B14R1.2340 CC(Cl)C(=O)c1cc(C=O)ccc1I Amb28284150 [0,2,0,0,0,0|2,0,0]=4 2940 B14R1.2340 CC(Cl)C(=O)c1cc(C=O)ccc1S Amb27798693 [0,2,0,0,0,0|1,1,0]=4 2941 B14R1.2340 CN(C)C(=O)c1cc(C=O)ccc1O Amb27590246 [0,2,0,0,0,0|2,0,0]=4 2942 B14R1.2340 Cc1ccc(C=O)cc1C(=O)C(C)Cl Amb24528058 [0,2,0,0,0,0|2,0,0]=4 2943 B14R1.3723 C#Cc1ccc(OC)c(OC(C)C)c1 Amb25808740 [0,2,0,0,0,0|1,0,1]=4 2944 B14R1.3723 COc1ccc(C=O)cc1CN(C)C Amb2235722 [0,2,0,0,0,0|2,0,0]=4 2945 B14R1.3723 COc1ccc(C=O)cc1CN(C)C Amb22586693 [0,2,0,0,0,0|2,0,0]=4 2946 B14R1.3723 COc1ccc(C=O)cc1CN(C)C Amb2722000 [0,2,0,0,0,0|2,0,0]=4 2947 B14R1.3723 COc1ccc(C=O)cc1NC(C)=O Amb17467700 [0,2,0,0,0,0|1,0,1]=4 2948 B14R1.3723 COc1ccc(C=O)cc1OC(C)=O Amb3989435 [0,2,0,0,0,0|0,0,1]=3 2949 B14R1.3723 COc1ccc(C=O)cc1OC(C)C Amb6335927 [0,2,0,0,0,0|0,0,0]=2 2950 B14R1.3723 COc1ccc(C=O)cc1OC(F)F Amb415905 [0,2,0,0,0,0|1,0,0]=3 2951 B14R1.3723 COc1ccc(CN)cc1OC(C)C Amb7780481 [0,2,0,0,0,0|1,0,1]=4 2952 B14R1.3724 O=Cc1ccc(O)c(NC(=O)CCl)c1 Amb28346775 [0,2,0,0,0,0|1,0,1]=4 2953 B14R1.436 C#CC(C)c1ccc(O)c(OCC)c1 Amb33376103 [0,2,0,0,0,0|1,0,1]=4 2954 B14R1.436 C=C(CBr)c1ccc(O)c(OCC)c1 Amb33387498 [0,2,0,0,0,0|1,0,0]=3 2955 B14R1.436 C=C(CCl)c1ccc(O)c(OCC)c1 Amb33256535 [0,2,0,0,0,0|1,0,0]=3 2956 B14R1.436 C=C(CN)c1ccc(O)c(OCC)c1 Amb33376105 [0,2,0,0,0,0|1,0,0]=3 2957 B14R1.436 C=CC(=O)c1ccc(O)c(OCC)c1 Amb33376406 [0,2,0,0,0,0|0,0,0]=2 2958 B14R1.436 C=CC(O)c1ccc(O)c(OCC)c1 Amb33376407 [0,2,0,0,0,0|1,0,0]=3 2959 B14R1.436 CCCc1cc(C(=O)OC)ccc1O Amb16229656 [0,2,0,0,0,0|1,0,0]=3 2960 B14R1.436 CCNc1cc(C(=O)OC)ccc1N Amb15695283 [0,2,0,0,0,0|2,0,0]=4 2961 B14R1.436 CCOc1cc(C(=O)CCl)ccc1O Amb33256531 [0,2,0,0,0,0|0,0,0]=2 2962 B14R1.436 CCOc1cc(C(=O)CN)ccc1O Amb33376440 [0,2,0,0,0,0|0,0,0]=2 2963 B14R1.436 CCOc1cc(C(=O)NC)ccc1N Amb17225582 [0,2,0,0,0,0|1,0,0]=3 2964 B14R1.436 CCOc1cc(C(=O)NC)ccc1O Amb28283347 [0,2,0,0,0,0|0,0,0]=2 2965 B14R1.436 CCOc1cc(C(=O)NN)ccc1Cl Amb27488357 [0,2,0,0,0,0|1,0,0]=3 2966 B14R1.436 CCOc1cc(C(=O)OC)ccc1Br Amb24105585 [0,2,0,0,0,0|1,0,0]=3 2967 B14R1.436 CCOc1cc(C(=O)OC)ccc1N Amb32680453 [0,2,0,0,0,0|1,0,0]=3 2968 B14R1.436 CCOc1cc(C(=O)OC)ccc1N Amb8963427 [0,2,0,0,0,0|1,0,0]=3 2969 B14R1.436 CCOc1cc(C(C)C#N)ccc1O Amb24416636 [0,2,0,0,0,0|1,0,1]=4 2970 B14R1.436 CCOc1cc(C(C)C=O)ccc1O Amb33376114 [0,2,0,0,0,0|0,0,0]=2 2971 B14R1.436 CCOc1cc(C(C)CBr)ccc1O Amb33386436 [0,2,0,0,0,0|1,0,1]=4 2972 B14R1.436 CCOc1cc(C(C)CN)ccc1O Amb33376433 [0,2,0,0,0,0|1,0,1]=4 2973 B14R1.436 CCOc1cc(C(C)ON)ccc1O Amb33223766 [0,2,0,0,0,0|0,0,2]=4 2974 B14R1.436 CCOc1cc(C(Cl)C#N)ccc1O Amb28198059 [0,2,0,0,0,0|1,0,1]=4 2975 B14R1.436 CCOc1cc(C(F)CN)ccc1O Amb33376402 [0,2,0,0,0,0|1,0,1]=4 2976 B14R1.436 CCOc1cc(C(N)CO)ccc1O Amb19009211 [0,2,0,0,0,0|0,0,2]=4 2977 B14R1.436 CCOc1cc(C(O)CBr)ccc1O Amb33386444 [0,2,0,0,0,0|0,0,2]=4 2978 B14R1.436 CCOc1cc(C(O)CCl)ccc1O Amb33256993 [0,2,0,0,0,0|0,0,2]=4 2979 B14R1.436 CCOc1cc(C(O)CF)ccc1O Amb33376111 [0,2,0,0,0,0|0,0,2]=4 2980 B14R1.436 CCOc1cc(C(O)CO)ccc1O Amb33376112 [0,2,0,0,0,0|0,0,2]=4 2981 B14R1.436 CCOc1cc([C@@H](N)CO)ccc1O Amb33171418 [0,2,0,0,0,0|0,0,2]=4 2982 B14R1.436 CCOc1cc([C@@H](O)CN)ccc1O Amb33376399 [0,2,0,0,0,0|0,0,2]=4 2983 B14R1.436 CCOc1cc([C@H](N)C#N)ccc1O Amb27464626 [0,2,0,0,0,0|1,0,1]=4 2984 B14R1.436 CCOc1cc([C@H](N)CO)ccc1O Amb33361974 [0,2,0,0,0,0|0,0,2]=4 2985 B14R1.436 CCOc1cc([C@H](O)CN)ccc1O Amb33376397 [0,2,0,0,0,0|0,0,2]=4 2986 B14R1.436 CCSc1cc(C(=O)NC)ccc1N Amb28436601 [0,2,0,0,0,0|1,1,0]=4 2987 B14R1.436 CCSc1cc(C(=O)OC)ccc1N Amb33743389 [0,2,0,0,0,0|1,1,0]=4 2988 B14R1.436 C\C=C/c1cc(C(=O)OC)ccc1O Amb27486158 [0,2,0,0,0,0|1,0,1]=4 2989 B14R1.437 CCOc1cc(C(C)(C)N)ccc1O Amb26417908 [0,2,0,0,0,0|1,0,1]=4 2990 B14R1.437 CCOc1cc(C(C)(C)O)ccc1O Amb33376413 [0,2,0,0,0,0|0,0,2]=4 2991 B14R1.437 CCOc1cc(S(=O)(=O)Cl)ccc1Br Amb21811413 [0,2,0,0,0,0|2,0,0]=4 2992 B14R1.437 CCOc1cc(S(=O)(=O)Cl)ccc1C Amb19001806 [0,2,0,0,0,0|2,0,0]=4 2993 B14R1.437 CCOc1cc(S(=O)(=O)Cl)ccc1Cl Amb15701435 [0,2,0,0,0,0|2,0,0]=4 2994 B14R1.437 CCOc1cc(S(=O)(=O)Cl)ccc1O Amb33745212 [0,2,0,0,0,0|1,0,0]=3 2995 B14R1.437 CCOc1cc(S(=O)(=O)F)ccc1O Amb33745801 [0,2,0,0,0,0|1,0,0]=3 2996 B14R1.437 CCOc1cc(S(C)(=O)=O)ccc1Br Amb32410902 [0,2,0,0,0,0|2,0,0]=4 2997 B14R1.437 CCOc1cc(S(C)(=O)=O)ccc1N Amb27404272 [0,2,0,0,0,0|2,0,0]=4 2998 B14R1.437 CCOc1cc(S(N)(=O)=O)ccc1Br Amb13949313 [0,2,0,0,0,0|2,0,0]=4 2999 B14R1.437 CCOc1cc(S(N)(=O)=O)ccc1C Amb33354036 [0,2,0,0,0,0|2,0,0]=4 3000 B14R1.437 CCOc1cc(S(N)(=O)=O)ccc1Cl Amb13949777 [0,2,0,0,0,0|2,0,0]=4 3001 B14R1.437 CCOc1cc(S(N)(=O)=O)ccc1N Amb27207096 [0,2,0,0,0,0|2,0,0]=4 3002 B14R1.437 CCOc1cc(S(N)(=O)=O)ccc1O Amb33056203 [0,2,0,0,0,0|1,0,0]=3 3003 B14R1.441 CCNc1cc([N+](=O)[O-])ccc1OC Amb9283391 [0,2,0,0,0,0|2,0,0]=4 3004 B14R1.441 CCOc1cc(B(O)O)ccc1OC Amb20075829 [0,2,0,0,0,0|1,0,1]=4 3005 B14R1.441 CCOc1cc(C(=N)N)ccc1OC Amb4297140 [0,2,0,0,0,0|1,0,0]=3 3006 B14R1.441 CCOc1cc(C(=O)Cl)ccc1OC Amb17143627 [0,2,0,0,0,0|0,0,0]=2 3007 B14R1.441 CCOc1cc(C(=O)O)ccc1C=O Amb32665294 [0,2,0,0,0,0|0,0,1]=3 3008 B14R1.441 CCOc1cc(C(=O)O)ccc1OC Amb1215276 [0,2,0,0,0,0|0,0,0]=2 3009 B14R1.441 CCOc1cc(C(=O)[O-])ccc1OC Amb33513288 [0,2,0,0,0,0|0,0,0]=2 3010 B14R1.441 CCOc1cc(C(C)=O)ccc1OC Amb22499612 [0,2,0,0,0,0|0,0,0]=2 3011 B14R1.441 CCOc1cc(C(C)N)ccc1OC Amb32410466 [0,2,0,0,0,0|1,0,1]=4 3012 B14R1.441 CCOc1cc(C(N)=O)ccc1OC Amb1963285 [0,2,0,0,0,0|0,0,0]=2 3013 B14R1.441 CCOc1cc(C(N)=S)ccc1OC Amb5769129 [0,2,0,0,0,0|0,1,0]=3 3014 B14R1.441 CCOc1cc(S(=O)[O-])ccc1C#N Amb32754308 [0,2,0,0,0,0|2,0,0]=4 3015 B14R1.441 CCOc1cc([C@@H](C)N)ccc1OC Amb33448973 [0,2,0,0,0,0|1,0,1]=4 3016 B14R1.441 CCOc1cc([C@@H](C)O)ccc1OC Amb33359568 [0,2,0,0,0,0|0,0,2]=4 3017 B14R1.441 CCOc1cc([C@H](C)N)ccc1OC Amb33359828 [0,2,0,0,0,0|1,0,1]=4 3018 B14R1.441 CCOc1cc([C@H](C)O)ccc1OC Amb33449340 [0,2,0,0,0,0|0,0,2]=4 3019 B14R1.441 CCOc1cc([N+](=O)[O-])ccc1C#N Amb24057208 [0,2,0,0,0,0|2,0,0]=4 3020 B14R1.441 CCOc1cc([N+](=O)[O-])ccc1NC Amb24309060 [0,2,0,0,0,0|2,0,0]=4 3021 B14R1.441 CCOc1cc([N+](=O)[O-])ccc1NN Amb24695895 [0,2,0,0,0,0|2,0,0]=4 3022 B14R1.441 CCSc1cc(C(=O)O)ccc1C#N Amb24445364 [0,2,0,0,0,0|1,1,0]=4 3023 B14R1.441 COCc1cc(C(=O)O)ccc1OC Amb9173540 [0,2,0,0,0,0|2,0,0]=4 3024 B14R1.441 COCc1cc(C(C)=O)ccc1OC Amb423525 [0,2,0,0,0,0|2,0,0]=4 3025 B14R1.441 COc1ccc(C(C)=O)cc1CSC Amb7990412 [0,2,0,0,0,0|2,0,0]=4 3026 B14R1.706 CCC(=O)c1cc(C(=O)Cl)ccc1Br Amb25270391 [0,2,0,0,0,0|2,0,0]=4 3027 B14R1.706 CCC(=O)c1cc(C(=O)Cl)ccc1N Amb27200465 [0,2,0,0,0,0|2,0,0]=4 3028 B14R1.706 CCC(=O)c1cc(C(=O)O)ccc1Br Amb27428113 [0,2,0,0,0,0|2,0,0]=4 3029 B14R1.706 CCC(=O)c1cc(C(=O)O)ccc1C Amb17201602 [0,2,0,0,0,0|2,0,0]=4 3030 B14R1.706 CCC(=O)c1cc(C(=O)O)ccc1Cl Amb27200042 [0,2,0,0,0,0|2,0,0]=4 3031 B14R1.706 CCC(=O)c1cc(C(=O)O)ccc1F Amb25900734 [0,2,0,0,0,0|2,0,0]=4 3032 B14R1.706 CCC(=O)c1cc(C(=O)O)ccc1N Amb28199313 [0,2,0,0,0,0|2,0,0]=4 3033 B14R1.706 CCC(=O)c1cc(C(=O)O)ccc1O Amb25724321 [0,2,0,0,0,0|1,0,0]=3 3034 B14R1.706 CCC(=O)c1cc(C(=O)O)ccc1S Amb27423600 [0,2,0,0,0,0|1,1,0]=4 3035 B14R1.706 CCC(=O)c1cc(C(C)=O)ccc1O Amb18651064 [0,2,0,0,0,0|1,0,0]=3 3036 B14R1.706 CCC(=O)c1cc([N+](=O)[O-])ccc1O Amb4477030 [0,2,0,0,0,0|2,0,0]=4 3037 B14R1.706 CCC(C)c1cc(C(C)=O)ccc1O Amb24388734 [0,2,0,0,0,0|1,0,0]=3 3038 B14R1.706 CCC(N)c1cc(C(=O)O)ccc1N Amb27446538 [0,2,0,0,0,0|2,0,0]=4 3039 B14R1.706 CCC(N)c1cc([N+](=O)[O-])ccc1O Amb27957986 [0,2,0,0,0,0|2,0,0]=4 3040 B14R1.706 CCN(C)c1cc(C(=O)O)ccc1N Amb25117239 [0,2,0,0,0,0|2,0,0]=4 3041 B14R1.706 CC[C@@H](N)c1cc(C(=O)O)ccc1F Amb27760341 [0,2,0,0,0,0|2,0,0]=4 3042 B14R1.706 CC[C@@H](N)c1cc(C(=O)O)ccc1O Amb27253087 [0,2,0,0,0,0|1,0,0]=3 3043 B14R1.706 CC[C@H](N)c1cc(C(=O)O)ccc1O Amb27871363 [0,2,0,0,0,0|1,0,0]=3 3044 B14R1.706 COC(=O)c1cc(C(=O)O)ccc1O Amb10071056 [0,2,0,0,0,0|2,0,0]=4 3045 B14R1.706 COC(=O)c1cc(C(C)=O)ccc1O Amb2722883 [0,2,0,0,0,0|2,0,0]=4 3046 B14R1.706 COC(=O)c1cc(C(N)=O)ccc1O Amb18652025 [0,2,0,0,0,0|2,0,0]=4 3047 B14R1.706 NCC(=O)c1cc(C(=O)O)ccc1O Amb27424011 [0,2,0,0,0,0|2,0,0]=4 3048 B14R1.706 NC[C@@H](N)c1cc(C(=O)O)ccc1O Amb27748237 [0,2,0,0,0,0|2,0,0]=4 3049 B14R1.706 NC[C@@H](N)c1cc(C(N)=O)ccc1O Amb27957026 [0,2,0,0,0,0|2,0,0]=4 3050 B14R1.706 NC[C@H](N)c1cc(C(=O)O)ccc1O Amb28143413 [0,2,0,0,0,0|2,0,0]=4 3051 B14R1.706 N[C@H](CO)c1cc(C(=O)O)ccc1O Amb28250773 [0,2,0,0,0,0|2,0,0]=4 3052 B14R1.706 O=C(O)c1ccc(O)c(C(=O)CBr)c1 Amb18137223 [0,2,0,0,0,0|2,0,0]=4 3053 B14R1.758 C#CCOc1cc(C(=O)O)ccc1Br Amb27813869 [0,2,0,0,0,0|1,0,1]=4 3054 B14R1.758 C#CCOc1cc(C(=O)O)ccc1C Amb19078132 [0,2,0,0,0,0|1,0,1]=4 3055 B14R1.758 C=CCOc1cc(C(=O)O)ccc1F Amb30585366 [0,2,0,0,0,0|1,0,1]=4 3056 B14R1.758 C=CCOc1cc(C(=O)O)ccc1N Amb24085309 [0,2,0,0,0,0|1,0,1]=4 3057 B14R1.758 C=CCOc1cc([N+](=O)[O-])ccc1O Amb32644409 [0,2,0,0,0,0|1,0,1]=4 3058 B14R1.758 CC(=O)c1ccc(F)c(NCCO)c1 Amb18267483 [0,2,0,0,0,0|2,0,0]=4 3059 B14R1.758 CCCCc1cc(C(=O)O)ccc1N Amb32697405 [0,2,0,0,0,0|2,0,0]=4 3060 B14R1.758 CCCNc1cc(C(=O)O)ccc1N Amb25101670 [0,2,0,0,0,0|2,0,0]=4 3061 B14R1.758 CCCNc1cc([N+](=O)[O-])ccc1O Amb27464258 [0,2,0,0,0,0|2,0,0]=4 3062 B14R1.758 CCCOc1cc(C(=O)O)ccc1C Amb17483558 [0,2,0,0,0,0|1,0,0]=3 3063 B14R1.758 CCCOc1cc(C(=O)O)ccc1Cl Amb22001104 [0,2,0,0,0,0|1,0,0]=3 3064 B14R1.758 CCCOc1cc([N+](=O)[O-])ccc1Cl Amb21856267 [0,2,0,0,0,0|2,0,0]=4 3065 B14R1.758 CCCOc1cc([N+](=O)[O-])ccc1N Amb22371344 [0,2,0,0,0,0|2,0,0]=4 3066 B14R1.758 CCOCc1cc([N+](=O)[O-])ccc1Cl Amb9003787 [0,2,0,0,0,0|2,0,0]=4 3067 B14R1.758 CCSCc1cc(C(C)=O)ccc1O Amb9654926 [0,2,0,0,0,0|0,1,0]=3 3068 B14R1.758 CNCCc1cc([N+](=O)[O-])ccc1O Amb33378414 [0,2,0,0,0,0|2,0,0]=4 3069 B14R1.758 Cc1ccc(C(=O)O)cc1NCCN Amb27163623 [0,2,0,0,0,0|2,0,0]=4 3070 B14R1.758 Cc1ccc(C(=O)O)cc1OCC#N Amb18977424 [0,2,0,0,0,0|1,0,1]=4 3071 B14R1.758 Cc1ccc([N+](=O)[O-])cc1OCCN Amb19008676 [0,2,0,0,0,0|2,0,0]=4 3072 B14R1.758 N#CCOc1cc(C(=O)O)ccc1Br Amb27657035 [0,2,0,0,0,0|1,0,1]=4 3073 B14R1.758 N#CCOc1cc(C(=O)O)ccc1N Amb8963123 [0,2,0,0,0,0|1,0,1]=4 3074 B14R1.758 NC(=O)c1ccc(Cl)c(NCCO)c1 Amb27191401 [0,2,0,0,0,0|2,0,0]=4 3075 B14R1.758 NC(=O)c1ccc(N)c(NCCF)c1 Amb27828426 [0,2,0,0,0,0|2,0,0]=4 3076 B14R1.758 NC(=O)c1ccc(N)c(NCCO)c1 Amb27848890 [0,2,0,0,0,0|2,0,0]=4 3077 B14R1.758 NCCCc1cc([N+](=O)[O-])ccc1O Amb33448621 [0,2,0,0,0,0|2,0,0]=4 3078 B14R1.758 NCCNc1cc(C(N)=O)ccc1F Amb27948993 [0,2,0,0,0,0|2,0,0]=4 3079 B14R1.758 NCCOc1cc([N+](=O)[O-])ccc1Cl Amb33220726 [0,2,0,0,0,0|2,0,0]=4 3080 B14R1.758 NCCOc1cc([N+](=O)[O-])ccc1F Amb33475371 [0,2,0,0,0,0|2,0,0]=4 3081 B14R1.758 NCCOc1cc([N+](=O)[O-])ccc1O Amb33080113 [0,2,0,0,0,0|1,0,0]=3 3082 B14R1.758 Nc1ccc(C(=O)O)cc1OCCO Amb8963194 [0,2,0,0,0,0|1,0,0]=3 3083 B14R1.758 O=C(O)c1ccc(Cl)c(NCCO)c1 Amb18933582 [0,2,0,0,0,0|2,0,0]=4 3084 B14R1.758 O=C(O)c1ccc(F)c(NCCO)c1 Amb18933586 [0,2,0,0,0,0|2,0,0]=4 3085 B14R1.758 O=[N+]([O-])c1ccc(O)c(CCCBr)c1 Amb33243022 [0,2,0,0,0,0|2,0,0]=4 3086 B14R1.758 O=[N+]([O-])c1ccc(O)c(CCCO)c1 Amb33358135 [0,2,0,0,0,0|2,0,0]=4 3087 B14R1.758 O=[N+]([O-])c1ccc(O)c(CCCS)c1 Amb33379375 [0,2,0,0,0,0|2,0,0]=4 3088 B14R1.3329 CCCc1cc(C(C)=O)c(O)cc1O Amb2778457 [0,2,0,0,0,0|1,0,0]=3 3089 B14R1.3329 CCNc1cc(C(=O)O)c(N)cc1F Amb18984755 [0,2,0,0,0,0|2,0,0]=4 3090 B14R1.3329 CCNc1cc(C(N)=O)c(N)cc1Br Amb27985184 [0,2,0,0,0,0|2,0,0]=4 3091 B14R1.3329 CCOc1cc(C(=O)O)c(Br)cc1C Amb25918133 [0,2,0,0,0,0|1,0,0]=3 3092 B14R1.3329 CCOc1cc(C(=O)O)c(F)cc1N Amb27777410 [0,2,0,0,0,0|1,0,0]=3 3093 B14R1.3329 CCOc1cc(C(=O)O)c(N)cc1Cl Amb27472554 [0,2,0,0,0,0|1,0,0]=3 3094 B14R1.3329 CCOc1cc(C(=O)O)c(N)cc1F Amb18984771 [0,2,0,0,0,0|1,0,0]=3 3095 B14R1.3329 CCOc1cc(C(N)=O)c(N)cc1F Amb18984772 [0,2,0,0,0,0|1,0,0]=3 3096 B14R1.3329 CCOc1cc([N+](=O)[O-])c(Br)cc1F Amb26458092 [0,2,0,0,0,0|2,0,0]=4 3097 B14R1.3329 CCOc1cc([N+](=O)[O-])c(C)cc1C Amb26965882 [0,2,0,0,0,0|2,0,0]=4 3098 B14R1.3329 CCOc1cc([N+](=O)[O-])c(F)cc1Br Amb27597142 [0,2,0,0,0,0|2,0,0]=4 3099 B14R1.3329 CCOc1cc([N+](=O)[O-])c(F)cc1F Amb27962539 [0,2,0,0,0,0|2,0,0]=4 3100 B14R1.3329 CCSc1cc(C(=O)O)c(N)cc1F Amb18984778 [0,2,0,0,0,0|1,1,0]=4 3101 B14R1.3329 CCSc1cc(C(C)=O)c(O)cc1O Amb27189443 [0,2,0,0,0,0|0,1,0]=3 3102 B14R1.3329 CCSc1cc(C(N)=O)c(N)cc1F Amb18984779 [0,2,0,0,0,0|1,1,0]=4 3103 B14R1.5293 CCOC1=C(Br)C(=O)OC(C(=O)O)=C1 Amb33741700 [0,2,0,0,0,0|2,0,0]=4 3104 B14R1.5293 CCOc1cc(C(=N)N)cc(Br)c1O Amb27181760 [0,2,0,0,0,0|1,0,0]=3 3105 B14R1.5293 CCOc1cc(C(=O)Cl)cc(F)c1F Amb25737050 [0,2,0,0,0,0|1,0,0]=3 3106 B14R1.5293 CCOc1cc(C(=O)O)cc(Br)c1O Amb25729852 [0,2,0,0,0,0|0,0,0]=2 3107 B14R1.5293 CCOc1cc(C(=O)O)cc(Cl)c1O Amb1105076 [0,2,0,0,0,0|0,0,0]=2 3108 B14R1.5293 CCOc1cc(C(=O)O)cc(F)c1C Amb23596314 [0,2,0,0,0,0|1,0,0]=3 3109 B14R1.5293 CCOc1cc(C(=O)O)cc(F)c1F Amb25238709 [0,2,0,0,0,0|1,0,0]=3 3110 B14R1.5293 CCOc1cc(C(=O)O)cc(O)c1Br Amb27183382 [0,2,0,0,0,0|1,0,0]=3 3111 B14R1.5293 CCOc1cc(C(C)=O)cc(Br)c1O Amb33434390 [0,2,0,0,0,0|0,0,0]=2 3112 B14R1.5293 CCOc1cc(C(C)=O)cc(F)c1F Amb24382627 [0,2,0,0,0,0|1,0,0]=3 3113 B14R1.5293 CCOc1cc(C(C)N)cc(Br)c1O Amb26036665 [0,2,0,0,0,0|1,0,1]=4 3114 B14R1.5293 CCOc1cc(C(C)N)cc(O)c1O Amb27182850 [0,2,0,0,0,0|1,0,1]=4 3115 B14R1.5293 CCOc1cc(C(N)=S)cc(Br)c1O Amb33434947 [0,2,0,0,0,0|0,1,0]=3 3116 B14R1.5293 CCOc1cc([C@@H](C)N)cc(Br)c1O Amb27986189 [0,2,0,0,0,0|1,0,1]=4 3117 B14R1.5293 CCOc1cc([C@@H](C)O)cc(Br)c1O Amb33434565 [0,2,0,0,0,0|0,0,2]=4 3118 B14R1.5293 CCOc1cc([C@H](C)N)cc(Br)c1O Amb26312539 [0,2,0,0,0,0|1,0,1]=4 3119 B14R1.5293 CCOc1cc([C@H](C)O)cc(Br)c1O Amb33434567 [0,2,0,0,0,0|0,0,2]=4 3120 B14R1.5293 CCOc1cc([N+](=O)[O-])cc(Br)c1F Amb26594551 [0,2,0,0,0,0|2,0,0]=4 3121 B14R1.5293 CCOc1cc([N+](=O)[O-])cc(C)c1C Amb27462253 [0,2,0,0,0,0|2,0,0]=4 3122 B14R1.5293 CCOc1cc([N+](=O)[O-])cc(F)c1Br Amb25095977 [0,2,0,0,0,0|2,0,0]=4 3123 B14R1.5293 CCOc1cc([N+](=O)[O-])cc(F)c1F Amb26416602 [0,2,0,0,0,0|2,0,0]=4 3124 B14R1.5389 CCCc1c(O)ccc(C(C)=O)c1O Amb2778481 [0,2,0,0,0,0|1,0,0]=3 3125 B14R1.5389 CCCc1c(S)ccc(C(C)=O)c1O Amb25807525 [0,2,0,0,0,0|1,1,0]=4 3126 B14R1.5389 CCOc1c(Br)ccc([N+](=O)[O-])c1F Amb26361395 [0,2,0,0,0,0|2,0,0]=4 3127 B14R1.5389 CCOc1c(C)ccc([N+](=O)[O-])c1C Amb27616159 [0,2,0,0,0,0|2,0,0]=4 3128 B14R1.5389 CCOc1c(Cl)ccc(C(=O)Cl)c1F Amb22738090 [0,2,0,0,0,0|1,0,0]=3 3129 B14R1.5389 CCOc1c(Cl)ccc(C(=O)O)c1N Amb18977269 [0,2,0,0,0,0|1,0,0]=3 3130 B14R1.5389 CCOc1c(Cl)ccc(C(N)=O)c1F Amb22738203 [0,2,0,0,0,0|1,0,0]=3 3131 B14R1.5389 CCOc1c(Cl)ccc([N+](=O)[O-])c1F Amb28344004 [0,2,0,0,0,0|2,0,0]=4 3132 B14R1.5389 CCOc1c(F)ccc(C(=O)Cl)c1F Amb22047704 [0,2,0,0,0,0|1,0,0]=3 3133 B14R1.5389 CCOc1c(F)ccc(C(=O)O)c1F Amb22047554 [0,2,0,0,0,0|1,0,0]=3 3134 B14R1.5389 CCOc1c(F)ccc(C(C)=O)c1F Amb22047568 [0,2,0,0,0,0|1,0,0]=3 3135 B14R1.5389 CCOc1c(F)ccc(C(N)=O)c1F Amb22043628 [0,2,0,0,0,0|1,0,0]=3 3136 B14R1.5389 CCOc1c(F)ccc([N+](=O)[O-])c1Br Amb26993906 [0,2,0,0,0,0|2,0,0]=4 3137 B14R1.5389 CCOc1c(F)ccc([N+](=O)[O-])c1F Amb27844393 [0,2,0,0,0,0|2,0,0]=4 3138 B14R1.759 C#CCOc1cc(C=O)ccc1OC Amb2041343 [0,2,0,0,0,0|0,0,1]=3 3139 B14R1.759 C=CCOc1cc(C=O)ccc1OC Amb3989789 [0,2,0,0,0,0|0,0,1]=3 3140 B14R1.759 CCCOc1cc(C=O)ccc1OC Amb1209972 [0,2,0,0,0,0|0,0,0]=2 3141 B14R1.759 CCCOc1cc(CO)ccc1OC Amb6706221 [0,2,0,0,0,0|0,0,2]=4 3142 B14R1.759 CCOCc1cc(C=O)ccc1OC Amb1933815 [0,2,0,0,0,0|0,0,0]=2 3143 B14R1.759 CCSCc1cc(C=O)ccc1OC Amb32683114 [0,2,0,0,0,0|0,1,0]=3 3144 B14R1.759 COCOc1cc(C=O)ccc1OC Amb24104604 [0,2,0,0,0,0|0,0,0]=2 3145 B14R1.759 COc1ccc(C=O)cc1OCCO Amb6276083 [0,2,0,0,0,0|0,0,0]=2 3146 B14R1.759 COc1ccc(OC)c(OCCN)c1 Amb18130398 [0,2,0,0,0,0|2,0,0]=4 3147 B14R1.2315 CCC(C)c1cc(C=O)ccc1OC Amb19962330 [0,2,0,0,0,0|1,0,0]=3 3148 B14R1.2315 COC(=O)c1cc(C=O)ccc1OC Amb17935913 [0,2,0,0,0,0|2,0,0]=4 3149 B14R1.5121 CCOc1cc(C=O)ccc1B(O)O Amb22739802 [0,2,0,0,0,0|0,0,0]=2 3150 B14R1.5121 CCOc1cc(NN)ccc1B(O)O Amb27211277 [0,2,0,0,0,0|2,0,0]=4 3151 B14R1.5121 CCOc1cc(OC)ccc1C(=O)O Amb5775496 [0,2,0,0,0,0|2,0,0]=4 3152 B14R1.5236 CCOc1cc(OC)ccc1\C=N\O Amb5774707 [0,2,0,0,0,0|2,0,0]=4 3153 B14R1.5236 CCOc1ccc(C#N)cc1OCC Amb5768407 [0,2,0,0,0,0|1,0,1]=4 3154 B14R1.5236 CCOc1ccc(C=O)cc1OCC Amb6320975 [0,2,0,0,0,0|0,0,0]=2 3155 B14R1.5236 CCOc1ccc(CCl)cc1OCC Amb1107230 [0,2,0,0,0,0|1,0,1]=4 3156 B14R1.5236 CCOc1ccc(CN)cc1OCC Amb839094 [0,2,0,0,0,0|1,0,1]=4 3157 B14R1.5236 CCOc1ccc(CO)cc1OCC Amb423748 [0,2,0,0,0,0|0,0,2]=4 3158 B14R1.5236 [C-]#[N+]c1ccc(OCC)c(OCC)c1 Amb33745945 [0,2,0,0,0,0|2,0,0]=4 3159 B14R1.5317 C=Cc1cc(Cl)c(OC)c(OCC)c1 Amb33262554 [0,2,0,0,0,0|1,0,0]=3 3160 B14R1.5317 CCOc1cc(C#N)cc(Br)c1OC Amb6366107 [0,2,0,0,0,0|1,0,1]=4 3161 B14R1.5317 CCOc1cc(C#N)cc(Cl)c1OC Amb5769226 [0,2,0,0,0,0|1,0,1]=4 3162 B14R1.5317 CCOc1cc(C#N)cc(I)c1OC Amb9767105 [0,2,0,0,0,0|1,0,1]=4 3163 B14R1.5317 CCOc1cc(C=O)cc(Br)c1OC Amb6426449 [0,2,0,0,0,0|0,0,0]=2 3164 B14R1.5317 CCOc1cc(C=O)cc(Cl)c1OC Amb1209845 [0,2,0,0,0,0|0,0,0]=2 3165 B14R1.5317 CCOc1cc(C=O)cc(I)c1OC Amb1882480 [0,2,0,0,0,0|0,0,0]=2 3166 B14R1.5317 CCOc1cc(C=O)cc(O)c1OC Amb17595173 [0,2,0,0,0,0|0,0,0]=2 3167 B14R1.5317 CCOc1cc(CBr)cc(Cl)c1OC Amb33435082 [0,2,0,0,0,0|1,0,1]=4 3168 B14R1.5317 CCOc1cc(CN)cc(Cl)c1OC Amb5769222 [0,2,0,0,0,0|1,0,1]=4 3169 B14R1.5317 CCOc1cc(CO)cc(Br)c1OC Amb1110501 [0,2,0,0,0,0|0,0,2]=4 3170 B14R1.5317 CCOc1cc(CO)cc(Cl)c1OC Amb1110954 [0,2,0,0,0,0|0,0,2]=4 3171 B14R1.6787 C#CCc1ccc(OC)c(OCC)c1 Amb33315262 [0,2,0,0,0,0|1,0,1]=4 3172 B14R1.6787 CCOc1cc(CC#N)ccc1OC Amb2687733 [0,2,0,0,0,0|1,0,1]=4 3173 B14R1.6787 CCOc1cc(CC=O)ccc1OC Amb18635886 [0,2,0,0,0,0|0,0,0]=2 3174 B14R1.6787 CCOc1cc(CCBr)ccc1OC Amb33005388 [0,2,0,0,0,0|1,0,1]=4 3175 B14R1.6787 CCOc1cc(CCN)ccc1OC Amb2687731 [0,2,0,0,0,0|1,0,1]=4 3176 B14R1.6787 CCOc1cc(CCO)ccc1OC Amb30593387 [0,2,0,0,0,0|0,0,2]=4 3177 B14R1.6787 CCOc1cc(CCS)ccc1OC Amb24100517 [0,2,0,0,0,0|0,1,1]=4 3178 B14R1.6787 CCOc1cc(CNC)ccc1OC Amb6718987 [0,2,0,0,0,0|1,0,1]=4 3179 B14R1.6787 CCOc1cc(CNN)ccc1OC Amb33429969 [0,2,0,0,0,0|1,0,1]=4 3180 B14R1.6787 CCOc1cc(CNO)ccc1OC Amb33449386 [0,2,0,0,0,0|0,0,2]=4 3181 B14R1.6787 CCOc1cc(CON)ccc1OC Amb33315544 [0,2,0,0,0,0|0,0,2]=4 3182 B14R1.6787 CCOc1cc(N=C=O)ccc1OC Amb33315610 [0,2,0,0,0,0|0,0,1]=3 3183 B14R1.6787 CCOc1cc(\C=C\Br)ccc1OC Amb33134897 [0,2,0,0,0,0|1,0,0]=3 3184 B14R1.6787 CCOc1cc(\C=N\O)ccc1OC Amb2795909 [0,2,0,0,0,0|0,0,1]=3 3185 B14R1.6787 CCOc1ccc(CO)c(OCC)c1 Amb837491 [0,2,0,0,0,0|1,0,1]=4 3186 B14R1.6787 [C-]#[N+]Cc1ccc(OC)c(OCC)c1 Amb33315601 [0,2,0,0,0,0|1,0,1]=4 3187 B14R1.9401 CCOc1c(OC)ccc(C=O)c1O Amb22406986 [0,2,0,0,0,0|0,0,0]=2 3188 B14R1.15069 CCOc1cc(C#N)c(Br)cc1OC Amb6366112 [0,2,0,0,0,0|1,0,1]=4 3189 B14R1.15069 CCOc1cc(C#N)c(Cl)cc1OC Amb8492546 [0,2,0,0,0,0|1,0,1]=4 3190 B14R1.15069 CCOc1cc(C#N)c(F)cc1OC Amb27389976 [0,2,0,0,0,0|1,0,1]=4 3191 B14R1.15069 CCOc1cc(C=O)c(Br)cc1OC Amb6426673 [0,2,0,0,0,0|0,0,0]=2 3192 B14R1.15069 CCOc1cc(C=O)c(C)cc1OC Amb839074 [0,2,0,0,0,0|0,0,0]=2 3193 B14R1.15069 CCOc1cc(C=O)c(Cl)cc1OC Amb3599289 [0,2,0,0,0,0|0,0,0]=2 3194 B14R1.15069 CCOc1cc(C=O)c(F)cc1OC Amb32668881 [0,2,0,0,0,0|0,0,0]=2 3195 B14R1.439 CCCc1cc(NC(C)=O)ccc1O Amb27585597 [0,2,0,0,0,0|1,0,0]=3 3196 B14R1.439 CCNc1cc(NC(C)=O)ccc1Cl Amb27447064 [0,2,0,0,0,0|2,0,0]=4 3197 B14R1.439 CCOc1cc(CC(=N)N)ccc1O Amb33358673 [0,2,0,0,0,0|1,0,0]=3 3198 B14R1.439 CCOc1cc(CC(=O)O)ccc1O Amb2687726 [0,2,0,0,0,0|0,0,0]=2 3199 B14R1.439 CCOc1cc(CC(C)=O)ccc1O Amb18041940 [0,2,0,0,0,0|0,0,0]=2 3200 B14R1.439 CCOc1cc(CC(C)Br)ccc1O Amb33386435 [0,2,0,0,0,0|1,0,1]=4 3201 B14R1.439 CCOc1cc(CC(C)O)ccc1O Amb33429980 [0,2,0,0,0,0|0,0,2]=4 3202 B14R1.439 CCOc1cc(CC(N)=S)ccc1O Amb33375771 [0,2,0,0,0,0|0,1,0]=3 3203 B14R1.439 CCOc1cc(CN(C)O)ccc1O Amb33376429 [0,2,0,0,0,0|0,0,2]=4 3204 B14R1.439 CCOc1cc(C[C@@H](C)N)ccc1O Amb33474878 [0,2,0,0,0,0|1,0,1]=4 3205 B14R1.439 CCOc1cc(C[C@@H](C)O)ccc1O Amb33377437 [0,2,0,0,0,0|0,0,2]=4 3206 B14R1.439 CCOc1cc(C[C@H](C)N)ccc1O Amb33171705 [0,2,0,0,0,0|1,0,1]=4 3207 B14R1.439 CCOc1cc(C[C@H](C)O)ccc1O Amb33377438 [0,2,0,0,0,0|0,0,2]=4 3208 B14R1.439 CCOc1cc(C[N+](=O)[O-])ccc1O Amb33376101 [0,2,0,0,0,0|0,0,1]=3 3209 B14R1.439 CCOc1cc(NC(=N)N)ccc1C Amb29859468 [0,2,0,0,0,0|2,0,0]=4 3210 B14R1.439 CCOc1cc(NC(=O)Cl)ccc1C Amb35625922 [0,2,0,0,0,0|1,0,0]=3 3211 B14R1.439 CCOc1cc(NC(C)=N)ccc1C Amb29859412 [0,2,0,0,0,0|2,0,0]=4 3212 B14R1.439 CCOc1cc(NC(C)=O)ccc1C Amb22000095 [0,2,0,0,0,0|1,0,0]=3 3213 B14R1.439 CCOc1cc(NC(C)=O)ccc1Cl Amb27230544 [0,2,0,0,0,0|1,0,0]=3 3214 B14R1.439 CCSc1cc(NC(C)=O)ccc1C Amb27872328 [0,2,0,0,0,0|1,1,0]=4 3215 B14R1.439 CCSc1cc(NC(C)=O)ccc1N Amb27254222 [0,2,0,0,0,0|1,1,0]=4 3216 B14R1.439 CNCc1cc(NC(C)=O)ccc1O Amb9776246 [0,2,0,0,0,0|2,0,0]=4 3217 B14R1.791 C#CCCc1ccc(O)c(OCC)c1 Amb33376072 [0,2,0,0,0,0|1,0,1]=4 3218 B14R1.791 CCNCc1ccc(O)c(OCC)c1 Amb6276409 [0,2,0,0,0,0|1,0,1]=4 3219 B14R1.791 CCNCc1ccc(O)c(OCC)c1 Amb7969640 [0,2,0,0,0,0|1,0,1]=4 3220 B14R1.791 CCOc1cc(C#CC=O)ccc1O Amb18635839 [0,2,0,0,0,0|0,0,0]=2 3221 B14R1.791 CCOc1cc(CCC#N)ccc1O Amb17509013 [0,2,0,0,0,0|1,0,1]=4 3222 B14R1.791 CCOc1cc(CCC=O)ccc1O Amb33358379 [0,2,0,0,0,0|0,0,0]=2 3223 B14R1.791 CCOc1cc(CCCBr)ccc1O Amb33005044 [0,2,0,0,0,0|1,0,1]=4 3224 B14R1.791 CCOc1cc(CCCN)ccc1O Amb17477391 [0,2,0,0,0,0|1,0,1]=4 3225 B14R1.791 CCOc1cc(CCCO)ccc1O Amb17477400 [0,2,0,0,0,0|0,0,2]=4 3226 B14R1.791 CCOc1cc(CCCS)ccc1O Amb33375773 [0,2,0,0,0,0|0,1,1]=4 3227 B14R1.791 CCOc1cc(CCNC)ccc1O Amb33079532 [0,2,0,0,0,0|1,0,1]=4 3228 B14R1.791 CCOc1cc(CCON)ccc1O Amb33376390 [0,2,0,0,0,0|0,0,2]=4 3229 B14R1.791 CCOc1cc(CN=[N+]=[N-])ccc1O Amb33376108 [0,2,0,0,0,0|1,0,1]=4 3230 B14R1.791 CCOc1cc(OCCN)ccc1O Amb33376038 [0,2,0,0,0,0|1,0,1]=4 3231 B14R1.791 CCOc1cc(\C=C\C=O)ccc1O Amb33474493 [0,2,0,0,0,0|0,0,0]=2 3232 B14R1.791 CCOc1cc(\C=C\CN)ccc1O Amb33376102 [0,2,0,0,0,0|1,0,0]=3 3233 B14R1.791 CCOc1cc(\C=C\CO)ccc1O Amb32953273 [0,2,0,0,0,0|0,0,1]=3 3234 B14R1.3235 C#CCc1cc(Br)c(O)c(OCC)c1 Amb33434584 [0,2,0,0,0,0|1,0,1]=4 3235 B14R1.3235 CCOc1cc(CC#N)cc(Br)c1O Amb33434581 [0,2,0,0,0,0|1,0,1]=4 3236 B14R1.3235 CCOc1cc(CC=O)cc(Br)c1O Amb33434594 [0,2,0,0,0,0|0,0,0]=2 3237 B14R1.3235 CCOc1cc(CCN)cc(Br)c1O Amb33241002 [0,2,0,0,0,0|1,0,1]=4 3238 B14R1.3235 CCOc1cc(CCO)cc(Br)c1O Amb33434591 [0,2,0,0,0,0|0,0,2]=4 3239 B14R1.3235 CCOc1cc(CCS)cc(Br)c1O Amb33434934 [0,2,0,0,0,0|0,1,1]=4 3240 B14R1.3235 CCOc1cc(CNC)cc(Br)c1O Amb17100011 [0,2,0,0,0,0|1,0,1]=4 3241 B14R1.3235 CCOc1cc(CNN)cc(Br)c1O Amb33434604 [0,2,0,0,0,0|1,0,1]=4 3242 B14R1.3235 CCOc1cc(CNO)cc(Br)c1O Amb33434215 [0,2,0,0,0,0|0,0,2]=4 3243 B14R1.3235 CCOc1cc(CON)cc(Br)c1O Amb33434606 [0,2,0,0,0,0|0,0,2]=4 3244 B14R1.3235 CCOc1cc(\C=N\O)cc(Br)c1O Amb6850433 [0,2,0,0,0,0|0,0,1]=3 3245 B14R1.3235 CCOc1cc(\C=N\O)cc(Cl)c1O Amb8492806 [0,2,0,0,0,0|0,0,1]=3 3246 B14R1.6795 COC(=O)c1cc(CC=O)ccc1O Amb33372892 [0,2,0,0,0,0|2,0,0]=4 3247 B14R1.14947 CCOc1cc(\C=N\O)c(Br)cc1O Amb8492816 [0,2,0,0,0,0|0,0,1]=3 3248 B14R1.601 C=C(OCC)c1cc(C=O)ccc1C Amb33136141 [0,2,0,0,0,0|1,0,0]=3 3249 B14R1.601 C=C(OCC)c1cc(C=O)ccc1F Amb33136096 [0,2,0,0,0,0|1,0,0]=3 3250 B14R1.601 C=C(OCC)c1cc(OC)ccc1O Amb33135928 [0,2,0,0,0,0|2,0,0]=4 3251 B14R1.601 CCOC(=O)c1cc(C#N)ccc1O Amb18650710 [0,2,0,0,0,0|1,0,1]=4 3252 B14R1.601 CCOC(=O)c1cc(C=O)ccc1Cl Amb32655758 [0,2,0,0,0,0|1,0,0]=3 3253 B14R1.601 CCOC(=O)c1cc(C=O)ccc1N Amb32655759 [0,2,0,0,0,0|1,0,0]=3 3254 B14R1.601 CCOC(=O)c1cc(NN)ccc1O Amb24616425 [0,2,0,0,0,0|2,0,0]=4 3255 B14R1.601 CCOC(=O)c1cc(OC)ccc1O Amb2697922 [0,2,0,0,0,0|2,0,0]=4 3256 B14R1.885 COc1ccc(O)c(OCCCN)c1 Amb32874797 [0,2,0,0,0,0|2,0,0]=4 3257 B14R1.2335 C=C(C)C#Cc1cc(C=O)ccc1O Amb28195178 [0,2,0,0,0,0|1,0,1]=4 3258 B14R1.2335 CC(C)=CCc1cc(C=O)ccc1O Amb18650515 [0,2,0,0,0,0|1,0,1]=4 3259 B14R1.562 COC(=O)c1cc(C=O)cc(Br)c1O Amb27466453 [0,2,0,0,0,0|2,0,0]=4 3260 B14R1.562 COC(=O)c1cc(C=O)cc(C)c1O Amb28408867 [0,2,0,0,0,0|2,0,0]=4 3261 B14R1.2283 COC(=O)c1cc(C=O)c(Br)cc1O Amb33328861 [0,2,0,0,0,0|2,0,0]=4 3262 B14R1.2283 COC(=O)c1cc(C=O)c(C)cc1O Amb27754108 [0,2,0,0,0,0|2,0,0]=4 3263 B14R1.2283 COC(=O)c1cc(C=O)c(Cl)cc1O Amb33456825 [0,2,0,0,0,0|2,0,0]=4 3264 B14R1.3721 CCC(C)(C)c1cc(N=O)ccc1O Amb28253689 [0,2,0,0,0,0|2,0,0]=4 3265 B14R1.3721 CC[C@@](N)(O)c1cc(C=O)ccc1O Amb28280146 [0,2,0,0,0,0|1,0,0]=3 3266 B14R1.3721 CC[C@](N)(O)c1cc(C=O)ccc1O Amb27406045 [0,2,0,0,0,0|1,0,0]=3 3267 B14R1.3721 N[C@](O)(CF)c1cc(C=O)ccc1O Amb27395875 [0,2,0,0,0,0|2,0,0]=4 3268 B14R1.3228 CCOc1cc(C#N)c(Br)c(Br)c1O Amb6888419 [0,2,0,0,0,0|1,0,1]=4 3269 B14R1.3228 CCOc1cc(C=O)c(Br)c(Br)c1O Amb1811625 [0,2,0,0,0,0|0,0,0]=2 3270 B14R1.3228 CCOc1cc(C=O)c(Br)c(Cl)c1O Amb1882514 [0,2,0,0,0,0|0,0,0]=2 3271 B14R1.3228 CCOc1cc(C=O)c(Br)c(I)c1O Amb17743748 [0,2,0,0,0,0|0,0,0]=2 3272 B14R1.3228 CCOc1cc(C=O)c(Cl)c(Br)c1O Amb8492527 [0,2,0,0,0,0|0,0,0]=2 3273 B14R1.3228 CCOc1cc(C=O)c(F)c(F)c1C Amb22738546 [0,2,0,0,0,0|1,0,0]=3 3274 B14R1.3228 CCOc1cc(CO)c(Br)c(Br)c1O Amb7102495 [0,2,0,0,0,0|0,0,2]=4 3275 B14R1.14946 CCOc1cc(C=O)c(OC)cc1C Amb17595097 [0,2,0,0,0,0|1,0,0]=3 3276 B14R1.3200 COc1cc(C=O)cc(CSC)c1O Amb22330582 [0,2,0,0,0,0|2,0,0]=4 3277 B14R1.3200 C\C=C\c1cc(C=O)cc(OC)c1O Amb25218227 [0,2,0,0,0,0|1,0,1]=4 3278 B14R1.14836 CCNc1c(N)c(C=O)cc(F)c1F Amb27229203 [0,2,0,0,0,0|2,0,0]=4 3279 B12R1.544 CCOc1ccc(C)c(C)c1O Amb24679281 [0,0,1,1,0,0|1,0,1]=4 3280 B12R1.544 CCOc1ccc(C)c(F)c1O Amb27450082 [0,0,1,1,0,0|2,0,0]=4 3281 B12R1.1 CCO\C=C\c1ccc(N)nc1 Amb24561276 [0,0,1,1,0,0|2,0,0]=4 3282 B12R1.267 CCO\C=C\c1ccccc1Cl Amb24603799 [0,0,1,1,0,0|2,0,0]=4 3283 B12R1.17 C=C(OCC)c1cccc(Br)n1 Amb33135765 [0,0,1,1,0,0|2,0,0]=4 3284 B12R1.17 C=C(OCC)c1cccc(Cl)n1 Amb33135989 [0,0,1,1,0,0|2,0,0]=4 3285 B12R1.17 C=C(OCC)c1cccc(F)n1 Amb33136246 [0,0,1,1,0,0|2,0,0]=4 3286 B12R1.17 C=C(OCC)c1cccc(N)c1 Amb33135830 [0,0,1,1,0,0|2,0,0]=4 3287 B12R1.17 C=C(OCC)c1cccc(N)n1 Amb33135831 [0,0,1,1,0,0|2,0,0]=4 3288 B12R1.17 C=C(OCC)c1cccc(O)c1 Amb33136254 [0,0,1,1,0,0|1,0,1]=4 3289 B12R1.312 C=C(OCC)c1ccc(C=O)o1 Amb33136022 [0,0,1,1,0,0|0,0,0]=2 3290 B12R1.312 C=C(OCC)c1ccc(CN)o1 Amb33136308 [0,0,1,1,0,0|1,0,1]=4 3291 B12R1.312 C=C(OCC)c1cnc(C=O)s1 Amb33135794 [0,0,1,1,0,0|1,1,0]=4 3292 B12R1.312 CCOC(=O)c1ccc(C=O)o1 Amb18646849 [0,0,1,1,0,0|1,0,0]=3 3293 B12R1.652 CCc1c(C=O)ccc(O)c1Br Amb18161503 [0,0,1,1,0,0|2,0,0]=4 3294 B12R1.652 CCc1c(C=O)ccc(O)c1Cl Amb27227049 [0,0,1,1,0,0|2,0,0]=4 3295 B12R2.24 Brc1ccc2c(c1)CCCO2 Amb33536169 [1,0,0,1,0,0|2,0,0]=4 3296 B12R2.24 Brc1ccc2c(c1)NCCO2 Amb21964574 [1,0,0,1,0,0|2,0,0]=4 3297 B12R2.24 Brc1ccc2c(c1)NCCO2 Amb2383447 [1,0,0,1,0,0|2,0,0]=4 3298 B12R2.24 Brc1ccc2c(c1)OCCC2 Amb23440336 [1,0,0,1,0,0|2,0,0]=4 3299 B12R2.24 Brc1ccc2c(c1)OCCN2 Amb10603903 [1,0,0,1,0,0|2,0,0]=4 3300 B12R2.24 Brc1ccc2c(c1)OCCN2 Amb19958005 [1,0,0,1,0,0|2,0,0]=4 3301 B12R2.24 Brc1ccc2c(c1)OCCO2 Amb1152259 [1,0,0,1,0,0|1,0,0]=3 3302 B12R2.24 Brc1cnc2c(c1)OCCO2 Amb13889671 [1,0,0,1,0,0|2,0,0]=4 3303 B12R2.24 Cc1ccc2c(c1)CCCO2 Amb13951730 [1,0,0,1,0,0|1,0,1]=4 3304 B12R2.24 Cc1ccc2c(c1)NCCO2 Amb22234866 [1,0,0,1,0,0|1,0,1]=4 3305 B12R2.24 Cc1ccc2c(c1)NCCO2 Amb2383451 [1,0,0,1,0,0|1,0,1]=4 3306 B12R2.24 Cc1ccc2c(c1)OCCN2 Amb17496858 [1,0,0,1,0,0|1,0,1]=4 3307 B12R2.24 Cc1ccc2c(c1)OCCO2 Amb22741143 [1,0,0,1,0,0|0,0,1]=3 3308 B12R2.24 Clc1ccc2c(c1)CCCO2 Amb22498254 [1,0,0,1,0,0|2,0,0]=4 3309 B12R2.24 Clc1ccc2c(c1)NCCO2 Amb2383445 [1,0,0,1,0,0|2,0,0]=4 3310 B12R2.24 Clc1ccc2c(c1)OCCN2 Amb2792652 [1,0,0,1,0,0|2,0,0]=4 3311 B12R2.24 Clc1ccc2c(c1)OCCO2 Amb13951123 [1,0,0,1,0,0|1,0,0]=3 3312 B12R2.24 Clc1cnc2c(c1)OCCO2 Amb21959416 [1,0,0,1,0,0|2,0,0]=4 3313 B12R2.24 Fc1ccc2c(c1)NCCO2 Amb10603189 [1,0,0,1,0,0|2,0,0]=4 3314 B12R2.24 Fc1ccc2c(c1)NCCO2 Amb2383446 [1,0,0,1,0,0|2,0,0]=4 3315 B12R2.24 Fc1ccc2c(c1)OCCC2 Amb25065166 [1,0,0,1,0,0|2,0,0]=4 3316 B12R2.24 Fc1ccc2c(c1)OCCN2 Amb10974785 [1,0,0,1,0,0|2,0,0]=4 3317 B12R2.24 Fc1ccc2c(c1)OCCO2 Amb22546380 [1,0,0,1,0,0|1,0,0]=3 3318 B12R2.24 Ic1ccc2c(c1)CCCO2 Amb22498253 [1,0,0,1,0,0|2,0,0]=4 3319 B12R2.24 Ic1ccc2c(c1)OCCO2 Amb2723025 [1,0,0,1,0,0|1,0,0]=3 3320 B12R2.24 Ic1ccc2c(n1)OCCO2 Amb13889672 [1,0,0,1,0,0|2,0,0]=4 3321 B12R2.24 Ic1cnc2c(c1)OCCO2 Amb13889674 [1,0,0,1,0,0|2,0,0]=4 3322 B12R2.24 Nc1cc2c(cn1)OCCO2 Amb26851752 [1,0,0,1,0,0|2,0,0]=4 3323 B12R2.24 Nc1cc2c(cn1)OCCO2 Amb32662956 [1,0,0,1,0,0|2,0,0]=4 3324 B12R2.24 Nc1ccc2c(c1)CCCO2 Amb13952453 [1,0,0,1,0,0|2,0,0]=4 3325 B12R2.24 Nc1ccc2c(c1)NCCO2 Amb15695267 [1,0,0,1,0,0|2,0,0]=4 3326 B12R2.24 Nc1ccc2c(c1)NCCO2 Amb31308216 [1,0,0,1,0,0|2,0,0]=4 3327 B12R2.24 Nc1ccc2c(c1)NCCO2 Amb8388114 [1,0,0,1,0,0|2,0,0]=4 3328 B12R2.24 Nc1ccc2c(c1)OCCC2 Amb25324386 [1,0,0,1,0,0|2,0,0]=4 3329 B12R2.24 Nc1ccc2c(c1)OCCN2 Amb8388115 [1,0,0,1,0,0|2,0,0]=4 3330 B12R2.24 Nc1ccc2c(c1)OCCO2 Amb2539754 [1,0,0,1,0,0|1,0,0]=3 3331 B12R2.24 Nc1ccc2c(c1)OCCO2 Amb373423 [1,0,0,1,0,0|1,0,0]=3 3332 B12R2.24 Nc1ccc2c(n1)OCCO2 Amb26845570 [1,0,0,1,0,0|2,0,0]=4 3333 B12R2.24 Nc1ccc2c(n1)OCCO2 Amb32662864 [1,0,0,1,0,0|2,0,0]=4 3334 B12R2.24 Nc1cnc2c(c1)OCCO2 Amb21959405 [1,0,0,1,0,0|2,0,0]=4 3335 B12R2.24 Oc1ccc2c(c1)CCCO2 Amb18243510 [1,0,0,1,0,0|1,0,1]=4 3336 B12R2.24 Oc1ccc2c(c1)NCCO2 Amb2698246 [1,0,0,1,0,0|1,0,1]=4 3337 B12R2.24 Oc1ccc2c(c1)OCCC2 Amb18125116 [1,0,0,1,0,0|1,0,1]=4 3338 B12R2.24 Oc1ccc2c(c1)OCCN2 Amb22495584 [1,0,0,1,0,0|1,0,1]=4 3339 B12R2.24 Oc1ccc2c(c1)OCCO2 Amb1157176 [1,0,0,1,0,0|0,0,1]=3 3340 B12R2.24 Oc1ccc2c(c1)OCCS2 Amb28381286 [1,0,0,1,0,0|0,1,1]=4 3341 B12R2.24 Oc1ccc2c(c1)SCCO2 Amb22584035 [1,0,0,1,0,0|0,1,1]=4 3342 B12R2.24 Oc1cnc2c(c1)OCCO2 Amb19959863 [1,0,0,1,0,0|1,0,1]=4 3343 B12R2.24 Sc1ccc2c(c1)CCCO2 Amb18180108 [1,0,0,1,0,0|1,1,0]=4 3344 B12R2.24 Sc1ccc2c(c1)NCCO2 Amb18664649 [1,0,0,1,0,0|1,1,0]=4 3345 B12R2.24 Sc1ccc2c(c1)OCCO2 Amb2370522 [1,0,0,1,0,0|0,1,0]=3 3346 B12R2.221 Cc1ccc(O)c2c1CCC2 Amb2722779 [1,0,0,1,0,0|1,0,1]=4 3347 B12R2.221 Cc1ccc(O)c2c1OCO2 Amb25335304 [1,0,0,1,0,0|1,0,1]=4 3348 B12R2.221 Nc1ccc(Br)c2c1CCO2 Amb18663135 [1,0,0,1,0,0|2,0,0]=4 3349 B12R2.221 Nc1ccc(Cl)c2c1CCO2 Amb18136168 [1,0,0,1,0,0|2,0,0]=4 3350 B12R2.221 Nc1ccc(O)c2c1CCC2 Amb27488661 [1,0,0,1,0,0|2,0,0]=4 3351 B12R2.221 Nc1ccc(O)c2c1CCN2 Amb24379569 [1,0,0,1,0,0|2,0,0]=4 3352 B12R2.221 Oc1ccc(Cl)c2c1CCC2 Amb3939491 [1,0,0,1,0,0|2,0,0]=4 3353 B12R2.221 Oc1ccc(F)c2c1CCC2 Amb15695413 [1,0,0,1,0,0|2,0,0]=4 3354 B12R2.221 Oc1ccc(F)c2c1CCO2 Amb25172771 [1,0,0,1,0,0|1,0,1]=4 3355 B12R2.221 Oc1ccc(O)c2c1CCC2 Amb28144112 [1,0,0,1,0,0|1,0,1]=4 3356 B12R2.606 CC1Cc2cc(Br)ccc2O1 Amb8927999 [1,0,0,1,0,0|2,0,0]=4 3357 B12R2.606 CC1Cc2cc(I)ccc2O1 Amb26983986 [1,0,0,1,0,0|2,0,0]=4 3358 B12R2.606 CC1Cc2cc(N)ccc2O1 Amb32686604 [1,0,0,1,0,0|2,0,0]=4 3359 B12R2.606 CC1Cc2cc(N)ccc2O1 Amb8503435 [1,0,0,1,0,0|2,0,0]=4 3360 B12R2.606 CC1Cc2cc(N)ccc2O1 Amb8927802 [1,0,0,1,0,0|2,0,0]=4 3361 B12R2.606 CC1Cc2cc(O)ccc2O1 Amb27861240 [1,0,0,1,0,0|1,0,1]=4 3362 B12R2.606 CC1Cc2cc(S)ccc2O1 Amb8928013 [1,0,0,1,0,0|1,1,0]=4 3363 B12R2.606 CC1Cc2ccc(N)cc2O1 Amb27882678 [1,0,0,1,0,0|2,0,0]=4 3364 B12R2.606 CC1Oc2ccc(N)cc2O1 Amb24707704 [1,0,0,1,0,0|1,0,0]=3 3365 B12R2.606 CC1Oc2ccc(O)cc2O1 Amb25988178 [1,0,0,1,0,0|0,0,1]=3 3366 B12R2.1316 Nc1ccc(O)c(C2CC2)c1 Amb27784840 [1,0,0,1,0,0|2,0,0]=4 3367 B12R2.1316 O=C1C=CC(=O)C(C2CC2)=C1 Amb28386588 [1,0,0,1,0,0|1,0,1]=4 3368 B12R2.1316 Oc1ccc(Br)cc1C2CC2 Amb27970132 [1,0,0,1,0,0|2,0,0]=4 3369 B12R2.1316 Oc1ccc(Cl)cc1C2CC2 Amb27751453 [1,0,0,1,0,0|2,0,0]=4 3370 B12R2.1316 Oc1ccc(F)cc1C2CC2 Amb25839259 [1,0,0,1,0,0|2,0,0]=4 3371 B12R2.43 C=Cc1cccc(C2CC2)c1 Amb24056363 [1,0,0,1,0,0|2,0,0]=4 3372 B12R2.43 O=Cc1cccc(C2CC2)c1 Amb9768835 [1,0,0,1,0,0|1,0,0]=3 3373 B12R2.43 O=Cc1cccc(C2CC2)n1 Amb22371510 [1,0,0,1,0,0|2,0,0]=4 3374 B12R2.43 O=Cc1cccc(N2CC2)c1 Amb24085107 [1,0,0,1,0,0|1,0,0]=3 3375 B12R2.43 O=Cc1ccnc(C2CC2)c1 Amb24059387 [1,0,0,1,0,0|2,0,0]=4 3376 B12R2.43 O=Cc1cncc(C2CC2)c1 Amb22276749 [1,0,0,1,0,0|2,0,0]=4 3377 B12R2.44 BrCc1ccc2c(c1)OCC2 Amb27794486 [1,0,0,1,0,0|1,0,1]=4 3378 B12R2.44 C=Cc1ccc2c(c1)CCC2 Amb25891684 [1,0,0,1,0,0|2,0,0]=4 3379 B12R2.44 C=Cc1ccc2c(c1)OCC2 Amb27171446 [1,0,0,1,0,0|1,0,0]=3 3380 B12R2.44 C=Cc1ccc2c(c1)OCO2 Amb22263780 [1,0,0,1,0,0|2,0,0]=4 3381 B12R2.44 CCc1ccc2c(c1)OCC2 Amb27868781 [1,0,0,1,0,0|1,0,1]=4 3382 B12R2.44 COc1ccc2c(c1)OCC2 Amb27162231 [1,0,0,1,0,0|2,0,0]=4 3383 B12R2.44 CSc1ccc2c(c1)OCC2 Amb28285036 [1,0,0,1,0,0|2,0,0]=4 3384 B12R2.44 N#Cc1ccc2c(c1)OCC2 Amb23399918 [1,0,0,1,0,0|1,0,1]=4 3385 B12R2.44 NOc1ccc2c(c1)OCC2 Amb30011022 [1,0,0,1,0,0|2,0,0]=4 3386 B12R2.44 O=Cc1cc2c(cn1)CCC2 Amb28054854 [1,0,0,1,0,0|2,0,0]=4 3387 B12R2.44 O=Cc1cc2c(cn1)OCO2 Amb18831275 [1,0,0,1,0,0|2,0,0]=4 3388 B12R2.44 O=Cc1ccc2c(c1)C=CC2 Amb24089076 [1,0,0,1,0,0|1,0,1]=4 3389 B12R2.44 O=Cc1ccc2c(c1)CCC2 Amb2688826 [1,0,0,1,0,0|1,0,0]=3 3390 B12R2.44 O=Cc1ccc2c(c1)CCN2 Amb18202303 [1,0,0,1,0,0|2,0,0]=4 3391 B12R2.44 O=Cc1ccc2c(c1)CCO2 Amb2408258 [1,0,0,1,0,0|2,0,0]=4 3392 B12R2.44 O=Cc1ccc2c(c1)CCS2 Amb18199757 [1,0,0,1,0,0|2,0,0]=4 3393 B12R2.44 O=Cc1ccc2c(c1)COC2 Amb8009967 [1,0,0,1,0,0|2,0,0]=4 3394 B12R2.44 O=Cc1ccc2c(c1)CSC2 Amb27219441 [1,0,0,1,0,0|2,0,0]=4 3395 B12R2.44 O=Cc1ccc2c(c1)NCC2 Amb18202304 [1,0,0,1,0,0|1,0,0]=3 3396 B12R2.44 O=Cc1ccc2c(c1)NCC2 Amb21857958 [1,0,0,1,0,0|1,0,0]=3 3397 B12R2.44 O=Cc1ccc2c(c1)OCC2 Amb18202266 [1,0,0,1,0,0|0,0,0]=2 3398 B12R2.44 O=Cc1ccc2c(c1)OCO2 Amb1873767 [1,0,0,1,0,0|1,0,0]=3 3399 B12R2.44 O=Cc1ccc2c(n1)CCC2 Amb23455029 [1,0,0,1,0,0|2,0,0]=4 3400 B12R2.44 O=Cc1ccc2c(n1)OCO2 Amb27193321 [1,0,0,1,0,0|2,0,0]=4 3401 B12R2.44 O=Cc1ccc2ccoc2c1 Amb18831461 [1,0,0,1,0,0|0,0,2]=4 3402 B12R2.44 O=Cc1ccc2ncoc2c1 Amb18831439 [1,0,0,1,0,0|1,0,1]=4 3403 B12R2.44 O=Cc1cnc2c(c1)CCC2 Amb22500617 [1,0,0,1,0,0|2,0,0]=4 3404 B12R2.44 O=Cc1cnc2c(c1)NCC2 Amb27224564 [1,0,0,1,0,0|2,0,0]=4 3405 B12R2.44 O=Nc1ccc2c(c1)OCO2 Amb25719400 [1,0,0,1,0,0|2,0,0]=4 3406 B12R2.44 OCc1ccc2c(c1)OCC2 Amb19516191 [1,0,0,1,0,0|0,0,2]=4 3407 B12R2.315 C#Cc1cccc2c1CCO2 Amb35650776 [1,0,0,1,0,0|1,0,1]=4 3408 B12R2.315 C=Cc1cccc2c1CCC2 Amb26581507 [1,0,0,1,0,0|2,0,0]=4 3409 B12R2.315 C=Cc1cccc2c1CCO2 Amb8389511 [1,0,0,1,0,0|1,0,0]=3 3410 B12R2.315 CSc1cccc2c1CCO2 Amb28120138 [1,0,0,1,0,0|2,0,0]=4 3411 B12R2.315 ClCc1cccc2c1CCO2 Amb28365370 [1,0,0,1,0,0|1,0,1]=4 3412 B12R2.315 N#[N+]c1cccc2c1CCO2 Amb30028989 [1,0,0,1,0,0|2,0,0]=4 3413 B12R2.315 NCc1cccc2c1CCO2 Amb25836255 [1,0,0,1,0,0|1,0,1]=4 3414 B12R2.315 NNc1cccc2c1CCO2 Amb30029098 [1,0,0,1,0,0|2,0,0]=4 3415 B12R2.315 O=Cc1cccc2c1CCC2 Amb18644270 [1,0,0,1,0,0|1,0,0]=3 3416 B12R2.315 O=Cc1cccc2c1CCO2 Amb8009540 [1,0,0,1,0,0|0,0,0]=2 3417 B12R2.315 O=Cc1cccc2c1CCS2 Amb18199756 [1,0,0,1,0,0|0,1,0]=3 3418 B12R2.315 O=Cc1cccc2c1CNC2 Amb24065295 [1,0,0,1,0,0|2,0,0]=4 3419 B12R2.315 O=Cc1cccc2c1COC2 Amb18202267 [1,0,0,1,0,0|2,0,0]=4 3420 B12R2.315 O=Cc1cccc2c1NCC2 Amb2432408 [1,0,0,1,0,0|2,0,0]=4 3421 B12R2.315 O=Cc1cccc2c1OCC2 Amb33544474 [1,0,0,1,0,0|2,0,0]=4 3422 B12R2.315 O=Cc1cccc2c1OCO2 Amb1935122 [1,0,0,1,0,0|1,0,0]=3 3423 B12R2.315 O=Cc1cccc2c1SCC2 Amb28133373 [1,0,0,1,0,0|2,0,0]=4 3424 B12R2.315 O=Cc1cccc2occc12 Amb18644251 [1,0,0,1,0,0|0,0,2]=4 3425 B12R2.315 O=Cc1cccc2ocnc12 Amb18831441 [1,0,0,1,0,0|1,0,1]=4 3426 B12R2.315 O=Cc1cccc2onnc12 Amb18202282 [1,0,0,1,0,0|2,0,0]=4 3427 B12R2.315 O=Cc1cncc2c1CCC2 Amb18831419 [1,0,0,1,0,0|2,0,0]=4 3428 B12R2.315 O=Cc1nccc2c1CCO2 Amb18202196 [1,0,0,1,0,0|1,0,0]=3 3429 B12R2.315 O=Cc1nccc2c1OCO2 Amb18201815 [1,0,0,1,0,0|2,0,0]=4 3430 B12R2.32 O=Cc1cc2c(s1)NCCO2 Amb18199107 [0,0,0,1,1,0|2,0,0]=4 3431 B12R2.32 O=Cc1cc2c(s1)OCCC2 Amb18199281 [0,0,0,1,1,0|2,0,0]=4 3432 B12R2.32 O=Cc1cc2c(s1)OCCO2 Amb18198935 [0,0,0,1,1,0|1,0,0]=3 3433 B12R2.1 O=Cc1csc2c1OCCO2 Amb18198936 [0,0,0,1,1,0|1,0,0]=3 3434 B12R2.1 O=Cc1occ2c1OCCO2 Amb19649851 [0,0,0,1,1,0|1,0,0]=3 3435 B12R2.1 O=Cc1scc2c1OCCO2 Amb2723911 [0,0,0,1,1,0|1,0,0]=3 3436 B12R2.1 O=Cc1scc2c1SCCO2 Amb28381126 [0,0,0,1,1,0|1,1,0]=4 3437 B14R2.134 CC1CCc2ccc(C=O)cc2O1 Amb27610217 [0,1,0,1,0,0|1,0,0]=3 3438 B14R2.134 O=Cc1ccc2c(c1)NC(=O)CO2 Amb10603717 [0,1,0,1,0,0|1,0,1]=4 3439 B14R2.161 Cc1ccc(C=O)cc1OC2CC2 Amb27244849 [0,1,0,1,0,0|1,0,0]=3 3440 B14R2.161 Cc1ncc(C=O)cc1OC2CC2 Amb27803856 [0,1,0,1,0,0|2,0,0]=4 3441 B14R2.161 Nc1cnc(C=O)cc1OC2CC2 Amb28399434 [0,1,0,1,0,0|2,0,0]=4 3442 B14R2.161 O=Cc1cc(OC2CC2)c(Br)cn1 Amb27866322 [0,1,0,1,0,0|2,0,0]=4 3443 B14R2.161 O=Cc1cc(OC2CC2)c(F)cn1 Amb27607149 [0,1,0,1,0,0|2,0,0]=4 3444 B14R2.161 O=Cc1ccc(O)c(OC2CC2)c1 Amb8390106 [0,1,0,1,0,0|0,0,0]=2 3445 B14R2.1726 CC1Cc2c(C=O)ccc(O)c2O1 Amb18195584 [0,1,0,1,0,0|0,0,0]=2 3446 B14R2.1726 Cc1cc2c(C=O)ccc(O)c2o1 Amb18197075 [0,1,0,1,0,0|0,0,1]=3 3447 B14R2.1726 Cc1cc2c(O)ccc(C=O)c2o1 Amb18197072 [0,1,0,1,0,0|1,0,1]=4 3448 B14R2.3303 CC1(C)Cc2cc(C=O)ccc2O1 Amb2783837 [0,1,0,1,0,0|1,0,0]=3 3449 B14R2.3303 CC1(C)Cc2ccc(C=O)cc2C1 Amb32687858 [0,1,0,1,0,0|2,0,0]=4 3450 B14R2.3303 CC1(C)Cc2ccc(C=O)cc2O1 Amb18127737 [0,1,0,1,0,0|1,0,0]=3 3451 B14R2.3303 CC1(C)Oc2ccc(C=O)cc2O1 Amb22032594 [0,1,0,1,0,0|0,0,0]=2 3452 B14R2.3303 CC1(C)Oc2ccc(CN)cc2O1 Amb25844031 [0,1,0,1,0,0|1,0,1]=4 3453 B14R2.3303 CC1(C)Oc2ccc(CN)cc2O1 Amb33330226 [0,1,0,1,0,0|1,0,1]=4 3454 B14R2.3303 CC1(C)Oc2ccc(CO)cc2O1 Amb27478781 [0,1,0,1,0,0|0,0,2]=4 3455 B14R2.3303 O=Cc1ccc2c(c1)OC(F)(F)O2 Amb9826832 [0,1,0,1,0,0|1,0,0]=3 3456 B14R2.601 CC(=O)c1ccc2c(c1)CC(C)N2 Amb17121829 [0,1,0,1,0,0|2,0,0]=4 3457 B14R2.601 CC(=O)c1ccc2c(c1)CC(C)O2 Amb2227444 [0,1,0,1,0,0|1,0,0]=3 3458 B14R2.601 CC(=O)c1ccc2nc(C)oc2c1 Amb18243606 [0,1,0,1,0,0|1,0,1]=4 3459 B14R2.601 CC(=O)c1ccc2oc(C)nc2c1 Amb18065549 [0,1,0,1,0,0|1,0,1]=4 3460 B14R2.601 CC1Cc2cc(C(=N)N)ccc2O1 Amb27785125 [0,1,0,1,0,0|2,0,0]=4 3461 B14R2.601 CC1Cc2cc(C(=O)Cl)ccc2O1 Amb9784258 [0,1,0,1,0,0|1,0,0]=3 3462 B14R2.601 CC1Cc2cc(C(=O)O)ccc2N1 Amb22371910 [0,1,0,1,0,0|2,0,0]=4 3463 B14R2.601 CC1Cc2cc(C(=O)O)ccc2O1 Amb1781525 [0,1,0,1,0,0|1,0,0]=3 3464 B14R2.601 CC1Cc2cc(C(N)=O)ccc2O1 Amb24696533 [0,1,0,1,0,0|1,0,0]=3 3465 B14R2.601 CC1Cc2cc(C(N)=S)ccc2O1 Amb32878137 [0,1,0,1,0,0|1,1,0]=4 3466 B14R2.601 CC1Cc2cc(S(=O)[O-])ccc2O1 Amb32754034 [0,1,0,1,0,0|2,0,0]=4 3467 B14R2.601 CC1Oc2ccc(C(=O)O)cc2O1 Amb27478098 [0,1,0,1,0,0|0,0,0]=2 3468 B14R2.601 C[C@H]1Cc2ccc(C(N)=O)cc2N1 Amb27783401 [0,1,0,1,0,0|2,0,0]=4 3469 B14R2.601 Cc1cc2cc(C(=O)O)ccc2o1 Amb1099008 [0,1,0,1,0,0|1,0,1]=4 3470 B14R2.601 Cc1nc2cc(C(=O)O)ccc2o1 Amb8629962 [0,1,0,1,0,0|1,0,1]=4 3471 B14R2.601 Cc1nc2cc(C(N)=O)ccc2o1 Amb18243643 [0,1,0,1,0,0|1,0,1]=4 3472 B14R2.601 Cc1nc2ccc(C(=O)O)cc2o1 Amb8629961 [0,1,0,1,0,0|1,0,1]=4 3473 B14R2.601 Cc1nc2ccc(C(N)=O)cc2o1 Amb18243644 [0,1,0,1,0,0|1,0,1]=4 3474 B14R2.601 O=C1Oc2ccc(C(=O)Cl)cc2O1 Amb26644101 [0,1,0,1,0,0|1,0,1]=4 3475 B14R2.601 O=C1Oc2ccc(C(=O)O)cc2O1 Amb27179343 [0,1,0,1,0,0|1,0,1]=4 3476 B14R2.781 CC(=O)c1ccc2c(c1)CCCC2 Amb1651449 [0,1,0,1,0,0|2,0,0]=4 3477 B14R2.781 CC(=O)c1ccc2c(c1)CCCN2 Amb9134084 [0,1,0,1,0,0|2,0,0]=4 3478 B14R2.781 CC(=O)c1ccc2c(c1)CCCO2 Amb18196804 [0,1,0,1,0,0|1,0,0]=3 3479 B14R2.781 CC(=O)c1ccc2c(c1)COCO2 Amb18195573 [0,1,0,1,0,0|2,0,0]=4 3480 B14R2.781 CC(=O)c1ccc2c(c1)NCCC2 Amb17592997 [0,1,0,1,0,0|2,0,0]=4 3481 B14R2.781 CC(=O)c1ccc2c(c1)NCCO2 Amb17094120 [0,1,0,1,0,0|1,0,0]=3 3482 B14R2.781 CC(=O)c1ccc2c(c1)OCCC2 Amb27948661 [0,1,0,1,0,0|1,0,0]=3 3483 B14R2.781 CC(=O)c1ccc2c(c1)OCCO2 Amb1039808 [0,1,0,1,0,0|0,0,0]=2 3484 B14R2.781 CC(Br)c1ccc2c(c1)OCCO2 Amb8835411 [0,1,0,1,0,0|1,0,1]=4 3485 B14R2.781 CC(Cl)c1ccc2c(c1)OCCO2 Amb9205042 [0,1,0,1,0,0|1,0,1]=4 3486 B14R2.781 CC(N)c1ccc2c(c1)OCCO2 Amb1111522 [0,1,0,1,0,0|1,0,1]=4 3487 B14R2.781 CC(N)c1ccc2c(c1)OCCO2 Amb6893103 [0,1,0,1,0,0|1,0,1]=4 3488 B14R2.781 CC(O)c1ccc2c(c1)OCCO2 Amb9748259 [0,1,0,1,0,0|0,0,2]=4 3489 B14R2.781 CC(S)c1ccc2c(c1)OCCO2 Amb7784728 [0,1,0,1,0,0|0,1,1]=4 3490 B14R2.781 C[C@@H](N)c1ccc2c(c1)OCCO2 Amb10610231 [0,1,0,1,0,0|1,0,1]=4 3491 B14R2.781 C[C@@H](N)c1ccc2c(c1)OCCO2 Amb6893534 [0,1,0,1,0,0|1,0,1]=4 3492 B14R2.781 C[C@@H](O)c1ccc2c(c1)OCCO2 Amb6893533 [0,1,0,1,0,0|0,0,2]=4 3493 B14R2.781 C[C@H](N)c1ccc2c(c1)OCCO2 Amb6893535 [0,1,0,1,0,0|1,0,1]=4 3494 B14R2.781 C[C@H](O)c1ccc2c(c1)OCCO2 Amb6893532 [0,1,0,1,0,0|0,0,2]=4 3495 B14R2.781 ClP(Cl)c1ccc2c(c1)OCCO2 Amb4297333 [0,1,0,1,0,0|2,0,0]=4 3496 B14R2.781 FC(F)c1ccc2c(c1)OCCO2 Amb22584198 [0,1,0,1,0,0|1,0,1]=4 3497 B14R2.781 N=C(N)c1ccc2c(c1)CCCO2 Amb18243656 [0,1,0,1,0,0|2,0,0]=4 3498 B14R2.781 N=C(N)c1ccc2c(c1)NCCO2 Amb32659070 [0,1,0,1,0,0|2,0,0]=4 3499 B14R2.781 N=C(N)c1ccc2c(c1)OCCO2 Amb9211240 [0,1,0,1,0,0|1,0,0]=3 3500 B14R2.781 NC(=O)c1ccc2c(c1)CCCC2 Amb8341131 [0,1,0,1,0,0|2,0,0]=4 3501 B14R2.781 NC(=O)c1ccc2c(c1)CCCN2 Amb6252702 [0,1,0,1,0,0|2,0,0]=4 3502 B14R2.781 NC(=O)c1ccc2c(c1)CCCO2 Amb9677671 [0,1,0,1,0,0|1,0,0]=3 3503 B14R2.781 NC(=O)c1ccc2c(c1)COCO2 Amb27604122 [0,1,0,1,0,0|2,0,0]=4 3504 B14R2.781 NC(=O)c1ccc2c(c1)NCCC2 Amb18054717 [0,1,0,1,0,0|2,0,0]=4 3505 B14R2.781 NC(=O)c1ccc2c(c1)NCCO2 Amb28058966 [0,1,0,1,0,0|1,0,0]=3 3506 B14R2.781 NC(=O)c1ccc2c(c1)OCCN2 Amb24384286 [0,1,0,1,0,0|1,0,0]=3 3507 B14R2.781 NC(=O)c1ccc2c(c1)OCCO2 Amb21962596 [0,1,0,1,0,0|0,0,0]=2 3508 B14R2.781 NC(=O)c1ccc2c(c1)OCCO2 Amb614109 [0,1,0,1,0,0|0,0,0]=2 3509 B14R2.781 NC(=O)c1ccc2c(c1)SCCC2 Amb28047351 [0,1,0,1,0,0|1,1,0]=4 3510 B14R2.781 NC(=S)c1ccc2c(c1)NCCO2 Amb32659071 [0,1,0,1,0,0|1,1,0]=4 3511 B14R2.781 NC(=S)c1ccc2c(c1)OCCO2 Amb2724735 [0,1,0,1,0,0|0,1,0]=3 3512 B14R2.781 O=C(Cl)c1ccc2c(c1)CCCC2 Amb27242086 [0,1,0,1,0,0|2,0,0]=4 3513 B14R2.781 O=C(Cl)c1ccc2c(c1)CCCN2 Amb27751747 [0,1,0,1,0,0|2,0,0]=4 3514 B14R2.781 O=C(Cl)c1ccc2c(c1)CCCO2 Amb9677573 [0,1,0,1,0,0|1,0,0]=3 3515 B14R2.781 O=C(Cl)c1ccc2c(c1)OCCO2 Amb1160211 [0,1,0,1,0,0|0,0,0]=2 3516 B14R2.781 O=C(O)C1=CC2=NCCN=C2C=C1 Amb24729451 [0,1,0,1,0,0|2,0,0]=4 3517 B14R2.781 O=C(O)C1=CNC2=NCCOC2=C1 Amb25061197 [0,1,0,1,0,0|2,0,0]=4 3518 B14R2.781 O=C(O)c1cc2c(cn1)OCCC2 Amb25350106 [0,1,0,1,0,0|2,0,0]=4 3519 B14R2.781 O=C(O)c1cc2c(cn1)OCCO2 Amb23455868 [0,1,0,1,0,0|1,0,0]=3 3520 B14R2.781 O=C(O)c1cc2c(cn1)OCCO2 Amb30526877 [0,1,0,1,0,0|1,0,0]=3 3521 B14R2.781 O=C(O)c1ccc2c(c1)CCCC2 Amb1215335 [0,1,0,1,0,0|2,0,0]=4 3522 B14R2.781 O=C(O)c1ccc2c(c1)CCCN2 Amb19427816 [0,1,0,1,0,0|2,0,0]=4 3523 B14R2.781 O=C(O)c1ccc2c(c1)CCCN2 Amb2724732 [0,1,0,1,0,0|2,0,0]=4 3524 B14R2.781 O=C(O)c1ccc2c(c1)CCCO2 Amb1101065 [0,1,0,1,0,0|1,0,0]=3 3525 B14R2.781 O=C(O)c1ccc2c(c1)CCCS2 Amb18130093 [0,1,0,1,0,0|1,1,0]=4 3526 B14R2.781 O=C(O)c1ccc2c(c1)COCO2 Amb19149319 [0,1,0,1,0,0|2,0,0]=4 3527 B14R2.781 O=C(O)c1ccc2c(c1)NCCC2 Amb33533242 [0,1,0,1,0,0|2,0,0]=4 3528 B14R2.781 O=C(O)c1ccc2c(c1)NCCC2 Amb5846612 [0,1,0,1,0,0|2,0,0]=4 3529 B14R2.781 O=C(O)c1ccc2c(c1)NCCN2 Amb10606639 [0,1,0,1,0,0|2,0,0]=4 3530 B14R2.781 O=C(O)c1ccc2c(c1)NCCO2 Amb17199839 [0,1,0,1,0,0|1,0,0]=3 3531 B14R2.781 O=C(O)c1ccc2c(c1)NCCS2 Amb15695098 [0,1,0,1,0,0|1,1,0]=4 3532 B14R2.781 O=C(O)c1ccc2c(c1)OCCC2 Amb22234652 [0,1,0,1,0,0|1,0,0]=3 3533 B14R2.781 O=C(O)c1ccc2c(c1)OCCN2 Amb22002707 [0,1,0,1,0,0|1,0,0]=3 3534 B14R2.781 O=C(O)c1ccc2c(c1)OCCN2 Amb33330869 [0,1,0,1,0,0|1,0,0]=3 3535 B14R2.781 O=C(O)c1ccc2c(c1)OCCO2 Amb1102835 [0,1,0,1,0,0|0,0,0]=2 3536 B14R2.781 O=C(O)c1ccc2c(c1)SCCN2 Amb27408976 [0,1,0,1,0,0|1,1,0]=4 3537 B14R2.781 O=C(O)c1ccc2c(n1)OCCN2 Amb27219544 [0,1,0,1,0,0|2,0,0]=4 3538 B14R2.781 O=C(O)c1ccc2c(n1)OCCO2 Amb22585735 [0,1,0,1,0,0|1,0,0]=3 3539 B14R2.781 O=C(O)c1cnc2c(c1)CCCO2 Amb21961015 [0,1,0,1,0,0|2,0,0]=4 3540 B14R2.781 O=C(O)c1cnc2c(c1)OCCN2 Amb33330837 [0,1,0,1,0,0|2,0,0]=4 3541 B14R2.781 O=C(O)c1cnc2c(c1)OCCO2 Amb21959491 [0,1,0,1,0,0|1,0,0]=3 3542 B14R2.781 O=C(O)c1ncc2c(n1)OCCO2 Amb27774840 [0,1,0,1,0,0|2,0,0]=4 3543 B14R2.781 O=N(=O)c1ccc2c(c1)OCCO2 Amb5630064 [0,1,0,1,0,0|1,0,0]=3 3544 B14R2.781 O=S(Cl)c1ccc2c(c1)OCCO2 Amb18570696 [0,1,0,1,0,0|1,0,0]=3 3545 B14R2.781 O=S(O)c1ccc2c(c1)CCCO2 Amb18864158 [0,1,0,1,0,0|2,0,0]=4 3546 B14R2.781 O=S(O)c1ccc2c(c1)OCCO2 Amb18566201 [0,1,0,1,0,0|1,0,0]=3 3547 B14R2.781 O=S([O-])c1ccc2c(c1)CCCO2 Amb32754478 [0,1,0,1,0,0|2,0,0]=4 3548 B14R2.781 O=S([O-])c1ccc2c(c1)OCCO2 Amb26593862 [0,1,0,1,0,0|1,0,0]=3 3549 B14R2.781 O=[N+]([O-])c1ccc2c(c1)CCCO2 Amb18243751 [0,1,0,1,0,0|2,0,0]=4 3550 B14R2.781 O=[N+]([O-])c1ccc2c(c1)NCCO2 Amb2383449 [0,1,0,1,0,0|2,0,0]=4 3551 B14R2.781 O=[N+]([O-])c1ccc2c(c1)NCCO2 Amb33741875 [0,1,0,1,0,0|2,0,0]=4 3552 B14R2.781 O=[N+]([O-])c1ccc2c(c1)OCCN2 Amb10975356 [0,1,0,1,0,0|2,0,0]=4 3553 B14R2.781 O=[N+]([O-])c1ccc2c(c1)OCCN2 Amb33804220 [0,1,0,1,0,0|2,0,0]=4 3554 B14R2.781 O=[N+]([O-])c1ccc2c(c1)OCCO2 Amb1008941 [0,1,0,1,0,0|1,0,0]=3 3555 B14R2.781 OB(O)c1ccc2c(c1)OCCO2 Amb1102732 [0,1,0,1,0,0|1,0,1]=4 3556 B14R2.955 Cc1ccc(C(=O)O)cc1C2CC2 Amb24489261 [0,1,0,1,0,0|2,0,0]=4 3557 B14R2.955 O=C(O)c1ccc(Cl)c(C2CC2)c1 Amb24490276 [0,1,0,1,0,0|2,0,0]=4 3558 B14R2.955 O=C(O)c1ccc(F)c(C2CC2)c1 Amb16233185 [0,1,0,1,0,0|2,0,0]=4 3559 B14R2.8653 CC(=O)c1ccc(Br)c2c1OCO2 Amb32405759 [0,1,0,1,0,0|2,0,0]=4 3560 B14R2.8653 CC(=O)c1ccc(O)c2c1CCC2 Amb26592809 [0,1,0,1,0,0|1,0,0]=3 3561 B14R2.8653 CC(=O)c1ccc(O)c2c1OCO2 Amb26026638 [0,1,0,1,0,0|1,0,0]=3 3562 B14R2.8653 Cc1ccc(C(=O)O)c2c1CCC2 Amb18127740 [0,1,0,1,0,0|2,0,0]=4 3563 B14R2.8653 NC(=O)c1ccc(Cl)c2c1CCO2 Amb33229379 [0,1,0,1,0,0|1,0,0]=3 3564 B14R2.8653 O=C(O)c1ccc(Br)c2c1CCC2 Amb28240007 [0,1,0,1,0,0|2,0,0]=4 3565 B14R2.8653 O=C(O)c1ccc(Cl)c2c1CCO2 Amb33229378 [0,1,0,1,0,0|1,0,0]=3 3566 B14R2.1747 COc1ccc(C=O)c2c1CCC2 Amb17594479 [0,1,0,1,0,0|1,0,0]=3 3567 B14R2.1747 COc1ccc(C=O)c2c1OCO2 Amb27872274 [0,1,0,1,0,0|1,0,0]=3 3568 B14R2.1747 COc1ccc(C=O)c2ccoc12 Amb18127584 [0,1,0,1,0,0|0,0,2]=4 3569 B14R2.1801 CC1CCCc2cc(C=O)ccc21 Amb9785121 [0,1,0,1,0,0|2,0,0]=4 3570 B14R2.1801 CCc1ccc2c(c1)OCCC2O Amb26891679 [0,1,0,1,0,0|1,0,1]=4 3571 B14R2.1801 CN1CCCc2cc(C=O)ccc21 Amb534620 [0,1,0,1,0,0|2,0,0]=4 3572 B14R2.1801 CN1CCNc2cc(C=O)ccc21 Amb18825064 [0,1,0,1,0,0|2,0,0]=4 3573 B14R2.1801 CN1CCOc2cc(C=O)ccc21 Amb2723212 [0,1,0,1,0,0|1,0,0]=3 3574 B14R2.1801 CN1CCOc2cc(C=O)cnc21 Amb6572259 [0,1,0,1,0,0|2,0,0]=4 3575 B14R2.1801 COc1ccc2c(c1)OCCC2O Amb24092157 [0,1,0,1,0,0|2,0,0]=4 3576 B14R2.1801 COc1ccc2c(c1)OCC[C@@H]2O Amb27853342 [0,1,0,1,0,0|2,0,0]=4 3577 B14R2.1801 NC1CCOc2cc(C=O)ccc21 Amb28422364 [0,1,0,1,0,0|1,0,0]=3 3578 B14R2.1801 NCc1ccc2c(c1)OCCC2O Amb27859470 [0,1,0,1,0,0|1,0,1]=4 3579 B14R2.1801 O=Cc1ccc2c(c1)CCCC2=O Amb28428590 [0,1,0,1,0,0|1,0,1]=4 3580 B14R2.1815 COc1ccc2c(c1)OC(C)C2O Amb28204441 [0,1,0,1,0,0|2,0,0]=4 3581 B14R2.1815 Cc1sc2cc(C=O)ccc2c1O Amb27467976 [0,1,0,1,0,0|0,1,1]=4 3582 B14R2.2400 C#Cc1ccc2c(c1)OCCCO2 Amb18178093 [0,1,0,1,0,0|1,0,1]=4 3583 B14R2.2400 COc1ccc2c(c1)OCCCO2 Amb27766419 [0,1,0,1,0,0|2,0,0]=4 3584 B14R2.2400 CSc1ccc2c(c1)OCCCO2 Amb8330795 [0,1,0,1,0,0|2,0,0]=4 3585 B14R2.2400 ClCc1ccc2c(c1)OCCCO2 Amb2723205 [0,1,0,1,0,0|1,0,1]=4 3586 B14R2.2400 N#Cc1ccc2c(c1)OCCCO2 Amb2798039 [0,1,0,1,0,0|1,0,1]=4 3587 B14R2.2400 NCc1ccc2c(c1)OCCCO2 Amb845127 [0,1,0,1,0,0|1,0,1]=4 3588 B14R2.2400 NNc1ccc2c(c1)OCCCO2 Amb18893645 [0,1,0,1,0,0|2,0,0]=4 3589 B14R2.2400 O=Cc1cc2c(cn1)OCCCS2 Amb27772113 [0,1,0,1,0,0|1,1,0]=4 3590 B14R2.2400 O=Cc1ccc2c(c1)CCCCC2 Amb27659452 [0,1,0,1,0,0|2,0,0]=4 3591 B14R2.2400 O=Cc1ccc2c(c1)CCCCO2 Amb25674639 [0,1,0,1,0,0|1,0,0]=3 3592 B14R2.2400 O=Cc1ccc2c(c1)CNCCO2 Amb16186719 [0,1,0,1,0,0|1,0,0]=3 3593 B14R2.2400 O=Cc1ccc2c(c1)CNCCO2 Amb32666967 [0,1,0,1,0,0|1,0,0]=3 3594 B14R2.2400 O=Cc1ccc2c(c1)OCCCO2 Amb2723199 [0,1,0,1,0,0|0,0,0]=2 3595 B14R2.2400 O=Cc1ccc2c(c1)OCCNC2 Amb33357136 [0,1,0,1,0,0|1,0,0]=3 3596 B14R2.2400 OCc1ccc2c(c1)OCCCO2 Amb2723201 [0,1,0,1,0,0|0,0,2]=4 3597 B14R2.2400 SCc1ccc2c(c1)OCCCO2 Amb24489545 [0,1,0,1,0,0|0,1,1]=4 3598 B14R2.2497 CCC1COc2cnc(C=O)cc21 Amb28041572 [0,1,0,1,0,0|2,0,0]=4 3599 B14R2.2497 CCN1CCc2ccc(C=O)cc21 Amb24496754 [0,1,0,1,0,0|2,0,0]=4 3600 B14R2.2497 CCn1ccc2ccc(C=O)cc21 Amb2182780 [0,1,0,1,0,0|2,0,0]=4 3601 B14R2.2497 CCn1ncc2ccc(C=O)cc21 Amb23455198 [0,1,0,1,0,0|2,0,0]=4 3602 B14R2.2497 CCn1nnc2ccc(C=O)cc21 Amb27587088 [0,1,0,1,0,0|2,0,0]=4 3603 B14R2.3519 COc1ccc(C=O)cc1C2CC2 Amb33098468 [0,1,0,1,0,0|1,0,0]=3 3604 B14R2.112 BrCCc1ccc2c(c1)OCCO2 Amb25827311 [0,1,0,1,0,0|1,0,1]=4 3605 B14R2.112 C#CCc1ccc2c(c1)OCCO2 Amb33474560 [0,1,0,1,0,0|1,0,1]=4 3606 B14R2.112 C#NCc1ccc2c(c1)OCCO2 Amb31112062 [0,1,0,1,0,0|1,0,1]=4 3607 B14R2.112 C=CCc1ccc2c(c1)CCCO2 Amb35653388 [0,1,0,1,0,0|2,0,0]=4 3608 B14R2.112 C=COc1ccc2c(c1)CCCO2 Amb27984306 [0,1,0,1,0,0|2,0,0]=4 3609 B14R2.112 CCNc1ccc2c(c1)OCCO2 Amb6694307 [0,1,0,1,0,0|1,0,1]=4 3610 B14R2.112 CNCc1ccc2c(c1)OCCO2 Amb2009792 [0,1,0,1,0,0|1,0,1]=4 3611 B14R2.112 CNCc1ccc2c(c1)OCCO2 Amb416194 [0,1,0,1,0,0|1,0,1]=4 3612 B14R2.112 N#CCc1ccc2c(c1)OCCO2 Amb2793722 [0,1,0,1,0,0|1,0,1]=4 3613 B14R2.112 N#CNc1ccc2c(c1)OCCO2 Amb18185960 [0,1,0,1,0,0|1,0,1]=4 3614 B14R2.112 NCCc1ccc2c(c1)OCCO2 Amb1105676 [0,1,0,1,0,0|1,0,1]=4 3615 B14R2.112 NCCc1ccc2c(c1)OCCO2 Amb3778834 [0,1,0,1,0,0|1,0,1]=4 3616 B14R2.112 NNCc1ccc2c(c1)OCCO2 Amb7772481 [0,1,0,1,0,0|1,0,1]=4 3617 B14R2.112 NOCc1ccc2c(c1)OCCO2 Amb33195920 [0,1,0,1,0,0|0,0,2]=4 3618 B14R2.112 O=C=Nc1ccc2c(c1)CCCO2 Amb9677574 [0,1,0,1,0,0|1,0,1]=4 3619 B14R2.112 O=C=Nc1ccc2c(c1)OCCO2 Amb33528930 [0,1,0,1,0,0|0,0,1]=3 3620 B14R2.112 O=CCc1ccc2c(c1)CCCO2 Amb29869369 [0,1,0,1,0,0|1,0,0]=3 3621 B14R2.112 O=CCc1ccc2c(c1)OCCO2 Amb17089537 [0,1,0,1,0,0|0,0,0]=2 3622 B14R2.112 O=CNc1ccc2c(c1)CCCC2 Amb35704401 [0,1,0,1,0,0|2,0,0]=4 3623 B14R2.112 O=CNc1ccc2c(c1)CCCO2 Amb27400981 [0,1,0,1,0,0|1,0,0]=3 3624 B14R2.112 O=CNc1ccc2c(c1)COCO2 Amb27635465 [0,1,0,1,0,0|2,0,0]=4 3625 B14R2.112 O=CNc1ccc2c(c1)OCCO2 Amb27757582 [0,1,0,1,0,0|0,0,0]=2 3626 B14R2.112 O=COc1ccc2c(c1)OCCO2 Amb27803123 [0,1,0,1,0,0|0,0,0]=2 3627 B14R2.112 OCCc1ccc2c(c1)OCCO2 Amb17089521 [0,1,0,1,0,0|0,0,2]=4 3628 B14R2.112 ONCc1ccc2c(c1)OCCO2 Amb26921239 [0,1,0,1,0,0|0,0,2]=4 3629 B14R2.112 O\N=C\c1ccc2c(c1)OCCO2 Amb3361802 [0,1,0,1,0,0|0,0,1]=3 3630 B14R2.112 S=C=Nc1ccc2c(c1)OCCO2 Amb1157178 [0,1,0,1,0,0|0,1,1]=4 3631 B14R2.112 SCCc1ccc2c(c1)OCCO2 Amb17402133 [0,1,0,1,0,0|0,1,1]=4 3632 B14R2.112 [C-]#[N+]Cc1ccc2c(c1)OCCO2 Amb5350963 [0,1,0,1,0,0|1,0,1]=4 3633 B14R2.6400 CC1Cc2cc(CC=O)ccc2O1 Amb32880014 [0,1,0,1,0,0|1,0,0]=3 3634 B14R2.6400 CC1Cc2cc(N=C=O)ccc2O1 Amb32880730 [0,1,0,1,0,0|1,0,1]=4 3635 B14R2.160 C=Cc1ccc(O)c(C2CCN2)c1 Amb27403073 [0,1,0,1,0,0|2,0,0]=4 3636 B14R2.160 O=Cc1ccc(O)c(C2CCC2)c1 Amb27411436 [0,1,0,1,0,0|1,0,0]=3 3637 B14R2.1131 O=Cc1ccc(Br)c2c1OCCC2 Amb33746157 [0,1,0,1,0,0|2,0,0]=4 3638 B14R2.1131 O=Cc1cnc(I)c2c1OCCO2 Amb24496176 [0,1,0,1,0,0|2,0,0]=4 3639 B14R2.1131 OCc1ccc(O)c2c1OCCO2 Amb27244985 [0,1,0,1,0,0|0,0,2]=4 3640 B14R2.1759 C=Cc1ccc(O)c2c1C(N)CC2 Amb27164253 [0,1,0,1,0,0|2,0,0]=4 3641 B14R2.1759 C=Cc1ccc(O)c2c1C(N)CO2 Amb28124714 [0,1,0,1,0,0|1,0,0]=3 3642 B14R2.1759 C=Cc1ccc(O)c2c1[C@H](N)CC2 Amb28239621 [0,1,0,1,0,0|2,0,0]=4 3643 B14R2.1759 C=Cc1ccc(O)c2c1[C@H](N)CO2 Amb27166586 [0,1,0,1,0,0|1,0,0]=3 3644 B14R2.2332 CC1CCc2cc(C=O)ccc2O1 Amb27812207 [0,1,0,1,0,0|1,0,0]=3 3645 B14R2.2332 CC1OCc2cc(C=O)ccc2O1 Amb18195585 [0,1,0,1,0,0|0,0,0]=2 3646 B14R2.2332 COc1ccc2c(c1)COC(C)O2 Amb27471798 [0,1,0,1,0,0|2,0,0]=4 3647 B14R2.2332 O=Cc1ccc2c(c1)OCC(=O)N2 Amb22235604 [0,1,0,1,0,0|1,0,1]=4 3648 B14R2.3304 CCc1nc2cc(C=O)ccc2o1 Amb17470508 [0,1,0,1,0,0|1,0,0]=3 3649 B14R2.3304 CCc1nc2ccc(C=O)cc2o1 Amb27851587 [0,1,0,1,0,0|1,0,0]=3 3650 B14R2.3304 COC1Oc2ccc(C=O)cc2O1 Amb28344089 [0,1,0,1,0,0|0,0,0]=2 3651 B14R2.3304 COc1nc2cc(C=O)ccc2o1 Amb27215563 [0,1,0,1,0,0|1,0,1]=4 3652 B14R2.3304 COc1nc2ccc(C=O)cc2o1 Amb26915959 [0,1,0,1,0,0|1,0,1]=4 3653 B14R2.3304 CSc1nc2ccc(C=O)cc2o1 Amb25056711 [0,1,0,1,0,0|1,0,1]=4 3654 B14R2.3304 NCC1Cc2cc(C=O)ccc2O1 Amb32658838 [0,1,0,1,0,0|1,0,0]=3 3655 B14R2.3304 NCc1cc2cc(C=O)ccc2o1 Amb32696476 [0,1,0,1,0,0|1,0,1]=4 3656 B14R2.3304 NCc1cc2ccc(C=O)cc2o1 Amb32696477 [0,1,0,1,0,0|1,0,1]=4 3657 B14R2.3304 NCc1nc2cc(C=O)ccc2o1 Amb28133121 [0,1,0,1,0,0|1,0,1]=4 3658 B14R2.3304 NCc1nc2ccc(C=O)cc2o1 Amb25312381 [0,1,0,1,0,0|1,0,1]=4 3659 B14R2.3304 O=Cc1ccc2c(c1)CC(CO)O2 Amb32658835 [0,1,0,1,0,0|1,0,0]=3 3660 B14R2.3304 O=Cc1ccc2nc(CBr)oc2c1 Amb27192396 [0,1,0,1,0,0|1,0,1]=4 3661 B14R2.3304 O=Cc1ccc2nc(CO)oc2c1 Amb26004260 [0,1,0,1,0,0|1,0,1]=4 3662 B14R2.3304 O=Cc1ccc2oc(CBr)nc2c1 Amb27192395 [0,1,0,1,0,0|1,0,1]=4 3663 B14R2.3304 O=Cc1ccc2oc(CCl)nc2c1 Amb27200717 [0,1,0,1,0,0|1,0,1]=4 3664 B14R2.3304 O=Cc1ccc2oc(CO)cc2c1 Amb26374816 [0,1,0,1,0,0|1,0,1]=4 3665 B14R2.3304 O=Cc1ccc2oc(CO)nc2c1 Amb27200511 [0,1,0,1,0,0|1,0,1]=4 3666 B14R2.142 C=Cc1ccc2c(c1)N(C)CCO2 Amb33446121 [0,1,0,1,0,0|2,0,0]=4 3667 B14R2.142 C=Cc1ccc2c(c1)[C@@H](N)CCO2 Amb27468697 [0,1,0,1,0,0|2,0,0]=4 3668 B14R2.142 CN1CCCc2ccc(C=O)cc21 Amb18197206 [0,1,0,1,0,0|2,0,0]=4 3669 B14R2.142 CN1CCOc2ccc(C=O)cc21 Amb18196186 [0,1,0,1,0,0|1,0,0]=3 3670 B14R2.142 O=Cc1ccc2c(c1)C(=O)CCN2 Amb18197440 [0,1,0,1,0,0|2,0,0]=4 3671 B14R2.142 O=Cc1ccc2c(c1)C(=O)CCO2 Amb18197054 [0,1,0,1,0,0|1,0,0]=3 3672 B14R2.142 O=Cc1ccc2c(c1)C(=O)CCS2 Amb18190680 [0,1,0,1,0,0|1,1,0]=4 3673 B14R2.142 O=Cc1ccc2c(c1)C(F)CCO2 Amb27478544 [0,1,0,1,0,0|1,0,0]=3 3674 B14R2.142 O=Cc1ccc2c(c1)C(O)CCC2 Amb25900684 [0,1,0,1,0,0|2,0,0]=4 3675 B14R2.1745 C=Cc1ccc(O)c2c1CC[C@H]2N Amb28314755 [0,1,0,1,0,0|2,0,0]=4 3676 B14R2.3274 CC1Oc2ccc(C=O)cc2C1C Amb33496166 [0,1,0,1,0,0|1,0,0]=3 3677 B14R2.17838 C=Cc1ccc(O)c(C2(N)CC2)c1 Amb27812745 [0,1,0,1,0,0|2,0,0]=4 3678 B14R2.1128 CNc1cc2c(cc1C)OCCO2 Amb18243757 [0,1,0,1,0,0|2,0,0]=4 3679 B14R2.1128 CNc1cc2c(cc1Cl)OCCO2 Amb18949270 [0,1,0,1,0,0|2,0,0]=4 3680 B14R2.1128 COc1cc2c(cc1N)OCCO2 Amb6679796 [0,1,0,1,0,0|2,0,0]=4 3681 B14R2.1128 CSc1cc2c(cc1Cl)OCCO2 Amb27771334 [0,1,0,1,0,0|2,0,0]=4 3682 B14R2.1128 CSc1cc2c(cc1N)OCCO2 Amb13952449 [0,1,0,1,0,0|2,0,0]=4 3683 B14R2.1128 Cc1cc2c(cc1C#N)OCCO2 Amb18243604 [0,1,0,1,0,0|1,0,1]=4 3684 B14R2.1128 Cc1cc2c(cc1C=O)OCCO2 Amb10608120 [0,1,0,1,0,0|0,0,0]=2 3685 B14R2.1128 Cc1cc2c(cc1CCl)OCCO2 Amb18864183 [0,1,0,1,0,0|1,0,1]=4 3686 B14R2.1128 Cc1cc2c(cc1CN)OCCO2 Amb1101064 [0,1,0,1,0,0|1,0,1]=4 3687 B14R2.1128 Cc1cc2c(cc1CO)OCCO2 Amb18862967 [0,1,0,1,0,0|0,0,2]=4 3688 B14R2.1128 Cc1cc2c(cc1CS)OCCO2 Amb26334502 [0,1,0,1,0,0|0,1,1]=4 3689 B14R2.1128 Cc1cc2c(cc1NN)OCCO2 Amb18243772 [0,1,0,1,0,0|2,0,0]=4 3690 B14R2.1128 ClCc1cc2c(cc1Br)OCCO2 Amb418474 [0,1,0,1,0,0|1,0,1]=4 3691 B14R2.1128 ClCc1cc2c(cc1Cl)OCCO2 Amb8843210 [0,1,0,1,0,0|1,0,1]=4 3692 B14R2.1128 N#Cc1cc2c(cc1Br)OCCO2 Amb17200007 [0,1,0,1,0,0|1,0,1]=4 3693 B14R2.1128 N#Cc1cc2c(cc1N)OCCO2 Amb17200050 [0,1,0,1,0,0|1,0,1]=4 3694 B14R2.1128 N#Cc1cc2c(cc1O)OCCO2 Amb26992458 [0,1,0,1,0,0|1,0,1]=4 3695 B14R2.1128 NNc1cc2c(cc1Br)OCCO2 Amb22546397 [0,1,0,1,0,0|2,0,0]=4 3696 B14R2.1128 O=Cc1cc2c(cc1Br)CCCN2 Amb18730567 [0,1,0,1,0,0|2,0,0]=4 3697 B14R2.1128 O=Cc1cc2c(cc1Br)COCO2 Amb27636494 [0,1,0,1,0,0|2,0,0]=4 3698 B14R2.1128 O=Cc1cc2c(cc1Br)NCCC2 Amb18156817 [0,1,0,1,0,0|2,0,0]=4 3699 B14R2.1128 O=Cc1cc2c(cc1Br)OCCO2 Amb33544367 [0,1,0,1,0,0|0,0,0]=2 3700 B14R2.1128 O=Cc1cc2c(cc1Cl)CCCN2 Amb18189138 [0,1,0,1,0,0|2,0,0]=4 3701 B14R2.1128 O=Cc1cc2c(cc1Cl)NCCC2 Amb18189125 [0,1,0,1,0,0|2,0,0]=4 3702 B14R2.1128 O=Cc1cc2c(cc1Cl)OCCO2 Amb25057975 [0,1,0,1,0,0|0,0,0]=2 3703 B14R2.1128 O=Cc1cc2c(cc1F)CCCN2 Amb18824760 [0,1,0,1,0,0|2,0,0]=4 3704 B14R2.1128 O=Cc1cc2c(cc1F)NCCC2 Amb18194747 [0,1,0,1,0,0|2,0,0]=4 3705 B14R2.1128 O=Cc1cc2c(cc1F)OCCO2 Amb18823852 [0,1,0,1,0,0|0,0,0]=2 3706 B14R2.1128 O=Cc1cc2c(cc1O)CCCC2 Amb18127669 [0,1,0,1,0,0|2,0,0]=4 3707 B14R2.1128 O=Cc1cc2c(cc1O)CCCN2 Amb18196198 [0,1,0,1,0,0|2,0,0]=4 3708 B14R2.1128 O=Cc1cc2c(cc1O)NCCC2 Amb18196202 [0,1,0,1,0,0|2,0,0]=4 3709 B14R2.1128 O=Cc1cc2c(cc1O)OCCO2 Amb18648325 [0,1,0,1,0,0|0,0,0]=2 3710 B14R2.1128 O=Cc1nc2c(cc1Cl)OCCO2 Amb21961055 [0,1,0,1,0,0|1,0,0]=3 3711 B14R2.1128 OCc1cc2c(cc1Br)OCCO2 Amb1111280 [0,1,0,1,0,0|0,0,2]=4 3712 B14R2.1197 Cc1cc2cc(O)c(C=O)cc2o1 Amb18197056 [0,1,0,1,0,0|1,0,1]=4 3713 B14R2.1019 C#Cc1cc(Br)c2c(c1)OCCO2 Amb25842648 [0,1,0,1,0,0|1,0,1]=4 3714 B14R2.1019 C=Cc1cc(Br)c2c(c1)OCCO2 Amb25674652 [0,1,0,1,0,0|1,0,0]=3 3715 B14R2.1019 C=Cc1cc(Cl)c2c(c1)OCCO2 Amb27651958 [0,1,0,1,0,0|1,0,0]=3 3716 B14R2.1019 Cc1cc(C=O)cc2c1OCCO2 Amb25837396 [0,1,0,1,0,0|0,0,0]=2 3717 B14R2.1019 Cc1cc(C=O)cc2c1OCOC2 Amb27397229 [0,1,0,1,0,0|2,0,0]=4 3718 B14R2.1019 Cc1cc(CO)cc2c1OCCO2 Amb24648654 [0,1,0,1,0,0|0,0,2]=4 3719 B14R2.1019 ClCc1cc(Br)c2c(c1)OCCO2 Amb9211060 [0,1,0,1,0,0|1,0,1]=4 3720 B14R2.1019 ClCc1cc(Cl)c2c(c1)OCCO2 Amb1153986 [0,1,0,1,0,0|1,0,1]=4 3721 B14R2.1019 N#Cc1cc(Cl)c2c(c1)OCCO2 Amb426537 [0,1,0,1,0,0|1,0,1]=4 3722 B14R2.1019 NCc1cc(Br)c2c(c1)OCCO2 Amb13951265 [0,1,0,1,0,0|1,0,1]=4 3723 B14R2.1019 NCc1cc(Br)c2c(c1)OCCO2 Amb8837746 [0,1,0,1,0,0|1,0,1]=4 3724 B14R2.1019 NCc1cc(Cl)c2c(c1)OCCO2 Amb2372446 [0,1,0,1,0,0|1,0,1]=4 3725 B14R2.1019 NCc1cc(Cl)c2c(c1)OCCO2 Amb7969449 [0,1,0,1,0,0|1,0,1]=4 3726 B14R2.1019 NNc1cc(Br)c2c(c1)OCCO2 Amb33433630 [0,1,0,1,0,0|2,0,0]=4 3727 B14R2.1019 O=Cc1cc(Br)c2c(c1)CCCO2 Amb30016387 [0,1,0,1,0,0|1,0,0]=3 3728 B14R2.1019 O=Cc1cc(Br)c2c(c1)OCCO2 Amb5395446 [0,1,0,1,0,0|0,0,0]=2 3729 B14R2.1019 O=Cc1cc(Cl)c2c(c1)OCCO2 Amb425008 [0,1,0,1,0,0|0,0,0]=2 3730 B14R2.1019 O=Cc1cc(F)c2c(c1)OCCO2 Amb25803579 [0,1,0,1,0,0|0,0,0]=2 3731 B14R2.1019 O=Cc1cc(O)c2c(c1)CCCC2 Amb30010166 [0,1,0,1,0,0|2,0,0]=4 3732 B14R2.1019 O=Cc1cc(O)c2c(c1)CCCO2 Amb27954028 [0,1,0,1,0,0|1,0,0]=3 3733 B14R2.1019 OCc1cc(Br)c2c(c1)OCCO2 Amb8837830 [0,1,0,1,0,0|0,0,2]=4 3734 B14R2.1019 OCc1cc(Cl)c2c(c1)OCCO2 Amb38223 [0,1,0,1,0,0|0,0,2]=4 3735 B14R2.1019 SCc1cc(Br)c2c(c1)OCCO2 Amb24649229 [0,1,0,1,0,0|0,1,1]=4 3736 B14R2.1019 SCc1cc(Cl)c2c(c1)OCCO2 Amb27160879 [0,1,0,1,0,0|0,1,1]=4 3737 B14R2.1019 [C-]#[N+]c1cc(Br)c2c(c1)OCCO2 Amb33263417 [0,1,0,1,0,0|2,0,0]=4 3738 B14R2.2301 CC1Cc2cc(C=O)cc(O)c2O1 Amb18195572 [0,1,0,1,0,0|1,0,0]=3 3739 B14R2.2301 Cc1cc2cc(C=O)cc(O)c2o1 Amb18197059 [0,1,0,1,0,0|1,0,1]=4 3740 B14R2.11806 Cc1cc(C=O)c2c(c1O)CCC2 Amb21864912 [0,1,0,1,0,0|1,0,0]=3 3741 B14R2.11806 O=Cc1cc(Cl)c(O)c2c1CCC2 Amb27224828 [0,1,0,1,0,0|1,0,0]=3 3742 B14R2.92 CCc1ccc2c(c1O)OCCO2 Amb4477230 [0,1,0,1,0,0|1,0,1]=4 3743 B14R2.92 Cc1c(C=O)ccc2c1OCCO2 Amb18195580 [0,1,0,1,0,0|0,0,0]=2 3744 B14R2.92 Cc1c(CN)ccc2c1OCCO2 Amb27241207 [0,1,0,1,0,0|1,0,1]=4 3745 B14R2.92 ClCc1ccc2c(c1Cl)OCCO2 Amb24350226 [0,1,0,1,0,0|1,0,1]=4 3746 B14R2.92 NCc1ccc2c(c1F)OCCO2 Amb32677561 [0,1,0,1,0,0|1,0,1]=4 3747 B14R2.92 O=Cc1ccc2c(c1Br)OCCO2 Amb23400626 [0,1,0,1,0,0|0,0,0]=2 3748 B14R2.92 O=Cc1ccc2c(c1Cl)OCCO2 Amb27953648 [0,1,0,1,0,0|0,0,0]=2 3749 B14R2.92 O=Cc1ccc2c(c1F)OCCO2 Amb27954080 [0,1,0,1,0,0|0,0,0]=2 3750 B14R2.92 O=Cc1ccc2c(c1O)CCCC2 Amb18127671 [0,1,0,1,0,0|2,0,0]=4 3751 B14R2.3302 Cc1c(C=O)ccc2c1OC(=O)O2 Amb27789580 [0,1,0,1,0,0|1,0,1]=4 3752 B14R2.3302 Cc1c(C=O)ccc2c1OC(C)C2 Amb25160587 [0,1,0,1,0,0|1,0,0]=3 3753 B14R2.3302 Cc1cc2c(O)c(C=O)ccc2o1 Amb18825114 [0,1,0,1,0,0|1,0,1]=4 3754 B14R2.3302 Cc1nc2c(Cl)c(C=O)ccc2o1 Amb18189161 [0,1,0,1,0,0|1,0,1]=4 3755 B10R1.130 CCOC1=CC(=O)NC1=O Amb28246405 [1,0,0,0,1,0|1,0,1]=4 3756 B10R1.130 CCOC1=CC(=O)OC1=O Amb23556175 [1,0,0,0,1,0|1,0,1]=4 3757 B10R1.5 C=Cc1sccc1OCC Amb28194671 [1,0,0,0,1,0|2,0,0]=4 3758 B10R1.5 CCCc1ccsc1C=O Amb24479216 [1,0,0,0,1,0|2,0,0]=4 3759 B10R1.5 CCCc1occc1C=O Amb28239481 [1,0,0,0,1,0|2,0,0]=4 3760 B10R1.5 CCCc1sccc1C=O Amb26979790 [1,0,0,0,1,0|2,0,0]=4 3761 B10R1.5 CCCn1cccc1C=O Amb33527325 [1,0,0,0,1,0|2,0,0]=4 3762 B10R1.96 CCCc1ccc(C=O)o1 Amb844123 [1,0,0,0,1,0|2,0,0]=4 3763 B10R1.96 CCCc1ccc(C=O)s1 Amb2721841 [1,0,0,0,1,0|2,0,0]=4 3764 B10R1.96 CCCc1csc(C=O)c1 Amb26842721 [1,0,0,0,1,0|2,0,0]=4 3765 B10R1.96 CCCn1ccc(C=O)c1 Amb26000552 [1,0,0,0,1,0|2,0,0]=4 3766 B10R1.96 CCOc1ccc(C=O)o1 Amb27601369 [1,0,0,0,1,0|1,0,0]=3 3767 B10R1.96 CCOc1ccc(C=O)s1 Amb27792101 [1,0,0,0,1,0|1,0,0]=3 3768 B10R1.96 CCOc1ncc(C=O)s1 Amb2592139 [1,0,0,0,1,0|2,0,0]=4 3769 B10R1.96 CCSc1ccc(C=O)o1 Amb13882202 [1,0,0,0,1,0|1,1,0]=4 3770 B10R1.35 CCc1cc(C=O)oc1Br Amb18176672 [1,0,0,0,1,0|2,0,0]=4 3771 B10R1.35 CCc1cc(C=O)sc1Br Amb18768548 [1,0,0,0,1,0|2,0,0]=4 3772 B10R1.35 CCc1cc(C=O)sc1C Amb18830969 [1,0,0,0,1,0|2,0,0]=4 3773 B10R1.35 CCc1cc(C=O)sc1N Amb18674384 [1,0,0,0,1,0|2,0,0]=4 3774 B10R1.35 CCc1oc(C=O)cc1C Amb18832234 [1,0,0,0,1,0|2,0,0]=4 3775 B10R1.35 CCc1sc(C=O)cc1Br Amb2693757 [1,0,0,0,1,0|2,0,0]=4 3776 B10R1.35 CCc1sc(C=O)cc1C Amb18143558 [1,0,0,0,1,0|2,0,0]=4 3777 B10R1.35 CCc1sc(C=O)cc1Cl Amb25851047 [1,0,0,0,1,0|2,0,0]=4 3778 B10R1.35 CCc1sc(C=O)cc1F Amb18830490 [1,0,0,0,1,0|2,0,0]=4 3779 B10R1.35 CCn1cc(C=O)cc1C Amb10788626 [1,0,0,0,1,0|2,0,0]=4 3780 B10R1.35 CCn1nc(C=O)cc1O Amb27225684 [1,0,0,0,1,0|2,0,0]=4 3781 B10R1.35 COc1cc(C=O)cn1C Amb18832098 [1,0,0,0,1,0|2,0,0]=4 3782 B10R1.35 COc1cc(C=O)sc1Br Amb33728226 [1,0,0,0,1,0|2,0,0]=4 3783 B10R1.35 COc1sc(C=O)cc1Br Amb18658456 [1,0,0,0,1,0|2,0,0]=4 3784 B10R1.257 CCc1c(C=O)coc1N Amb18145968 [1,0,0,0,1,0|2,0,0]=4 3785 B10R1.257 CCc1c(C=O)csc1Br Amb18142188 [1,0,0,0,1,0|2,0,0]=4 3786 B10R1.257 CCc1c(C=O)csc1N Amb18145952 [1,0,0,0,1,0|2,0,0]=4 3787 B10R1.257 CCn1c(C)ccc1C=O Amb8455740 [1,0,0,0,1,0|2,0,0]=4 3788 B10R1.257 COc1c(C)csc1C=O Amb27425099 [1,0,0,0,1,0|2,0,0]=4 3789 B12R1.114 C=Cc1ccc(OCC)c(O)c1 Amb17594070 [0,0,0,0,1,1|1,0,0]=3 3790 B12R1.114 C=Cc1cnc(OCC)c(N)c1 Amb25353152 [0,0,0,0,1,1|2,0,0]=4 3791 B12R1.114 CCNc1ccc(C=O)cc1C Amb27814284 [0,0,0,0,1,1|2,0,0]=4 3792 B12R1.114 CCOc1ccc(C=O)cc1Br Amb837233 [0,0,0,0,1,1|1,0,0]=3 3793 B12R1.114 CCOc1ccc(C=O)cc1C Amb18563617 [0,0,0,0,1,1|1,0,0]=3 3794 B12R1.114 CCOc1ccc(C=O)cc1Cl Amb6827127 [0,0,0,0,1,1|1,0,0]=3 3795 B12R1.114 CCOc1ccc(C=O)cc1F Amb6717810 [0,0,0,0,1,1|1,0,0]=3 3796 B12R1.114 CCOc1ccc(C=O)cc1I Amb3599137 [0,0,0,0,1,1|1,0,0]=3 3797 B12R1.114 CCOc1ccc(C=O)cc1N Amb17208168 [0,0,0,0,1,1|1,0,0]=3 3798 B12R1.114 CCOc1ccc(C=O)cc1O Amb16233233 [0,0,0,0,1,1|0,0,0]=2 3799 B12R1.114 CCOc1ccc(NN)cc1O Amb25234221 [0,0,0,0,1,1|2,0,0]=4 3800 B12R1.114 CCOc1ccc(OC)cc1O Amb25112654 [0,0,0,0,1,1|2,0,0]=4 3801 B12R1.114 CCOc1cnc(CCl)cc1O Amb17218038 [0,0,0,0,1,1|1,0,1]=4 3802 B12R1.114 CCOc1cnc(CN)cc1O Amb17218164 [0,0,0,0,1,1|1,0,1]=4 3803 B12R1.114 CCOc1ncc(C=O)cc1C Amb22235598 [0,0,0,0,1,1|1,0,0]=3 3804 B12R1.114 CCOc1ncc(C=O)cc1Cl Amb27752138 [0,0,0,0,1,1|1,0,0]=3 3805 B12R1.114 CCOc1ncc(C=O)cc1F Amb20171059 [0,0,0,0,1,1|1,0,0]=3 3806 B12R1.114 O=Cc1ccc(OCCl)c(Cl)c1 Amb26334469 [0,0,0,0,1,1|2,0,0]=4