0 B10R1.15 Br\C=C(\Br)c1ccccc1 Amb8394126 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.15 C#CC(=O)c1ccccc1 Amb1088846 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.15 C#CC(=O)c1ccccn1 Amb28120737 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.15 C#CC(=O)c1cccnc1 Amb27272672 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.15 C#CC(=O)c1ccncc1 Amb27235537 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.15 C#CC(C)c1ccncc1 Amb33380650 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.15 C#CC(O)c1ccncc1 Amb21964740 [0,0,0,0,0,0|2,0,2]=4 7 B10R1.15 C=C(C#N)c1ccccc1 Amb17231856 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.15 C=C(C=O)c1ccccc1 Amb16233227 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.15 C=C(CBr)c1ccccc1 Amb8391739 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.15 C=C(CBr)c1ccncc1 Amb24759413 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.15 C=C(CBr)c1ccncn1 Amb33009086 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.15 C=C(CCl)c1ccccc1 Amb26968652 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.15 C=C(CCl)c1ccncc1 Amb33052726 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.15 C=C(CCl)c1ccncn1 Amb33057655 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.15 C=C(CN)c1ccccc1 Amb10609068 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.15 C=C(CN)c1ccccc1 Amb9421165 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.15 C=C(CN)c1ccccn1 Amb27767907 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.15 C=C(CN)c1cccnc1 Amb33360054 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.15 C=C(CN)c1ccncc1 Amb33380645 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.15 C=C(CN)c1ccncn1 Amb33268582 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.15 C=C(CO)c1ccccc1 Amb27839071 [0,0,0,0,0,0|4,0,0]=4 22 B10R1.15 C=C(CO)c1ccncc1 Amb25887623 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.15 C=C(NC)c1ccccc1 Amb27975699 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.15 C=CC(=C)c1ccccc1 Amb26348162 [0,0,0,0,0,0|4,0,0]=4 25 B10R1.15 C=CC(=O)c1ccccc1 Amb33542643 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.15 C=CC(=O)c1ccccn1 Amb28399382 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.15 C=CC(=O)c1cccnc1 Amb25776729 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.15 C=CC(=O)c1ccncc1 Amb24482055 [0,0,0,0,0,0|2,0,0]=2 29 B10R1.15 C=CC(=O)c1ccncn1 Amb27203886 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.15 C=CC(=O)c1ccnnc1 Amb28135491 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.15 C=CC(N)c1ccncc1 Amb25789567 [0,0,0,0,0,0|3,0,1]=4 32 B10R1.15 C=CC(O)c1ccncc1 Amb24546417 [0,0,0,0,0,0|2,0,2]=4 33 B10R1.15 C=CN(C)c1ccncc1 Amb26031722 [0,0,0,0,0,0|4,0,0]=4 34 B10R1.15 C=CS(=O)c1ccccc1 Amb15692858 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.15 C=C[C@H](N)c1ccncc1 Amb27770577 [0,0,0,0,0,0|3,0,1]=4 36 B10R1.15 CC(C#N)c1ccncc1 Amb8950034 [0,0,0,0,0,0|2,0,2]=4 37 B10R1.15 CC(C=O)c1ccncc1 Amb33358501 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.15 CC(CBr)c1ccncc1 Amb26369737 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.15 CC(CCl)c1ccncc1 Amb27835971 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [0,0,0,0,0,0|3,0,1]=4 41 B10R1.15 CC(CN)c1ccccc1 Amb5717369 [0,0,0,0,0,0|3,0,1]=4 42 B10R1.15 CC(CN)c1ccncc1 Amb32668866 [0,0,0,0,0,0|2,0,1]=3 43 B10R1.15 CC(CN)c1ccncc1 Amb8950130 [0,0,0,0,0,0|2,0,1]=3 44 B10R1.15 CC(CN)c1ccncn1 Amb25917566 [0,0,0,0,0,0|3,0,1]=4 45 B10R1.15 CC(CO)c1ccncc1 Amb24480432 [0,0,0,0,0,0|3,0,1]=4 46 B10R1.15 CC(NCl)c1ccccc1 Amb28049660 [0,0,0,0,0,0|3,0,1]=4 47 B10R1.15 CC(NN)c1ccccc1 Amb10610271 [0,0,0,0,0,0|2,0,1]=3 48 B10R1.15 CC(NN)c1ccccc1 Amb6251215 [0,0,0,0,0,0|2,0,1]=3 49 B10R1.15 CC(NN)c1ccccn1 Amb6243803 [0,0,0,0,0,0|3,0,1]=4 50 B10R1.15 CC(NN)c1cccnc1 Amb6243761 [0,0,0,0,0,0|3,0,1]=4 51 B10R1.15 CC(NN)c1ccncc1 Amb32663987 [0,0,0,0,0,0|1,0,1]=2 52 B10R1.15 CC(NN)c1ccncc1 Amb9714299 [0,0,0,0,0,0|1,0,1]=2 53 B10R1.15 CC(NO)c1ccccc1 Amb10605006 [0,0,0,0,0,0|3,0,1]=4 54 B10R1.15 CC(ON)c1ccccc1 Amb17089185 [0,0,0,0,0,0|3,0,1]=4 55 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [0,0,0,0,0,0|3,0,1]=4 56 B10R1.15 CC(ON)c1ccncc1 Amb22397090 [0,0,0,0,0,0|2,0,1]=3 57 B10R1.15 CC(ON)c1ccncn1 Amb33268673 [0,0,0,0,0,0|3,0,1]=4 58 B10R1.15 CCC(=O)c1ccccc1 Amb4037285 [0,0,0,0,0,0|3,0,0]=3 59 B10R1.15 CCC(=O)c1ccccn1 Amb6301470 [0,0,0,0,0,0|4,0,0]=4 60 B10R1.15 CCC(=O)c1cccnc1 Amb8386799 [0,0,0,0,0,0|4,0,0]=4 61 B10R1.15 CCC(=O)c1ccncc1 Amb10576400 [0,0,0,0,0,0|2,0,0]=2 62 B10R1.15 CCC(=O)c1ccncn1 Amb25737542 [0,0,0,0,0,0|3,0,0]=3 63 B10R1.15 CCC(=O)c1cnncn1 Amb18203073 [0,0,0,0,0,0|4,0,0]=4 64 B10R1.15 CCC(Br)c1ccncc1 Amb27463363 [0,0,0,0,0,0|3,0,1]=4 65 B10R1.15 CCC(C)c1ccncc1 Amb26842817 [0,0,0,0,0,0|3,0,1]=4 66 B10R1.15 CCC(N)c1ccncc1 Amb8009606 [0,0,0,0,0,0|3,0,1]=4 67 B10R1.15 CCC(O)c1ccncc1 Amb16233288 [0,0,0,0,0,0|2,0,2]=4 68 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [0,0,0,0,0,0|4,0,0]=4 69 B10R1.15 CC[C@@H](N)c1ccncc1 Amb30647447 [0,0,0,0,0,0|3,0,1]=4 70 B10R1.15 CC[C@H](N)c1ccncc1 Amb27404537 [0,0,0,0,0,0|3,0,1]=4 71 B10R1.15 CC[C@H](N)c1ccncc1 Amb30647448 [0,0,0,0,0,0|3,0,1]=4 72 B10R1.15 CC[C@H](O)c1ccncc1 Amb27861997 [0,0,0,0,0,0|2,0,2]=4 73 B10R1.15 CN(N=O)c1ccncc1 Amb25736812 [0,0,0,0,0,0|3,0,1]=4 74 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [0,0,0,0,0,0|3,0,0]=3 75 B10R1.15 CNC(=N)c1ccccc1 Amb28775800 [0,0,0,0,0,0|3,0,0]=3 76 B10R1.15 CNC(=N)c1cccnc1 Amb32667420 [0,0,0,0,0,0|4,0,0]=4 77 B10R1.15 CNC(=N)c1ccncn1 Amb28119700 [0,0,0,0,0,0|3,0,0]=3 78 B10R1.15 CNC(=O)C1=CC=CNC1 Amb27252063 [0,0,0,0,0,0|3,0,1]=4 79 B10R1.15 CNC(=O)c1ccccc1 Amb2591685 [0,0,0,0,0,0|2,0,0]=2 80 B10R1.15 CNC(=O)c1ccccn1 Amb6892873 [0,0,0,0,0,0|3,0,0]=3 81 B10R1.15 CNC(=O)c1cccnc1 Amb3886560 [0,0,0,0,0,0|3,0,0]=3 82 B10R1.15 CNC(=O)c1ccncc1 Amb26328844 [0,0,0,0,0,0|1,0,0]=1 83 B10R1.15 CNC(=O)c1ccncn1 Amb27589630 [0,0,0,0,0,0|2,0,0]=2 84 B10R1.15 CNC(=O)c1ncccn1 Amb25985661 [0,0,0,0,0,0|4,0,0]=4 85 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [0,0,0,0,0,0|2,1,0]=3 86 B10R1.15 CNC(=S)c1cccnc1 Amb27877638 [0,0,0,0,0,0|3,1,0]=4 87 B10R1.15 CNC(C)c1ccccc1 Amb6382953 [0,0,0,0,0,0|3,0,1]=4 88 B10R1.15 CNC(C)c1ccccc1 Amb9745717 [0,0,0,0,0,0|3,0,1]=4 89 B10R1.15 CNC(C)c1ccncc1 Amb10189609 [0,0,0,0,0,0|2,0,1]=3 90 B10R1.15 CNC(C)c1ccncc1 Amb22492289 [0,0,0,0,0,0|2,0,1]=3 91 B10R1.15 CNC(C)c1ccncc1 Amb22587687 [0,0,0,0,0,0|2,0,1]=3 92 B10R1.15 CNC(C)c1ccncc1 Amb9705906 [0,0,0,0,0,0|2,0,1]=3 93 B10R1.15 CNC(C)c1ccncn1 Amb10608544 [0,0,0,0,0,0|3,0,1]=4 94 B10R1.15 CNC(C)c1ccncn1 Amb22587685 [0,0,0,0,0,0|3,0,1]=4 95 B10R1.15 CNN(C)c1ccccc1 Amb27398128 [0,0,0,0,0,0|4,0,0]=4 96 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [0,0,0,0,0,0|3,0,1]=4 97 B10R1.15 CN[C@@H](C)c1ccncc1 Amb28193264 [0,0,0,0,0,0|2,0,1]=3 98 B10R1.15 CN[C@@H](C)c1ccncc1 Amb33457902 [0,0,0,0,0,0|2,0,1]=3 99 B10R1.15 CN[C@H](C)c1ccccc1 Amb10844610 [0,0,0,0,0,0|3,0,1]=4 100 B10R1.15 COC(=N)c1ccccc1 Amb4009954 [0,0,0,0,0,0|4,0,0]=4 101 B10R1.15 COC(=N)c1ccccc1 Amb6366188 [0,0,0,0,0,0|4,0,0]=4 102 B10R1.15 COC(=O)c1ccccc1 Amb4302710 [0,0,0,0,0,0|3,0,0]=3 103 B10R1.15 COC(=O)c1ccccn1 Amb2721020 [0,0,0,0,0,0|4,0,0]=4 104 B10R1.15 COC(=O)c1cccnc1 Amb1212078 [0,0,0,0,0,0|4,0,0]=4 105 B10R1.15 COC(=O)c1cccnc1 Amb22741138 [0,0,0,0,0,0|4,0,0]=4 106 B10R1.15 COC(=O)c1ccncc1 Amb6608958 [0,0,0,0,0,0|2,0,0]=2 107 B10R1.15 COC(=O)c1ccncn1 Amb7101502 [0,0,0,0,0,0|3,0,0]=3 108 B10R1.15 COC(=O)c1ccnnc1 Amb17935713 [0,0,0,0,0,0|3,0,0]=3 109 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [0,0,0,0,0,0|3,1,0]=4 110 B10R1.15 COS(=O)c1ccccc1 Amb2689327 [0,0,0,0,0,0|4,0,0]=4 111 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [0,0,0,0,0,0|4,0,0]=4 112 B10R1.15 CSC(=O)c1ccccn1 Amb1487227 [0,0,0,0,0,0|4,0,0]=4 113 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [0,0,0,0,0,0|3,1,0]=4 114 B10R1.15 C[C@@H](CN)c1ccccc1 Amb33623692 [0,0,0,0,0,0|3,0,1]=4 115 B10R1.15 C[C@@H](CN)c1ccccc1 Amb4036825 [0,0,0,0,0,0|3,0,1]=4 116 B10R1.15 C[C@@H](CN)c1ccncc1 Amb33727423 [0,0,0,0,0,0|2,0,1]=3 117 B10R1.15 C[C@@H](CO)c1ccncc1 Amb33735556 [0,0,0,0,0,0|3,0,1]=4 118 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [0,0,0,0,0,0|2,0,1]=3 119 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [0,0,0,0,0,0|3,0,1]=4 120 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [0,0,0,0,0,0|3,0,1]=4 121 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [0,0,0,0,0,0|3,0,1]=4 122 B10R1.15 C[C@@H](ON)c1ccccc1 Amb32665789 [0,0,0,0,0,0|3,0,1]=4 123 B10R1.15 C[C@@H](ON)c1ccncc1 Amb33620851 [0,0,0,0,0,0|2,0,1]=3 124 B10R1.15 C[C@H](CN)c1ccccc1 Amb10070369 [0,0,0,0,0,0|3,0,1]=4 125 B10R1.15 C[C@H](CN)c1ccncc1 Amb33747422 [0,0,0,0,0,0|2,0,1]=3 126 B10R1.15 C[C@H](CO)c1ccncc1 Amb33730462 [0,0,0,0,0,0|3,0,1]=4 127 B10R1.15 C[C@H](NN)c1ccccc1 Amb26589811 [0,0,0,0,0,0|2,0,1]=3 128 B10R1.15 C[C@H](ON)c1ccccc1 Amb32665788 [0,0,0,0,0,0|3,0,1]=4 129 B10R1.15 C[C@H](ON)c1ccccc1 Amb32666539 [0,0,0,0,0,0|3,0,1]=4 130 B10R1.15 C[C@H](ON)c1ccncc1 Amb33299308 [0,0,0,0,0,0|2,0,1]=3 131 B10R1.15 C\C(=C/Br)c1ccccc1 Amb25066105 [0,0,0,0,0,0|4,0,0]=4 132 B10R1.15 C\C(=C/Cl)c1ccccc1 Amb30621745 [0,0,0,0,0,0|4,0,0]=4 133 B10R1.15 C\C(=C\Br)c1ccccc1 Amb4035454 [0,0,0,0,0,0|4,0,0]=4 134 B10R1.15 C\C(=C\Br)c1ccncn1 Amb28245272 [0,0,0,0,0,0|4,0,0]=4 135 B10R1.15 C\C(=C\Cl)c1ccccc1 Amb26652006 [0,0,0,0,0,0|4,0,0]=4 136 B10R1.15 C\C(=N/N)c1ccccc1 Amb4016930 [0,0,0,0,0,0|2,0,1]=3 137 B10R1.15 C\C(=N/N)c1ccccn1 Amb22552431 [0,0,0,0,0,0|3,0,1]=4 138 B10R1.15 C\C(=N/O)c1ccccc1 Amb2387477 [0,0,0,0,0,0|3,0,1]=4 139 B10R1.15 C\C(=N/O)c1ccncc1 Amb6336368 [0,0,0,0,0,0|2,0,1]=3 140 B10R1.15 C\C(=N\O)c1ccccc1 Amb3428046 [0,0,0,0,0,0|3,0,1]=4 141 B10R1.15 C\C(=N\O)c1ccncc1 Amb2780071 [0,0,0,0,0,0|2,0,1]=3 142 B10R1.15 C\C(=N\O)c1ccnnc1 Amb27654291 [0,0,0,0,0,0|3,0,1]=4 143 B10R1.15 C\C=C(/C)c1ccccc1 Amb29628341 [0,0,0,0,0,0|4,0,0]=4 144 B10R1.15 C\C=C(/C)c1ccncc1 Amb24103190 [0,0,0,0,0,0|3,0,0]=3 145 B10R1.15 C\C=C(/F)c1ccccc1 Amb25881627 [0,0,0,0,0,0|4,0,0]=4 146 B10R1.15 C\C=C(/N)c1ccccc1 Amb27787637 [0,0,0,0,0,0|4,0,0]=4 147 B10R1.15 C\C=C(\C)c1ccccc1 Amb26360165 [0,0,0,0,0,0|4,0,0]=4 148 B10R1.15 Cl\C=C(\Cl)c1ccccc1 Amb25849275 [0,0,0,0,0,0|4,0,0]=4 149 B10R1.15 N#CC(=O)c1ccccc1 Amb6893027 [0,0,0,0,0,0|2,0,1]=3 150 B10R1.15 N#CC(N)c1ccncc1 Amb1108968 [0,0,0,0,0,0|2,0,2]=4 151 B10R1.15 N=C(NN)c1ccccc1 Amb22234855 [0,0,0,0,0,0|2,0,0]=2 152 B10R1.15 N=C(NN)c1ccccn1 Amb22499914 [0,0,0,0,0,0|3,0,0]=3 153 B10R1.15 N=C(NN)c1cccnc1 Amb19514929 [0,0,0,0,0,0|3,0,0]=3 154 B10R1.15 N=C(NN)c1cccnc1 Amb32644495 [0,0,0,0,0,0|3,0,0]=3 155 B10R1.15 N=C(NN)c1ccncc1 Amb8631022 [0,0,0,0,0,0|1,0,0]=1 156 B10R1.15 N=C(NN)c1cnccn1 Amb2782717 [0,0,0,0,0,0|4,0,0]=4 157 B10R1.15 N=C(NN)c1ncccn1 Amb33545461 [0,0,0,0,0,0|4,0,0]=4 158 B10R1.15 N=C(NO)c1ccncc1 Amb8559047 [0,0,0,0,0,0|2,0,0]=2 159 B10R1.15 N=C(NO)c1ccncn1 Amb8631024 [0,0,0,0,0,0|3,0,0]=3 160 B10R1.15 N=C(NO)c1ccnnc1 Amb24742886 [0,0,0,0,0,0|3,0,0]=3 161 B10R1.15 N=CC(=O)c1ccccc1 Amb27783553 [0,0,0,0,0,0|2,0,1]=3 162 B10R1.15 NC(=S=O)c1ccncc1 Amb28137969 [0,0,0,0,0,0|3,0,0]=3 163 B10R1.15 NC(CO)c1ccncc1 Amb17935881 [0,0,0,0,0,0|3,0,1]=4 164 B10R1.15 NC(CO)c1ccncc1 Amb18561776 [0,0,0,0,0,0|3,0,1]=4 165 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [0,0,0,0,0,0|2,0,0]=2 166 B10R1.15 NCC(=O)c1ccccc1 Amb33531112 [0,0,0,0,0,0|2,0,0]=2 167 B10R1.15 NCC(=O)c1ccccn1 Amb10601921 [0,0,0,0,0,0|3,0,0]=3 168 B10R1.15 NCC(=O)c1ccccn1 Amb18832469 [0,0,0,0,0,0|3,0,0]=3 169 B10R1.15 NCC(=O)c1cccnc1 Amb17607867 [0,0,0,0,0,0|3,0,0]=3 170 B10R1.15 NCC(=O)c1cccnc1 Amb22277079 [0,0,0,0,0,0|3,0,0]=3 171 B10R1.15 NCC(=O)c1cccnc1 Amb22754018 [0,0,0,0,0,0|3,0,0]=3 172 B10R1.15 NCC(=O)c1ccncc1 Amb18832471 [0,0,0,0,0,0|1,0,0]=1 173 B10R1.15 NCC(=O)c1ccncc1 Amb22002046 [0,0,0,0,0,0|1,0,0]=1 174 B10R1.15 NCC(=O)c1ccncn1 Amb18832380 [0,0,0,0,0,0|2,0,0]=2 175 B10R1.15 NCC(=O)c1cnccn1 Amb21862012 [0,0,0,0,0,0|4,0,0]=4 176 B10R1.15 NCC(=O)c1cnccn1 Amb33038182 [0,0,0,0,0,0|4,0,0]=4 177 B10R1.15 NCC(=O)c1cncnc1 Amb18832378 [0,0,0,0,0,0|4,0,0]=4 178 B10R1.15 NCC(=O)c1ncccn1 Amb24105961 [0,0,0,0,0,0|4,0,0]=4 179 B10R1.15 NCC(Cl)c1ccccc1 Amb27984951 [0,0,0,0,0,0|3,0,1]=4 180 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [0,0,0,0,0,0|3,0,1]=4 181 B10R1.15 NCC(F)c1ccccc1 Amb33249671 [0,0,0,0,0,0|3,0,1]=4 182 B10R1.15 NCC(F)c1ccncc1 Amb27653637 [0,0,0,0,0,0|2,0,1]=3 183 B10R1.15 NCC(F)c1ccncn1 Amb33269015 [0,0,0,0,0,0|3,0,1]=4 184 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [0,0,0,0,0,0|3,0,1]=4 185 B10R1.15 NCC(N)c1ccccc1 Amb33473621 [0,0,0,0,0,0|3,0,1]=4 186 B10R1.15 NCC(N)c1ccccc1 Amb9380661 [0,0,0,0,0,0|3,0,1]=4 187 B10R1.15 NCC(N)c1ccncc1 Amb18063802 [0,0,0,0,0,0|2,0,1]=3 188 B10R1.15 NCC(N)c1ccncn1 Amb27669693 [0,0,0,0,0,0|3,0,1]=4 189 B10R1.15 NCC(O)c1ccccc1 Amb33542602 [0,0,0,0,0,0|2,0,2]=4 190 B10R1.15 NCC(O)c1ccccc1 Amb33544420 [0,0,0,0,0,0|2,0,2]=4 191 B10R1.15 NCC(O)c1ccncc1 Amb22755845 [0,0,0,0,0,0|1,0,2]=3 192 B10R1.15 NCC(O)c1ccncc1 Amb9703695 [0,0,0,0,0,0|1,0,2]=3 193 B10R1.15 NCC(O)c1ccncn1 Amb24434504 [0,0,0,0,0,0|2,0,2]=4 194 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [0,0,0,0,0,0|3,0,1]=4 195 B10R1.15 NC[C@@H](F)c1ccccc1 Amb32661014 [0,0,0,0,0,0|3,0,1]=4 196 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [0,0,0,0,0,0|2,0,2]=4 197 B10R1.15 NC[C@@H](O)c1ccccc1 Amb8630286 [0,0,0,0,0,0|2,0,2]=4 198 B10R1.15 NC[C@@H](O)c1ccncc1 Amb24479579 [0,0,0,0,0,0|1,0,2]=3 199 B10R1.15 NC[C@@H](O)c1ccncn1 Amb24546069 [0,0,0,0,0,0|2,0,2]=4 200 B10R1.15 NC[C@H](N)c1ccncc1 Amb27617070 [0,0,0,0,0,0|2,0,1]=3 201 B10R1.15 NC[C@H](O)c1ccccc1 Amb10070626 [0,0,0,0,0,0|2,0,2]=4 202 B10R1.15 NC[C@H](O)c1ccccc1 Amb8631408 [0,0,0,0,0,0|2,0,2]=4 203 B10R1.15 NC[C@H](O)c1ccncc1 Amb27227500 [0,0,0,0,0,0|1,0,2]=3 204 B10R1.15 NC[C@H](O)c1ccncn1 Amb25917456 [0,0,0,0,0,0|2,0,2]=4 205 B10R1.15 NC[PH](=O)c1ccccc1 Amb28119772 [0,0,0,0,0,0|3,0,0]=3 206 B10R1.15 NNC(=O)C1=CCCCC1 Amb27596590 [0,0,0,0,0,0|1,0,3]=4 207 B10R1.15 NNC(=O)C1=CCNCC1 Amb35730094 [0,0,0,0,0,0|0,0,4]=4 208 B10R1.15 NNC(=O)C1=CNCCC1 Amb27244943 [0,0,0,0,0,0|2,0,2]=4 209 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [0,0,0,0,0,0|1,0,0]=1 210 B10R1.15 NNC(=O)c1ccccn1 Amb1208395 [0,0,0,0,0,0|2,0,0]=2 211 B10R1.15 NNC(=O)c1cccnc1 Amb1786962 [0,0,0,0,0,0|2,0,0]=2 212 B10R1.15 NNC(=O)c1cccnn1 Amb33544789 [0,0,0,0,0,0|3,0,0]=3 213 B10R1.15 NNC(=O)c1ccncc1 Amb6335257 [0,0,0,0,0,0|0,0,0]=0 214 B10R1.15 NNC(=O)c1ccncn1 Amb10844888 [0,0,0,0,0,0|1,0,0]=1 215 B10R1.15 NNC(=O)c1ccnnc1 Amb27623682 [0,0,0,0,0,0|1,0,0]=1 216 B10R1.15 NNC(=O)c1ccnnc1 Amb32663904 [0,0,0,0,0,0|1,0,0]=1 217 B10R1.15 NNC(=O)c1cnccn1 Amb1161624 [0,0,0,0,0,0|3,0,0]=3 218 B10R1.15 NNC(=O)c1ncccn1 Amb16231289 [0,0,0,0,0,0|3,0,0]=3 219 B10R1.15 NNC(=O)c1nccnn1 Amb27486004 [0,0,0,0,0,0|4,0,0]=4 220 B10R1.15 NNC(=S)c1ccccc1 Amb23513674 [0,0,0,0,0,0|1,1,0]=2 221 B10R1.15 NNS(=O)c1ccccc1 Amb27428863 [0,0,0,0,0,0|2,0,0]=2 222 B10R1.15 N[C@@H](CO)c1ccncc1 Amb25146410 [0,0,0,0,0,0|3,0,1]=4 223 B10R1.15 N[C@H](CO)c1ccncc1 Amb24714739 [0,0,0,0,0,0|3,0,1]=4 224 B10R1.15 N\C(=N/O)c1ccccc1 Amb1149046 [0,0,0,0,0,0|3,0,1]=4 225 B10R1.15 N\C(=N/O)c1ccccc1 Amb6298734 [0,0,0,0,0,0|3,0,1]=4 226 B10R1.15 N\C(=N/O)c1ccncc1 Amb1159214 [0,0,0,0,0,0|2,0,1]=3 227 B10R1.15 N\C(=N\O)c1ccccc1 Amb2226909 [0,0,0,0,0,0|3,0,1]=4 228 B10R1.15 N\C(=N\O)c1ccncc1 Amb2371661 [0,0,0,0,0,0|2,0,1]=3 229 B10R1.15 N\N=C(/Cl)c1ccccc1 Amb27951117 [0,0,0,0,0,0|2,0,1]=3 230 B10R1.15 N\N=C(/N)c1ccccc1 Amb20407822 [0,0,0,0,0,0|2,0,1]=3 231 B10R1.15 N\N=C(/N)c1cccnc1 Amb2695042 [0,0,0,0,0,0|3,0,1]=4 232 B10R1.15 N\N=C(/N)c1ccncc1 Amb8395125 [0,0,0,0,0,0|1,0,1]=2 233 B10R1.15 N\N=C(\Cl)c1ccccc1 Amb27210015 [0,0,0,0,0,0|2,0,1]=3 234 B10R1.15 N\N=C(\N)c1ccncn1 Amb24724142 [0,0,0,0,0,0|2,0,1]=3 235 B10R1.15 N\N=C(\N)c1ccnnc1 Amb27202640 [0,0,0,0,0,0|2,0,1]=3 236 B10R1.15 O=C(CBr)c1ccccc1 Amb33533065 [0,0,0,0,0,0|3,0,0]=3 237 B10R1.15 O=C(CBr)c1ccccn1 Amb1980867 [0,0,0,0,0,0|4,0,0]=4 238 B10R1.15 O=C(CBr)c1ccccn1 Amb2684941 [0,0,0,0,0,0|4,0,0]=4 239 B10R1.15 O=C(CBr)c1cccnc1 Amb1981330 [0,0,0,0,0,0|4,0,0]=4 240 B10R1.15 O=C(CBr)c1cccnc1 Amb2684942 [0,0,0,0,0,0|4,0,0]=4 241 B10R1.15 O=C(CBr)c1ccncc1 Amb1981329 [0,0,0,0,0,0|2,0,0]=2 242 B10R1.15 O=C(CBr)c1ccncc1 Amb2684943 [0,0,0,0,0,0|2,0,0]=2 243 B10R1.15 O=C(CBr)c1ccncn1 Amb22304669 [0,0,0,0,0,0|3,0,0]=3 244 B10R1.15 O=C(CBr)c1ccncn1 Amb22490403 [0,0,0,0,0,0|3,0,0]=3 245 B10R1.15 O=C(CCl)c1ccccc1 Amb3940253 [0,0,0,0,0,0|3,0,0]=3 246 B10R1.15 O=C(CCl)c1ccccn1 Amb33329358 [0,0,0,0,0,0|4,0,0]=4 247 B10R1.15 O=C(CCl)c1ccccn1 Amb33545115 [0,0,0,0,0,0|4,0,0]=4 248 B10R1.15 O=C(CCl)c1cccnc1 Amb22371841 [0,0,0,0,0,0|4,0,0]=4 249 B10R1.15 O=C(CCl)c1cccnc1 Amb7172585 [0,0,0,0,0,0|4,0,0]=4 250 B10R1.15 O=C(CCl)c1ccncc1 Amb22371842 [0,0,0,0,0,0|2,0,0]=2 251 B10R1.15 O=C(CCl)c1ccncc1 Amb3319289 [0,0,0,0,0,0|2,0,0]=2 252 B10R1.15 O=C(CCl)c1ccncn1 Amb28456565 [0,0,0,0,0,0|3,0,0]=3 253 B10R1.15 O=C(CF)c1ccccc1 Amb10603600 [0,0,0,0,0,0|3,0,0]=3 254 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [0,0,0,0,0,0|3,0,0]=3 255 B10R1.15 O=C(CO)c1ccccc1 Amb3940718 [0,0,0,0,0,0|3,0,0]=3 256 B10R1.15 O=C(CO)c1ccccn1 Amb18063640 [0,0,0,0,0,0|4,0,0]=4 257 B10R1.15 O=C(CO)c1cccnc1 Amb18063681 [0,0,0,0,0,0|4,0,0]=4 258 B10R1.15 O=C(CO)c1ccncc1 Amb18063686 [0,0,0,0,0,0|2,0,0]=2 259 B10R1.15 O=C(CS)c1ccccc1 Amb16192503 [0,0,0,0,0,0|3,0,0]=3 260 B10R1.15 O=C(C[K])c1ccncn1 Amb28287563 [0,0,0,0,0,0|3,0,0]=3 261 B10R1.15 O=C(NCl)c1cccnc1 Amb26039027 [0,0,0,0,0,0|3,0,0]=3 262 B10R1.15 O=C(NI)c1ccccc1 Amb27787732 [0,0,0,0,0,0|2,0,0]=2 263 B10R1.15 O=C(NO)c1ccccc1 Amb1645521 [0,0,0,0,0,0|2,0,0]=2 264 B10R1.15 O=C(NO)c1ccccn1 Amb6268699 [0,0,0,0,0,0|3,0,0]=3 265 B10R1.15 O=C(NO)c1cccnc1 Amb33532633 [0,0,0,0,0,0|3,0,0]=3 266 B10R1.15 O=C(NO)c1ccncc1 Amb6270440 [0,0,0,0,0,0|1,0,0]=1 267 B10R1.15 O=C(NO)c1ccncn1 Amb24099638 [0,0,0,0,0,0|2,0,0]=2 268 B10R1.15 O=C(NO)c1cnccn1 Amb25937815 [0,0,0,0,0,0|4,0,0]=4 269 B10R1.15 O=C(NO)c1cncnc1 Amb26512805 [0,0,0,0,0,0|4,0,0]=4 270 B10R1.15 O=C(NO)c1ncccn1 Amb26420351 [0,0,0,0,0,0|4,0,0]=4 271 B10R1.15 O=C(N[O-])c1ccccc1 Amb18800075 [0,0,0,0,0,0|2,0,0]=2 272 B10R1.15 O=C(N[O-])c1ccccc1 Amb4035742 [0,0,0,0,0,0|2,0,0]=2 273 B10R1.15 O=C(OO)c1cccnc1 Amb24094187 [0,0,0,0,0,0|4,0,0]=4 274 B10R1.15 O=C(OO)c1ccncc1 Amb24066209 [0,0,0,0,0,0|2,0,0]=2 275 B10R1.15 O=C(O[K])c1cccnc1 Amb3150242 [0,0,0,0,0,0|4,0,0]=4 276 B10R1.15 O=CC(=O)c1ccccc1 Amb4338217 [0,0,0,0,0,0|3,0,0]=3 277 B10R1.15 O=CC(=O)c1ccccc1 Amb8513585 [0,0,0,0,0,0|3,0,0]=3 278 B10R1.15 O=CC(=O)c1ccccn1 Amb25066902 [0,0,0,0,0,0|4,0,0]=4 279 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [0,0,0,0,0,0|4,0,0]=4 280 B10R1.15 O=S(CO)c1ccccc1 Amb27617047 [0,0,0,0,0,0|4,0,0]=4 281 B10R1.15 O=S(O[Na])c1ccccc1 Amb6365754 [0,0,0,0,0,0|4,0,0]=4 282 B10R1.15 OC(CBr)c1ccncc1 Amb24099591 [0,0,0,0,0,0|2,0,2]=4 283 B10R1.15 OC(CCl)c1ccncc1 Amb27470348 [0,0,0,0,0,0|2,0,2]=4 284 B10R1.15 OC(CF)c1ccncc1 Amb33380647 [0,0,0,0,0,0|2,0,2]=4 285 B10R1.15 OCC(F)c1ccncc1 Amb28384557 [0,0,0,0,0,0|3,0,1]=4 286 B10R1.15 OCC(O)c1ccncc1 Amb23538718 [0,0,0,0,0,0|2,0,2]=4 287 B10R1.15 OCC(O)c1ccncc1 Amb32656243 [0,0,0,0,0,0|2,0,2]=4 288 B10R1.15 OC[C@@H](O)c1ccncc1 Amb28291407 [0,0,0,0,0,0|2,0,2]=4 289 B10R1.15 O[C@H](CCl)c1ccncc1 Amb27973641 [0,0,0,0,0,0|2,0,2]=4 290 B10R1.15 O\N=C(/Cl)c1ccccc1 Amb32411906 [0,0,0,0,0,0|3,0,1]=4 291 B10R1.15 O\N=C(/Cl)c1ccncc1 Amb22446639 [0,0,0,0,0,0|2,0,1]=3 292 B10R1.15 O\N=C(/Cl)c1ccncc1 Amb32729387 [0,0,0,0,0,0|2,0,1]=3 293 B10R1.15 O\N=C(\Cl)c1ccccc1 Amb2684308 [0,0,0,0,0,0|3,0,1]=4 294 B10R1.15 O\N=C(\Cl)c1ccncn1 Amb27202056 [0,0,0,0,0,0|3,0,1]=4 295 B10R1.15 O\N=C(\O)c1ccccc1 Amb17843421 [0,0,0,0,0,0|2,0,2]=4 296 B10R1.15 S=C(CBr)c1ccccc1 Amb27755078 [0,0,0,0,0,0|3,1,0]=4 297 B10R1.15 [C-]#[N+]C(C)c1ccncc1 Amb2235825 [0,0,0,0,0,0|2,0,2]=4 298 B10R1.15 [NH3+]CC(=O)c1ccccc1 Amb9787668 [0,0,0,0,0,0|2,0,1]=3 299 B9R1.6 C=C(Br)c1ccccc1 Amb8516473 [1,0,0,0,0,0|3,0,0]=4 300 B9R1.6 C=C(Br)c1ccncc1 Amb24710590 [1,0,0,0,0,0|2,0,0]=3 301 B9R1.6 C=C(C)c1ccccc1 Amb8394996 [1,0,0,0,0,0|3,0,0]=4 302 B9R1.6 C=C(C)c1ccncc1 Amb25126374 [1,0,0,0,0,0|2,0,0]=3 303 B9R1.6 C=C(Cl)c1ccccc1 Amb27775278 [1,0,0,0,0,0|3,0,0]=4 304 B9R1.6 C=C(F)c1ccccc1 Amb22738583 [1,0,0,0,0,0|3,0,0]=4 305 B9R1.6 C=C(F)c1ccncc1 Amb20248442 [1,0,0,0,0,0|2,0,0]=3 306 B9R1.6 CC(=N)c1ccnnc1 Amb28323587 [1,0,0,0,0,0|2,0,1]=4 307 B9R1.6 CC(=O)c1ccccc1 Amb2792761 [1,0,0,0,0,0|2,0,0]=3 308 B9R1.6 CC(=O)c1ccccn1 Amb932786 [1,0,0,0,0,0|3,0,0]=4 309 B9R1.6 CC(=O)c1cccnc1 Amb2610530 [1,0,0,0,0,0|3,0,0]=4 310 B9R1.6 CC(=O)c1ccncc1 Amb2792762 [1,0,0,0,0,0|1,0,0]=2 311 B9R1.6 CC(=O)c1ccncn1 Amb19959228 [1,0,0,0,0,0|2,0,0]=3 312 B9R1.6 CC(=O)c1ccnnc1 Amb19958070 [1,0,0,0,0,0|2,0,0]=3 313 B9R1.6 CC(=O)c1cnncn1 Amb18203342 [1,0,0,0,0,0|3,0,0]=4 314 B9R1.6 CC(Br)c1ccncc1 Amb10610143 [1,0,0,0,0,0|2,0,1]=4 315 B9R1.6 CC(Br)c1ccncc1 Amb9210657 [1,0,0,0,0,0|2,0,1]=4 316 B9R1.6 CC(C)c1ccncc1 Amb2694187 [1,0,0,0,0,0|2,0,1]=4 317 B9R1.6 CC(Cl)c1ccncc1 Amb19514972 [1,0,0,0,0,0|2,0,1]=4 318 B9R1.6 CC(Cl)c1ccncc1 Amb9205038 [1,0,0,0,0,0|2,0,1]=4 319 B9R1.6 CC(N)c1ccccc1 Amb5716844 [1,0,0,0,0,0|2,0,1]=4 320 B9R1.6 CC(N)c1ccncc1 Amb19958395 [1,0,0,0,0,0|1,0,1]=3 321 B9R1.6 CC(N)c1ccncc1 Amb32662788 [1,0,0,0,0,0|1,0,1]=3 322 B9R1.6 CC(N)c1ccncc1 Amb9745700 [1,0,0,0,0,0|1,0,1]=3 323 B9R1.6 CC(N)c1ccncn1 Amb10608543 [1,0,0,0,0,0|2,0,1]=4 324 B9R1.6 CC(N)c1ccncn1 Amb22587681 [1,0,0,0,0,0|2,0,1]=4 325 B9R1.6 CC(N)c1ccnnc1 Amb21964416 [1,0,0,0,0,0|2,0,1]=4 326 B9R1.6 CC(N)c1ccnnc1 Amb22757188 [1,0,0,0,0,0|2,0,1]=4 327 B9R1.6 CC(O)c1ccncc1 Amb6705768 [1,0,0,0,0,0|1,0,2]=4 328 B9R1.6 CC(S)c1ccncc1 Amb9208031 [1,0,0,0,0,0|1,1,1]=4 329 B9R1.6 CN(C)c1ccncc1 Amb2613773 [1,0,0,0,0,0|3,0,0]=4 330 B9R1.6 CN(N)c1ccccc1 Amb1153615 [1,0,0,0,0,0|3,0,0]=4 331 B9R1.6 CN(N)c1ccccc1 Amb22754142 [1,0,0,0,0,0|3,0,0]=4 332 B9R1.6 CN(N)c1ccccc1 Amb33172726 [1,0,0,0,0,0|3,0,0]=4 333 B9R1.6 CN(N)c1ccccc1 Amb9677307 [1,0,0,0,0,0|3,0,0]=4 334 B9R1.6 CN(N)c1ccncc1 Amb26494358 [1,0,0,0,0,0|2,0,0]=3 335 B9R1.6 CP(C)c1ccncc1 Amb35750173 [1,0,0,0,0,0|3,0,0]=4 336 B9R1.6 CS(=O)c1ccccc1 Amb8516154 [1,0,0,0,0,0|3,0,0]=4 337 B9R1.6 CS(=O)c1ccnnc1 Amb27239017 [1,0,0,0,0,0|3,0,0]=4 338 B9R1.6 C[C@@H](N)c1ccccc1 Amb22168000 [1,0,0,0,0,0|2,0,1]=4 339 B9R1.6 C[C@@H](N)c1ccccc1 Amb3940166 [1,0,0,0,0,0|2,0,1]=4 340 B9R1.6 C[C@@H](N)c1ccncc1 Amb13952719 [1,0,0,0,0,0|1,0,1]=3 341 B9R1.6 C[C@@H](N)c1ccncc1 Amb6893468 [1,0,0,0,0,0|1,0,1]=3 342 B9R1.6 C[C@@H](N)c1ccncn1 Amb18832953 [1,0,0,0,0,0|2,0,1]=4 343 B9R1.6 C[C@@H](O)c1ccncc1 Amb6893466 [1,0,0,0,0,0|1,0,2]=4 344 B9R1.6 C[C@H](N)c1ccccc1 Amb2725550 [1,0,0,0,0,0|2,0,1]=4 345 B9R1.6 C[C@H](N)c1ccncc1 Amb28895917 [1,0,0,0,0,0|1,0,1]=3 346 B9R1.6 C[C@H](N)c1ccncc1 Amb6893469 [1,0,0,0,0,0|1,0,1]=3 347 B9R1.6 C[C@H](N)c1ccncn1 Amb24099656 [1,0,0,0,0,0|2,0,1]=4 348 B9R1.6 C[C@H](O)c1ccncc1 Amb6893467 [1,0,0,0,0,0|1,0,2]=4 349 B9R1.6 FC(F)c1ccncc1 Amb19894457 [1,0,0,0,0,0|2,0,1]=4 350 B9R1.6 N=C(/N)c1ccncc1 Amb20243353 [1,0,0,0,0,0|1,0,0]=2 351 B9R1.6 N=C(Cl)c1ccccc1 Amb28285285 [1,0,0,0,0,0|2,0,1]=4 352 B9R1.6 N=C(N)c1cc[nH+]cc1 Amb22734887 [1,0,0,0,0,0|1,0,1]=3 353 B9R1.6 N=C(N)c1ccc[nH+]c1 Amb22166890 [1,0,0,0,0,0|3,0,0]=4 354 B9R1.6 N=C(N)c1cccc[nH+]1 Amb4004574 [1,0,0,0,0,0|3,0,0]=4 355 B9R1.6 N=C(N)c1ccccc1 Amb10068704 [1,0,0,0,0,0|2,0,0]=3 356 B9R1.6 N=C(N)c1ccccc1 Amb2371546 [1,0,0,0,0,0|2,0,0]=3 357 B9R1.6 N=C(N)c1ccccc1 Amb6337518 [1,0,0,0,0,0|2,0,0]=3 358 B9R1.6 N=C(N)c1ccccn1 Amb2696370 [1,0,0,0,0,0|3,0,0]=4 359 B9R1.6 N=C(N)c1ccccn1 Amb2725149 [1,0,0,0,0,0|3,0,0]=4 360 B9R1.6 N=C(N)c1cccnc1 Amb2695043 [1,0,0,0,0,0|3,0,0]=4 361 B9R1.6 N=C(N)c1cccnc1 Amb2782187 [1,0,0,0,0,0|3,0,0]=4 362 B9R1.6 N=C(N)c1ccncc1 Amb2695050 [1,0,0,0,0,0|1,0,0]=2 363 B9R1.6 N=C(N)c1ccncc1 Amb2724144 [1,0,0,0,0,0|1,0,0]=2 364 B9R1.6 N=C(N)c1ccncc1 Amb34916282 [1,0,0,0,0,0|1,0,0]=2 365 B9R1.6 N=C(N)c1ccncc1 Amb8630084 [1,0,0,0,0,0|1,0,0]=2 366 B9R1.6 N=C(N)c1ccncn1 Amb24099639 [1,0,0,0,0,0|2,0,0]=3 367 B9R1.6 N=C(N)c1ccncn1 Amb28934979 [1,0,0,0,0,0|2,0,0]=3 368 B9R1.6 NC(=O)C1=CC=CNC1 Amb28397885 [1,0,0,0,0,0|2,0,1]=4 369 B9R1.6 NC(=O)C1=CNC=CC1 Amb24574438 [1,0,0,0,0,0|2,0,1]=4 370 B9R1.6 NC(=O)[n+]1ccccc1 Amb27806689 [1,0,0,0,0,0|2,0,0]=3 371 B9R1.6 NC(=O)c1ccc[nH+]c1 Amb8465811 [1,0,0,0,0,0|2,0,0]=3 372 B9R1.6 NC(=O)c1ccccc1 Amb6399766 [1,0,0,0,0,0|1,0,0]=2 373 B9R1.6 NC(=O)c1ccccn1 Amb1219876 [1,0,0,0,0,0|2,0,0]=3 374 B9R1.6 NC(=O)c1cccnc1 Amb2609940 [1,0,0,0,0,0|2,0,0]=3 375 B9R1.6 NC(=O)c1cccnn1 Amb22499430 [1,0,0,0,0,0|3,0,0]=4 376 B9R1.6 NC(=O)c1ccncc1 Amb5721989 [1,0,0,0,0,0|0,0,0]=1 377 B9R1.6 NC(=O)c1ccncn1 Amb24074283 [1,0,0,0,0,0|1,0,0]=2 378 B9R1.6 NC(=O)c1ccnnc1 Amb22235791 [1,0,0,0,0,0|1,0,0]=2 379 B9R1.6 NC(=O)c1cnccn1 Amb534509 [1,0,0,0,0,0|3,0,0]=4 380 B9R1.6 NC(=O)c1cncnc1 Amb5492750 [1,0,0,0,0,0|3,0,0]=4 381 B9R1.6 NC(=O)c1ncccn1 Amb8631041 [1,0,0,0,0,0|3,0,0]=4 382 B9R1.6 NC(=O)c1ncncn1 Amb27392150 [1,0,0,0,0,0|2,0,0]=3 383 B9R1.6 NC(=S)c1ccccc1 Amb6338789 [1,0,0,0,0,0|1,1,0]=3 384 B9R1.6 NC(=S)c1ccccn1 Amb6316123 [1,0,0,0,0,0|2,1,0]=4 385 B9R1.6 NC(=S)c1cccnc1 Amb1152408 [1,0,0,0,0,0|2,1,0]=4 386 B9R1.6 NC(=S)c1ccncc1 Amb1397718 [1,0,0,0,0,0|0,1,0]=2 387 B9R1.6 NC(=S)c1ccncn1 Amb21933379 [1,0,0,0,0,0|1,1,0]=3 388 B9R1.6 NC(=S)c1ccnnc1 Amb25730862 [1,0,0,0,0,0|1,1,0]=3 389 B9R1.6 NC(=[NH2+])c1ccccn1 Amb16233715 [1,0,0,0,0,0|3,0,0]=4 390 B9R1.6 NC(F)c1ccncc1 Amb27844854 [1,0,0,0,0,0|1,0,1]=3 391 B9R1.6 NC(N)c1ccccc1 Amb28069502 [1,0,0,0,0,0|2,0,1]=4 392 B9R1.6 NC(N)c1ccncc1 Amb24079161 [1,0,0,0,0,0|1,0,1]=3 393 B9R1.6 NS(=O)c1ccccc1 Amb26487323 [1,0,0,0,0,0|2,0,0]=3 394 B9R1.6 O=C(Br)c1ccccc1 Amb8513573 [1,0,0,0,0,0|2,0,0]=3 395 B9R1.6 O=C(Cl)c1cc[nH+]cc1 Amb21952993 [1,0,0,0,0,0|1,0,1]=3 396 B9R1.6 O=C(Cl)c1ccccc1 Amb3939302 [1,0,0,0,0,0|2,0,0]=3 397 B9R1.6 O=C(Cl)c1ccccn1 Amb22492448 [1,0,0,0,0,0|3,0,0]=4 398 B9R1.6 O=C(Cl)c1ccccn1 Amb2690341 [1,0,0,0,0,0|3,0,0]=4 399 B9R1.6 O=C(Cl)c1ccccn1 Amb3939534 [1,0,0,0,0,0|3,0,0]=4 400 B9R1.6 O=C(Cl)c1cccnc1 Amb33531191 [1,0,0,0,0,0|3,0,0]=4 401 B9R1.6 O=C(Cl)c1cccnc1 Amb839669 [1,0,0,0,0,0|3,0,0]=4 402 B9R1.6 O=C(Cl)c1ccncc1 Amb2707217 [1,0,0,0,0,0|1,0,0]=2 403 B9R1.6 O=C(Cl)c1ccncc1 Amb2720189 [1,0,0,0,0,0|1,0,0]=2 404 B9R1.6 O=C(F)c1ccccc1 Amb10607152 [1,0,0,0,0,0|2,0,0]=3 405 B9R1.6 O=C(O)C1=CCOC=C1 Amb27860440 [1,0,0,0,0,0|2,0,1]=4 406 B9R1.6 O=C(O)C1C=CCC=C1 Amb17593268 [1,0,0,0,0,0|2,0,1]=4 407 B9R1.6 O=C(O)c1ccccc1 Amb1935196 [1,0,0,0,0,0|2,0,0]=3 408 B9R1.6 O=C(O)c1ccccc1 Amb22002523 [1,0,0,0,0,0|2,0,0]=3 409 B9R1.6 O=C(O)c1ccccc1 Amb22336602 [1,0,0,0,0,0|2,0,0]=3 410 B9R1.6 O=C(O)c1ccccc1 Amb22351742 [1,0,0,0,0,0|2,0,0]=3 411 B9R1.6 O=C(O)c1ccccn1 Amb1227737 [1,0,0,0,0,0|3,0,0]=4 412 B9R1.6 O=C(O)c1ccccn1 Amb4035065 [1,0,0,0,0,0|3,0,0]=4 413 B9R1.6 O=C(O)c1cccnc1 Amb1195995 [1,0,0,0,0,0|3,0,0]=4 414 B9R1.6 O=C(O)c1ccncc1 Amb2609990 [1,0,0,0,0,0|1,0,0]=2 415 B9R1.6 O=C(O)c1ccncn1 Amb1102414 [1,0,0,0,0,0|2,0,0]=3 416 B9R1.6 O=C(O)c1ccnnc1 Amb2691390 [1,0,0,0,0,0|2,0,0]=3 417 B9R1.6 O=C(O)c1cnncn1 Amb26419787 [1,0,0,0,0,0|3,0,0]=4 418 B9R1.6 O=C(O)c1ncncn1 Amb27760009 [1,0,0,0,0,0|3,0,0]=4 419 B9R1.6 O=C(S)c1ccccc1 Amb8513358 [1,0,0,0,0,0|2,0,0]=3 420 B9R1.6 O=C([O-])c1ccccc1 Amb22053472 [1,0,0,0,0,0|2,0,0]=3 421 B9R1.6 O=C([O-])c1ccccc1 Amb22168438 [1,0,0,0,0,0|2,0,0]=3 422 B9R1.6 O=C([O-])c1ccccc1 Amb8387740 [1,0,0,0,0,0|2,0,0]=3 423 B9R1.6 O=C([O-])c1ccccc1 Amb8513916 [1,0,0,0,0,0|2,0,0]=3 424 B9R1.6 O=C([O-])c1ccccc1 Amb8517378 [1,0,0,0,0,0|2,0,0]=3 425 B9R1.6 O=C([O-])c1ccccn1 Amb22058087 [1,0,0,0,0,0|3,0,0]=4 426 B9R1.6 O=C([O-])c1ccccn1 Amb22734923 [1,0,0,0,0,0|3,0,0]=4 427 B9R1.6 O=C([O-])c1ccccn1 Amb8393579 [1,0,0,0,0,0|3,0,0]=4 428 B9R1.6 O=C([O-])c1ccccn1 Amb8393582 [1,0,0,0,0,0|3,0,0]=4 429 B9R1.6 O=C([O-])c1ccncc1 Amb22730239 [1,0,0,0,0,0|1,0,0]=2 430 B9R1.6 O=I(=O)c1ccccc1 Amb9679129 [1,0,0,0,0,0|3,0,0]=4 431 B9R1.6 O=N(=O)c1ccncc1 Amb20621911 [1,0,0,0,0,0|2,0,0]=3 432 B9R1.6 O=S(Cl)c1ccccc1 Amb13881360 [1,0,0,0,0,0|3,0,0]=4 433 B9R1.6 O=S(O)c1ccccc1 Amb17939345 [1,0,0,0,0,0|3,0,0]=4 434 B9R1.6 O=S([O-])c1ccccc1 Amb2684569 [1,0,0,0,0,0|3,0,0]=4 435 B9R1.6 O=S([O-])c1ccccc1 Amb28536248 [1,0,0,0,0,0|3,0,0]=4 436 B9R1.6 O=S([O-])c1ccncc1 Amb30982202 [1,0,0,0,0,0|2,0,0]=3 437 B9R1.6 O=[N+]([O-])c1ccccc1 Amb2793077 [1,0,0,0,0,0|3,0,0]=4 438 B9R1.6 O=[N+]([O-])c1ccncc1 Amb2610532 [1,0,0,0,0,0|2,0,0]=3 439 B9R1.6 O=[PH](O)c1ccccc1 Amb3371978 [1,0,0,0,0,0|3,0,0]=4 440 B9R1.6 O=[Se](O)c1ccccc1 Amb4138617 [1,0,0,0,0,0|3,0,0]=4 441 B9R1.6 OB(O)c1ccncc1 Amb13887063 [1,0,0,0,0,0|2,0,1]=4 442 B9R1.6 OB(O)c1ccncc1 Amb2383497 [1,0,0,0,0,0|2,0,1]=4 443 B9R1.6 OB(O)c1ccncc1 Amb2690422 [1,0,0,0,0,0|2,0,1]=4 444 B9R1.6 OC(=S)c1ccccc1 Amb17942862 [1,0,0,0,0,0|2,0,1]=4 445 B9R1.6 ON(O)c1ccncc1 Amb24572621 [1,0,0,0,0,0|2,0,1]=4 446 B9R1.6 S=C(Cl)c1ccccc1 Amb25294215 [1,0,0,0,0,0|2,1,0]=4 447 B9R1.6 S=C(S)c1ccccc1 Amb22051683 [1,0,0,0,0,0|2,1,0]=4 448 B9R1.8 BrCCc1ccncc1 Amb18326675 [1,0,0,0,0,0|2,0,1]=4 449 B9R1.8 BrCCc1ccncc1 Amb33313562 [1,0,0,0,0,0|2,0,1]=4 450 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [1,0,0,0,0,0|3,0,0]=4 451 B9R1.8 Br\C=C\c1ccccc1 Amb3940204 [1,0,0,0,0,0|3,0,0]=4 452 B9R1.8 Br\C=C\c1ccncc1 Amb27756767 [1,0,0,0,0,0|2,0,0]=3 453 B9R1.8 C#CCc1ccncc1 Amb24478677 [1,0,0,0,0,0|2,0,1]=4 454 B9R1.8 C#NCc1ccncc1 Amb31132455 [1,0,0,0,0,0|1,0,2]=4 455 B9R1.8 C=NCc1ccncc1 Amb27758185 [1,0,0,0,0,0|1,0,2]=4 456 B9R1.8 CCCc1ccncc1 Amb4017941 [1,0,0,0,0,0|2,0,1]=4 457 B9R1.8 CCNc1ccncc1 Amb33545749 [1,0,0,0,0,0|3,0,0]=4 458 B9R1.8 CCOc1ccncc1 Amb8396897 [1,0,0,0,0,0|3,0,0]=4 459 B9R1.8 CCSc1ccncc1 Amb27766422 [1,0,0,0,0,0|3,0,0]=4 460 B9R1.8 CNCc1ccccc1 Amb3699562 [1,0,0,0,0,0|2,0,1]=4 461 B9R1.8 CNCc1ccncc1 Amb10068773 [1,0,0,0,0,0|1,0,1]=3 462 B9R1.8 CNCc1ccncc1 Amb1115812 [1,0,0,0,0,0|1,0,1]=3 463 B9R1.8 CNCc1ccncn1 Amb21962059 [1,0,0,0,0,0|2,0,1]=4 464 B9R1.8 CNCc1ccncn1 Amb22587684 [1,0,0,0,0,0|2,0,1]=4 465 B9R1.8 CNCc1ccncn1 Amb3941356 [1,0,0,0,0,0|2,0,1]=4 466 B9R1.8 CNCc1ccnnc1 Amb24183593 [1,0,0,0,0,0|2,0,1]=4 467 B9R1.8 CNCc1ccnnc1 Amb27784160 [1,0,0,0,0,0|2,0,1]=4 468 B9R1.8 CNNc1ccccc1 Amb20242875 [1,0,0,0,0,0|3,0,0]=4 469 B9R1.8 CNNc1ccccc1 Amb27969267 [1,0,0,0,0,0|3,0,0]=4 470 B9R1.8 C\C=C/c1ccccc1 Amb2690400 [1,0,0,0,0,0|3,0,0]=4 471 B9R1.8 C\C=C\c1ccccc1 Amb6366726 [1,0,0,0,0,0|3,0,0]=4 472 B9R1.8 C\N=C\c1ccccc1 Amb8513063 [1,0,0,0,0,0|2,0,1]=4 473 B9R1.8 C\N=C\c1ccncc1 Amb22330508 [1,0,0,0,0,0|1,0,1]=3 474 B9R1.8 ClCCc1ccncc1 Amb23400891 [1,0,0,0,0,0|2,0,1]=4 475 B9R1.8 ClCCc1ccncc1 Amb9004339 [1,0,0,0,0,0|2,0,1]=4 476 B9R1.8 ClCSc1ccncc1 Amb27185726 [1,0,0,0,0,0|3,0,0]=4 477 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [1,0,0,0,0,0|3,0,0]=4 478 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [1,0,0,0,0,0|3,0,0]=4 479 B9R1.8 ICCc1ccncc1 Amb28383331 [1,0,0,0,0,0|2,0,1]=4 480 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [1,0,0,0,0,0|3,0,0]=4 481 B9R1.8 N#CCc1ccncc1 Amb6661799 [1,0,0,0,0,0|1,0,2]=4 482 B9R1.8 N#CCc1ccncc1 Amb8516296 [1,0,0,0,0,0|1,0,2]=4 483 B9R1.8 N#CNc1ccncc1 Amb25319718 [1,0,0,0,0,0|2,0,1]=4 484 B9R1.8 NCCc1ccccc1 Amb17843439 [1,0,0,0,0,0|2,0,1]=4 485 B9R1.8 NCCc1ccccc1 Amb2792829 [1,0,0,0,0,0|2,0,1]=4 486 B9R1.8 NCCc1ccncc1 Amb1102164 [1,0,0,0,0,0|1,0,1]=3 487 B9R1.8 NCCc1ccncc1 Amb8631358 [1,0,0,0,0,0|1,0,1]=3 488 B9R1.8 NCCc1ccncn1 Amb22899210 [1,0,0,0,0,0|2,0,1]=4 489 B9R1.8 NCCc1ccncn1 Amb8009432 [1,0,0,0,0,0|2,0,1]=4 490 B9R1.8 NCCc1ccnnc1 Amb31217486 [1,0,0,0,0,0|2,0,1]=4 491 B9R1.8 NCCc1ccnnc1 Amb8009433 [1,0,0,0,0,0|2,0,1]=4 492 B9R1.8 NCNc1ccccc1 Amb17117015 [1,0,0,0,0,0|3,0,0]=4 493 B9R1.8 NCOc1ccccc1 Amb25128781 [1,0,0,0,0,0|3,0,0]=4 494 B9R1.8 NNCc1ccccc1 Amb1105200 [1,0,0,0,0,0|1,0,1]=3 495 B9R1.8 NNCc1ccccc1 Amb16231890 [1,0,0,0,0,0|1,0,1]=3 496 B9R1.8 NNCc1ccccc1 Amb22492438 [1,0,0,0,0,0|1,0,1]=3 497 B9R1.8 NNCc1ccccc1 Amb8513062 [1,0,0,0,0,0|1,0,1]=3 498 B9R1.8 NNCc1ccccc1 Amb9826089 [1,0,0,0,0,0|1,0,1]=3 499 B9R1.8 NNCc1ccccn1 Amb1117330 [1,0,0,0,0,0|2,0,1]=4 500 B9R1.8 NNCc1ccccn1 Amb28984160 [1,0,0,0,0,0|2,0,1]=4 501 B9R1.8 NNCc1ccccn1 Amb6892424 [1,0,0,0,0,0|2,0,1]=4 502 B9R1.8 NNCc1cccnc1 Amb1121062 [1,0,0,0,0,0|2,0,1]=4 503 B9R1.8 NNCc1cccnc1 Amb22491471 [1,0,0,0,0,0|2,0,1]=4 504 B9R1.8 NNCc1cccnc1 Amb33551495 [1,0,0,0,0,0|2,0,1]=4 505 B9R1.8 NNCc1ccncc1 Amb1118337 [1,0,0,0,0,0|0,0,1]=2 506 B9R1.8 NNCc1ccncc1 Amb19893255 [1,0,0,0,0,0|0,0,1]=2 507 B9R1.8 NNCc1ccncc1 Amb2691315 [1,0,0,0,0,0|0,0,1]=2 508 B9R1.8 NNCc1ccncc1 Amb28984138 [1,0,0,0,0,0|0,0,1]=2 509 B9R1.8 NNCc1ccncn1 Amb23586399 [1,0,0,0,0,0|1,0,1]=3 510 B9R1.8 NNCc1ccnnc1 Amb23586392 [1,0,0,0,0,0|1,0,1]=3 511 B9R1.8 NOCc1ccccc1 Amb1154307 [1,0,0,0,0,0|2,0,1]=4 512 B9R1.8 NOCc1ccccc1 Amb22489499 [1,0,0,0,0,0|2,0,1]=4 513 B9R1.8 NOCc1ccccc1 Amb6600539 [1,0,0,0,0,0|2,0,1]=4 514 B9R1.8 NOCc1ccncc1 Amb22397036 [1,0,0,0,0,0|1,0,1]=3 515 B9R1.8 NOCc1ccncn1 Amb26557423 [1,0,0,0,0,0|2,0,1]=4 516 B9R1.8 N\C=C/c1ccccn1 Amb27443779 [1,0,0,0,0,0|3,0,0]=4 517 B9R1.8 N\C=C/c1cccnc1 Amb28137814 [1,0,0,0,0,0|3,0,0]=4 518 B9R1.8 N\C=C/c1ccncc1 Amb24068867 [1,0,0,0,0,0|1,0,0]=2 519 B9R1.8 N\C=C\c1cccnc1 Amb27776892 [1,0,0,0,0,0|3,0,0]=4 520 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [1,0,0,0,0,0|3,0,0]=4 521 B9R1.8 N\C=P\c1ccccc1 Amb27643938 [1,0,0,0,0,0|3,0,0]=4 522 B9R1.8 N\N=C/c1ccncn1 Amb27478364 [1,0,0,0,0,0|1,0,1]=3 523 B9R1.8 N\N=C\c1ccccc1 Amb31284503 [1,0,0,0,0,0|1,0,1]=3 524 B9R1.8 N\N=C\c1cccnc1 Amb8485037 [1,0,0,0,0,0|2,0,1]=4 525 B9R1.8 N\N=C\c1ccncc1 Amb27837636 [1,0,0,0,0,0|0,0,1]=2 526 B9R1.8 O=C=Nc1ccncc1 Amb9780817 [1,0,0,0,0,0|3,0,0]=4 527 B9R1.8 O=CCc1ccncc1 Amb17089529 [1,0,0,0,0,0|2,0,1]=4 528 B9R1.8 OCCc1ccncc1 Amb3939219 [1,0,0,0,0,0|2,0,1]=4 529 B9R1.8 ONCc1ccccc1 Amb22001943 [1,0,0,0,0,0|2,0,1]=4 530 B9R1.8 ONCc1ccccc1 Amb9825936 [1,0,0,0,0,0|2,0,1]=4 531 B9R1.8 ONCc1ccncc1 Amb25851052 [1,0,0,0,0,0|1,0,1]=3 532 B9R1.8 ONCc1ccncn1 Amb23586394 [1,0,0,0,0,0|2,0,1]=4 533 B9R1.8 O\N=C/c1ccccc1 Amb6298335 [1,0,0,0,0,0|2,0,1]=4 534 B9R1.8 O\N=C/c1ccncc1 Amb9821776 [1,0,0,0,0,0|1,0,1]=3 535 B9R1.8 O\N=C/c1ccnnc1 Amb8439020 [1,0,0,0,0,0|2,0,1]=4 536 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [1,0,0,0,0,0|2,0,1]=4 537 B9R1.8 O\N=C\c1ccncc1 Amb1793802 [1,0,0,0,0,0|1,0,1]=3 538 B9R1.8 O\N=C\c1ccncn1 Amb20668794 [1,0,0,0,0,0|2,0,1]=4 539 B9R1.8 O\N=C\c1ccnnc1 Amb23539003 [1,0,0,0,0,0|2,0,1]=4 540 B9R1.8 S=C=Nc1ccncc1 Amb2371966 [1,0,0,0,0,0|3,0,0]=4 541 B9R1.8 SCCc1ccncc1 Amb10552830 [1,0,0,0,0,0|2,0,1]=4 542 B9R1.8 SCCc1ccncc1 Amb9800962 [1,0,0,0,0,0|2,0,1]=4 543 B9R1.8 [C-]#[N+]Cc1ccncc1 Amb1981059 [1,0,0,0,0,0|1,0,2]=4 544 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [1,0,0,0,0,0|1,0,2]=4 545 B9R1.8 [N-]=[N+]=Nc1ccncc1 Amb33547216 [1,0,0,0,0,0|1,0,2]=4 546 B11R1.7 C=CS(=O)(=O)c1ccncc1 Amb9305562 [0,1,0,0,0,0|3,0,0]=4 547 B11R1.7 CC(C)(CN)c1ccncc1 Amb17748503 [0,1,0,0,0,0|2,0,1]=4 548 B11R1.7 CC(C)(NN)c1ccccc1 Amb18644446 [0,1,0,0,0,0|2,0,1]=4 549 B11R1.7 CC(C)(ON)c1ccncc1 Amb33380655 [0,1,0,0,0,0|2,0,1]=4 550 B11R1.7 CC(N)(CN)c1ccncc1 Amb23538716 [0,1,0,0,0,0|2,0,1]=4 551 B11R1.7 CC(O)(CN)c1ccncc1 Amb18562952 [0,1,0,0,0,0|1,0,2]=4 552 B11R1.7 CCS(=N)(=O)c1ccncc1 Amb32667795 [0,1,0,0,0,0|3,0,0]=4 553 B11R1.7 CN=S(C)(=O)c1ccncc1 Amb32667797 [0,1,0,0,0,0|2,0,1]=4 554 B11R1.7 CNC(C)(C)c1ccncc1 Amb31176233 [0,1,0,0,0,0|2,0,1]=4 555 B11R1.7 CNP(=O)(O)c1ccccc1 Amb28343794 [0,1,0,0,0,0|3,0,0]=4 556 B11R1.7 CNS(=O)(=O)c1ccccc1 Amb1152097 [0,1,0,0,0,0|3,0,0]=4 557 B11R1.7 CNS(=O)(=O)c1ccncc1 Amb26030725 [0,1,0,0,0,0|2,0,0]=3 558 B11R1.7 NCC(F)(F)c1ccncc1 Amb25194771 [0,1,0,0,0,0|2,0,1]=4 559 B11R1.7 NCP(=O)(O)c1ccccc1 Amb27823125 [0,1,0,0,0,0|3,0,0]=4 560 B11R1.7 NNS(=O)(=O)c1ccccc1 Amb6468409 [0,1,0,0,0,0|2,0,0]=3 561 B11R1.7 NNS(=O)(=O)c1ccccn1 Amb26639288 [0,1,0,0,0,0|3,0,0]=4 562 B11R1.7 NNS(=O)(=O)c1ccncc1 Amb25135173 [0,1,0,0,0,0|1,0,0]=2 563 B11R1.7 O=S(=O)(NCl)c1ccccc1 Amb32653532 [0,1,0,0,0,0|3,0,0]=4 564 B11R1.7 O=S(=O)(NF)c1ccccc1 Amb22729706 [0,1,0,0,0,0|3,0,0]=4 565 B11R1.7 O=S(=O)(NO)c1ccccc1 Amb1154834 [0,1,0,0,0,0|3,0,0]=4 566 B11R1.7 O=S(=O)(NO)c1ccncc1 Amb26639473 [0,1,0,0,0,0|2,0,0]=3 567 B11R1.12 C#CC(NN)c1ccncc1 Amb27656560 [0,1,0,0,0,0|1,0,1]=3 568 B11R1.12 CCC(C=O)c1ccncc1 Amb27198828 [0,1,0,0,0,0|2,0,1]=4 569 B11R1.12 CCC(CN)c1ccncc1 Amb26373299 [0,1,0,0,0,0|2,0,1]=4 570 B11R1.12 CCC(NC)c1ccncc1 Amb18301849 [0,1,0,0,0,0|2,0,1]=4 571 B11R1.12 CCC(NN)c1ccccc1 Amb6245428 [0,1,0,0,0,0|2,0,1]=4 572 B11R1.12 CCC(NN)c1ccncn1 Amb27599725 [0,1,0,0,0,0|2,0,1]=4 573 B11R1.12 CNC(C#N)c1ccncc1 Amb17043489 [0,1,0,0,0,0|2,0,1]=4 574 B11R1.12 CNC(CF)c1ccncc1 Amb28135718 [0,1,0,0,0,0|2,0,1]=4 575 B11R1.12 CNC(CN)c1ccncc1 Amb18065359 [0,1,0,0,0,0|2,0,1]=4 576 B11R1.12 CNC(CO)c1ccncc1 Amb18065364 [0,1,0,0,0,0|1,0,2]=4 577 B11R1.12 CN\C(=N\N)c1ccncc1 Amb18177155 [0,1,0,0,0,0|1,0,1]=3 578 B11R1.12 CN\C(=N\N)c1ccnnc1 Amb28388861 [0,1,0,0,0,0|2,0,1]=4 579 B11R1.12 CN\C(=N\O)c1ccncc1 Amb27945463 [0,1,0,0,0,0|1,0,1]=3 580 B11R1.12 COC(C=O)c1ccncc1 Amb28368633 [0,1,0,0,0,0|2,0,1]=4 581 B11R1.12 C\C=C(/C=O)c1ccncc1 Amb24418258 [0,1,0,0,0,0|2,0,0]=3 582 B11R1.12 C\N=C(/NC)c1ccccc1 Amb8487310 [0,1,0,0,0,0|3,0,0]=4 583 B11R1.12 C\N=C(\NC)c1ccnnc1 Amb27244972 [0,1,0,0,0,0|3,0,0]=4 584 B11R1.12 N#CC(NN)c1ccccc1 Amb17399905 [0,1,0,0,0,0|2,0,1]=4 585 B11R1.12 N#CC(NN)c1ccncc1 Amb17399909 [0,1,0,0,0,0|1,0,1]=3 586 B11R1.12 N#C\C(=C/N)c1ccccc1 Amb24403322 [0,1,0,0,0,0|3,0,0]=4 587 B11R1.12 N#C\C(=C\N)c1ccncc1 Amb27795103 [0,1,0,0,0,0|2,0,0]=3 588 B11R1.12 NCC(C=O)c1ccccc1 Amb28282628 [0,1,0,0,0,0|2,0,1]=4 589 B11R1.12 NCC(CN)c1ccncc1 Amb18065358 [0,1,0,0,0,0|2,0,1]=4 590 B11R1.12 NCC(CO)c1ccncc1 Amb25990872 [0,1,0,0,0,0|1,0,2]=4 591 B11R1.12 NC\C(=C/Cl)c1ccccc1 Amb34005133 [0,1,0,0,0,0|3,0,0]=4 592 B11R1.12 NC\C(=C\Br)c1ccccc1 Amb28319127 [0,1,0,0,0,0|3,0,0]=4 593 B11R1.12 NC\C(=N\O)c1ccccc1 Amb25368564 [0,1,0,0,0,0|2,0,1]=4 594 B11R1.12 NNC(CO)c1ccccc1 Amb27252003 [0,1,0,0,0,0|1,0,2]=4 595 B11R1.12 NNC(CO)c1ccccc1 Amb33422027 [0,1,0,0,0,0|1,0,2]=4 596 B11R1.12 NN\C(=N/O)c1ccccc1 Amb4008710 [0,1,0,0,0,0|1,0,1]=3 597 B11R1.12 N\N=C(\NN)c1ccccc1 Amb27949046 [0,1,0,0,0,0|2,0,0]=3 598 B11R1.12 O=C=C(C=O)c1ccccc1 Amb27643622 [0,1,0,0,0,0|3,0,0]=4 599 B11R1.12 O=CC(C=O)c1ccncc1 Amb2503949 [0,1,0,0,0,0|2,0,1]=4 600 B11R1.12 O=C\C(=C/O)c1ccccc1 Amb10576572 [0,1,0,0,0,0|3,0,0]=4 601 B11R1.12 O=C\C(=C/O)c1ccncc1 Amb1101998 [0,1,0,0,0,0|2,0,0]=3 602 B11R1.12 O=C\C(=C/O)c1ccncn1 Amb2717751 [0,1,0,0,0,0|3,0,0]=4 603 B11R1.12 O=C\C(=C\Br)c1ccccc1 Amb24634608 [0,1,0,0,0,0|3,0,0]=4 604 B11R1.12 O=C\C(=C\Cl)c1ccccc1 Amb17594154 [0,1,0,0,0,0|3,0,0]=4 605 B11R1.12 O=C\C(=C\O)c1ccccc1 Amb25092916 [0,1,0,0,0,0|3,0,0]=4 606 B11R1.12 O=C\C(=C\O)c1ccncc1 Amb1019561 [0,1,0,0,0,0|2,0,0]=3 607 B11R1.12 O=C\C(=C\S)c1ccccc1 Amb27622186 [0,1,0,0,0,0|3,0,0]=4 608 B11R1.12 O=C\C(=N/O)c1ccccc1 Amb28345218 [0,1,0,0,0,0|2,0,1]=4 609 B11R1.12 O=C\C(=N\O)c1ccccc1 Amb26580467 [0,1,0,0,0,0|2,0,1]=4 610 B11R1.12 O\N=C(\NO)c1ccccc1 Amb27751854 [0,1,0,0,0,0|2,0,1]=4 611 B11R1.16 C#CCC(=O)c1ccccc1 Amb27794052 [0,1,0,0,0,0|3,0,0]=4 612 B11R1.16 C#COC(=O)c1ccccc1 Amb25084221 [0,1,0,0,0,0|3,0,0]=4 613 B11R1.16 C=C(CCN)c1ccccc1 Amb32953172 [0,1,0,0,0,0|3,0,0]=4 614 B11R1.16 C=C(CCN)c1ccncc1 Amb33380624 [0,1,0,0,0,0|2,0,0]=3 615 B11R1.16 C=C(CCN)c1ccncn1 Amb33267945 [0,1,0,0,0,0|3,0,0]=4 616 B11R1.16 C=C(CNN)c1ccccc1 Amb27956116 [0,1,0,0,0,0|2,0,0]=3 617 B11R1.16 C=C(NC=O)c1ccccc1 Amb28046518 [0,1,0,0,0,0|3,0,0]=4 618 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [0,1,0,0,0,0|3,0,0]=4 619 B11R1.16 C=CCC(=O)c1ccncc1 Amb17334269 [0,1,0,0,0,0|2,0,0]=3 620 B11R1.16 C=CNC(=O)c1ccncc1 Amb27170598 [0,1,0,0,0,0|1,0,0]=2 621 B11R1.16 C=COC(=O)c1ccccc1 Amb10807409 [0,1,0,0,0,0|3,0,0]=4 622 B11R1.16 C=NNC(=O)c1ccncc1 Amb4034434 [0,1,0,0,0,0|0,0,1]=2 623 B11R1.16 CC#CC(=O)c1ccccc1 Amb17593622 [0,1,0,0,0,0|3,0,0]=4 624 B11R1.16 CC(CCN)c1ccncc1 Amb18293553 [0,1,0,0,0,0|2,0,1]=4 625 B11R1.16 CC(CCN)c1ccncc1 Amb32652118 [0,1,0,0,0,0|2,0,1]=4 626 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [0,1,0,0,0,0|2,0,1]=4 627 B11R1.16 CC(CON)c1ccncc1 Amb33380656 [0,1,0,0,0,0|2,0,1]=4 628 B11R1.16 CC(NC=O)c1ccncc1 Amb10070155 [0,1,0,0,0,0|2,0,1]=4 629 B11R1.16 CCCC(=O)c1ccccc1 Amb4605997 [0,1,0,0,0,0|3,0,0]=4 630 B11R1.16 CCCC(=O)c1ccncc1 Amb22235246 [0,1,0,0,0,0|2,0,0]=3 631 B11R1.16 CCCC(=O)c1ccncn1 Amb26417226 [0,1,0,0,0,0|3,0,0]=4 632 B11R1.16 CCNC(=O)c1ccccc1 Amb6871002 [0,1,0,0,0,0|2,0,0]=3 633 B11R1.16 CCNC(=O)c1ccccn1 Amb8439146 [0,1,0,0,0,0|3,0,0]=4 634 B11R1.16 CCNC(=O)c1ccnnc1 Amb27823464 [0,1,0,0,0,0|2,0,0]=3 635 B11R1.16 CCNC(=S)c1ccccc1 Amb27848073 [0,1,0,0,0,0|2,1,0]=4 636 B11R1.16 CCNC(C)c1ccncc1 Amb33548282 [0,1,0,0,0,0|2,0,1]=4 637 B11R1.16 CCNC(C)c1ccncc1 Amb6272006 [0,1,0,0,0,0|2,0,1]=4 638 B11R1.16 CCNS(=O)c1ccccc1 Amb27261568 [0,1,0,0,0,0|3,0,0]=4 639 B11R1.16 CCOC(=N)c1ccncc1 Amb18179378 [0,1,0,0,0,0|3,0,0]=4 640 B11R1.16 CCOC(=O)c1ccccc1 Amb4302705 [0,1,0,0,0,0|3,0,0]=4 641 B11R1.16 CCOC(=O)c1ccncc1 Amb1210124 [0,1,0,0,0,0|2,0,0]=3 642 B11R1.16 CCOC(=O)c1ccncc1 Amb33140921 [0,1,0,0,0,0|2,0,0]=3 643 B11R1.16 CCOC(=O)c1ccncn1 Amb8383933 [0,1,0,0,0,0|3,0,0]=4 644 B11R1.16 CCOC(=O)c1ccnnc1 Amb8383938 [0,1,0,0,0,0|3,0,0]=4 645 B11R1.16 CCSC(=O)c1ccccc1 Amb27828652 [0,1,0,0,0,0|3,0,0]=4 646 B11R1.16 CNCC(=O)c1ccccc1 Amb577810 [0,1,0,0,0,0|2,0,0]=3 647 B11R1.16 CNCC(=O)c1ccccn1 Amb31094252 [0,1,0,0,0,0|3,0,0]=4 648 B11R1.16 CNCC(=O)c1cccnc1 Amb27146952 [0,1,0,0,0,0|3,0,0]=4 649 B11R1.16 CNCC(=O)c1ccncc1 Amb31094250 [0,1,0,0,0,0|1,0,0]=2 650 B11R1.16 CNCC(=O)c1ccncn1 Amb33269066 [0,1,0,0,0,0|2,0,0]=3 651 B11R1.16 CNCC(C)c1ccncc1 Amb27199701 [0,1,0,0,0,0|2,0,1]=4 652 B11R1.16 CNCC(O)c1ccncc1 Amb17138442 [0,1,0,0,0,0|1,0,2]=4 653 B11R1.16 CNNC(=N)c1cccnc1 Amb25690466 [0,1,0,0,0,0|3,0,0]=4 654 B11R1.16 CNNC(=O)c1ccncc1 Amb28434923 [0,1,0,0,0,0|0,0,0]=1 655 B11R1.16 CNNC(=O)c1ncccn1 Amb22749170 [0,1,0,0,0,0|3,0,0]=4 656 B11R1.16 CNOC(=O)c1ccccc1 Amb25240574 [0,1,0,0,0,0|2,0,0]=3 657 B11R1.16 CN\C=C(\C)c1ccccc1 Amb27468700 [0,1,0,0,0,0|3,0,0]=4 658 B11R1.16 CN\N=C(/N)c1ccccc1 Amb20623020 [0,1,0,0,0,0|2,0,1]=4 659 B11R1.16 CN\N=C(\C)c1ccncc1 Amb25129259 [0,1,0,0,0,0|1,0,1]=3 660 B11R1.16 COCC(=O)c1ccccc1 Amb4605981 [0,1,0,0,0,0|3,0,0]=4 661 B11R1.16 CONC(=O)c1ccccc1 Amb16969913 [0,1,0,0,0,0|2,0,0]=3 662 B11R1.16 CO\N=C(/N)c1ccncc1 Amb18224286 [0,1,0,0,0,0|2,0,1]=4 663 B11R1.16 CSCC(=O)c1ccccc1 Amb4034487 [0,1,0,0,0,0|3,0,0]=4 664 B11R1.16 C[C@@H](NC#N)c1ccncc1 Amb28185266 [0,1,0,0,0,0|1,0,2]=4 665 B11R1.16 C\C(=C/CN)c1ccccc1 Amb23555622 [0,1,0,0,0,0|3,0,0]=4 666 B11R1.16 C\C(=C/CN)c1ccncc1 Amb31099544 [0,1,0,0,0,0|2,0,0]=3 667 B11R1.16 C\C(=C\C=O)c1ccncc1 Amb27855013 [0,1,0,0,0,0|3,0,0]=4 668 B11R1.16 C\C(=C\CN)c1ccncn1 Amb28066895 [0,1,0,0,0,0|3,0,0]=4 669 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [0,1,0,0,0,0|3,0,0]=4 670 B11R1.16 N#CCC(=O)c1ccccc1 Amb1644485 [0,1,0,0,0,0|2,0,1]=4 671 B11R1.16 N#CCC(=O)c1ccncc1 Amb8832803 [0,1,0,0,0,0|1,0,1]=3 672 B11R1.16 N#CNC(=N)c1ccccc1 Amb20527583 [0,1,0,0,0,0|2,0,1]=4 673 B11R1.16 N#CNC(=O)c1ccccc1 Amb4007087 [0,1,0,0,0,0|1,0,1]=3 674 B11R1.16 N#CNC(=O)c1ccccn1 Amb28067311 [0,1,0,0,0,0|2,0,1]=4 675 B11R1.16 N#CNC(=O)c1ccnnc1 Amb28250575 [0,1,0,0,0,0|1,0,1]=3 676 B11R1.16 N#C\C=C(/[O-])c1ccncc1 Amb21837603 [0,1,0,0,0,0|1,0,2]=4 677 B11R1.16 N#C\C=C(\Cl)c1ccncc1 Amb27882192 [0,1,0,0,0,0|2,0,1]=4 678 B11R1.16 N#C\C=C(\N)c1ccncc1 Amb28429809 [0,1,0,0,0,0|2,0,1]=4 679 B11R1.16 N#C\N=C(/N)c1ccncc1 Amb10070758 [0,1,0,0,0,0|1,0,2]=4 680 B11R1.16 N#C\N=C(\N)c1ccncc1 Amb9677864 [0,1,0,0,0,0|1,0,2]=4 681 B11R1.16 N=C=NC(=O)c1ccccc1 Amb28127436 [0,1,0,0,0,0|1,0,2]=4 682 B11R1.16 N=CNC(=O)c1ccccc1 Amb27961481 [0,1,0,0,0,0|1,0,1]=3 683 B11R1.16 NCCC(=O)c1ccccc1 Amb2613669 [0,1,0,0,0,0|2,0,0]=3 684 B11R1.16 NCCC(=O)c1ccccn1 Amb18121375 [0,1,0,0,0,0|3,0,0]=4 685 B11R1.16 NCCC(=O)c1cccnc1 Amb18121496 [0,1,0,0,0,0|3,0,0]=4 686 B11R1.16 NCCC(=O)c1ccncc1 Amb18639595 [0,1,0,0,0,0|1,0,0]=2 687 B11R1.16 NCCC(=O)c1ccncn1 Amb33269069 [0,1,0,0,0,0|2,0,0]=3 688 B11R1.16 NCCC(F)c1ccncc1 Amb25329368 [0,1,0,0,0,0|2,0,1]=4 689 B11R1.16 NCCC(O)c1ccncc1 Amb18121042 [0,1,0,0,0,0|1,0,2]=4 690 B11R1.16 NCCS(=O)c1ccccc1 Amb18974516 [0,1,0,0,0,0|3,0,0]=4 691 B11R1.16 NCCS(=O)c1ccccc1 Amb19349568 [0,1,0,0,0,0|3,0,0]=4 692 B11R1.16 NCC[C@@H](N)c1ccncc1 Amb27205112 [0,1,0,0,0,0|2,0,1]=4 693 B11R1.16 NCC[C@@H](O)c1ccncc1 Amb33225169 [0,1,0,0,0,0|1,0,2]=4 694 B11R1.16 NCC[C@H](O)c1ccncc1 Amb33380660 [0,1,0,0,0,0|1,0,2]=4 695 B11R1.16 NNCC(=O)c1cccnc1 Amb28342492 [0,1,0,0,0,0|2,0,0]=3 696 B11R1.16 NNCC(O)c1ccccc1 Amb17232104 [0,1,0,0,0,0|1,0,2]=4 697 B11R1.16 NNCC(O)c1ccncc1 Amb18065401 [0,1,0,0,0,0|0,0,2]=3 698 B11R1.16 NOCC(=O)c1ccccc1 Amb29848094 [0,1,0,0,0,0|2,0,0]=3 699 B11R1.16 N\N=C\C(=O)c1ccccc1 Amb9824983 [0,1,0,0,0,0|1,0,1]=3 700 B11R1.16 O=C(C=C=S)c1ccccc1 Amb27227059 [0,1,0,0,0,0|3,0,0]=4 701 B11R1.16 O=C(CCBr)c1ccccc1 Amb4066411 [0,1,0,0,0,0|3,0,0]=4 702 B11R1.16 O=C(CCCl)c1ccccc1 Amb3940266 [0,1,0,0,0,0|3,0,0]=4 703 B11R1.16 O=C(CCCl)c1ccncc1 Amb24117884 [0,1,0,0,0,0|2,0,0]=3 704 B11R1.16 O=C(CCO)c1ccccc1 Amb16231606 [0,1,0,0,0,0|3,0,0]=4 705 B11R1.16 O=C(CCO)c1ccncc1 Amb24544067 [0,1,0,0,0,0|2,0,0]=3 706 B11R1.16 O=C(CCS)c1ccccc1 Amb17400214 [0,1,0,0,0,0|3,0,0]=4 707 B11R1.16 O=C(N=C=S)c1ccccc1 Amb2092776 [0,1,0,0,0,0|2,0,1]=4 708 B11R1.16 O=C(N=C=S)c1ccncc1 Amb9375599 [0,1,0,0,0,0|1,0,1]=3 709 B11R1.16 O=C(N=C=S)c1ccncn1 Amb27874281 [0,1,0,0,0,0|2,0,1]=4 710 B11R1.16 O=C(N=C=S)c1ccnnc1 Amb27406371 [0,1,0,0,0,0|2,0,1]=4 711 B11R1.16 O=C(NC#P)c1ccccc1 Amb28245816 [0,1,0,0,0,0|1,1,0]=3 712 B11R1.16 O=C(NCCl)c1ccccc1 Amb7761622 [0,1,0,0,0,0|2,0,0]=3 713 B11R1.16 O=C(NCCl)c1cccnc1 Amb27974129 [0,1,0,0,0,0|3,0,0]=4 714 B11R1.16 O=C(NCO)c1ccccc1 Amb1200467 [0,1,0,0,0,0|2,0,0]=3 715 B11R1.16 O=C(NCO)c1cccnc1 Amb6358137 [0,1,0,0,0,0|3,0,0]=4 716 B11R1.16 O=C(NNO)c1ccccn1 Amb25043959 [0,1,0,0,0,0|2,0,0]=3 717 B11R1.16 O=C(NO[K])c1ccccc1 Amb33457787 [0,1,0,0,0,0|2,0,0]=3 718 B11R1.16 O=C(OCCl)c1ccccc1 Amb19958719 [0,1,0,0,0,0|3,0,0]=4 719 B11R1.16 O=C(OCF)c1ccccc1 Amb27485928 [0,1,0,0,0,0|3,0,0]=4 720 B11R1.16 O=C(OCI)c1ccccc1 Amb25148286 [0,1,0,0,0,0|3,0,0]=4 721 B11R1.16 O=C(OCO)c1ccccc1 Amb25115920 [0,1,0,0,0,0|3,0,0]=4 722 B11R1.16 O=C(SCCl)c1ccccc1 Amb28458380 [0,1,0,0,0,0|3,0,0]=4 723 B11R1.16 O=C(\C=C/[O-])c1ccccc1 Amb17843402 [0,1,0,0,0,0|3,0,0]=4 724 B11R1.16 O=C(\C=C/[O-])c1ccccc1 Amb2385893 [0,1,0,0,0,0|3,0,0]=4 725 B11R1.16 O=C(\C=C\Cl)c1ccccc1 Amb17594153 [0,1,0,0,0,0|3,0,0]=4 726 B11R1.16 O=C(\C=C\Cl)c1ccncc1 Amb35645314 [0,1,0,0,0,0|2,0,0]=3 727 B11R1.16 O=C(\C=C\Cl)c1ccncn1 Amb35628814 [0,1,0,0,0,0|3,0,0]=4 728 B11R1.16 O=C(\C=C\Cl)c1ccnnc1 Amb35628607 [0,1,0,0,0,0|3,0,0]=4 729 B11R1.16 O=C(\C=C\[O-])c1ccccc1 Amb22360915 [0,1,0,0,0,0|3,0,0]=4 730 B11R1.16 O=C(\C=N\O)c1ccccc1 Amb2781112 [0,1,0,0,0,0|2,0,1]=4 731 B11R1.16 O=C(\N=C\S)c1ccccc1 Amb24485844 [0,1,0,0,0,0|2,0,1]=4 732 B11R1.16 O=C=NC(=O)c1ccccc1 Amb3940094 [0,1,0,0,0,0|2,0,1]=4 733 B11R1.16 O=C=NC(=O)c1ccncc1 Amb27473383 [0,1,0,0,0,0|1,0,1]=3 734 B11R1.16 O=CCC(=O)c1ccccc1 Amb8394158 [0,1,0,0,0,0|3,0,0]=4 735 B11R1.16 O=CCC(=O)c1ccncc1 Amb9204939 [0,1,0,0,0,0|2,0,0]=3 736 B11R1.16 O=CCC(=O)c1ccncn1 Amb26967626 [0,1,0,0,0,0|3,0,0]=4 737 B11R1.16 O=CNC(=O)c1ccccn1 Amb27831529 [0,1,0,0,0,0|3,0,0]=4 738 B11R1.16 O=COC(=O)c1ccccc1 Amb27421012 [0,1,0,0,0,0|3,0,0]=4 739 B11R1.16 O=C[CH-]C(=O)c1ccccc1 Amb24121236 [0,1,0,0,0,0|3,0,0]=4 740 B11R1.16 ONCC(O)c1ccncc1 Amb17334347 [0,1,0,0,0,0|1,0,2]=4 741 B11R1.16 [N-]=[N+]=CC(=O)c1ccccc1 Amb16233231 [0,1,0,0,0,0|1,0,2]=4 742 B11R1.16 [N-]=[N+]=CC(=O)c1ccncc1 Amb25922938 [0,1,0,0,0,0|0,0,2]=3 743 B11R1.16 [N-]=[N+]=NC(=O)c1ccccc1 Amb8938214 [0,1,0,0,0,0|1,0,2]=4 744 B11R1.16 [N-]=[N+]=NC(=O)c1ccncc1 Amb10574948 [0,1,0,0,0,0|0,0,2]=3 745 B11R1.16 [N-]=[N+]=NC(=O)c1ccncn1 Amb25766393 [0,1,0,0,0,0|1,0,2]=4 746 B11R1.16 [N-]=[N+]=NC(=O)c1ccnnc1 Amb28052765 [0,1,0,0,0,0|1,0,2]=4 747 B11R1.22 C#CC(=O)c1ccc(C)cc1 Amb27617443 [0,1,0,0,0,0|3,0,0]=4 748 B11R1.22 C#CC(=O)c1ccc(Cl)cc1 Amb25720663 [0,1,0,0,0,0|3,0,0]=4 749 B11R1.22 C#CC(=O)c1ccc(F)cc1 Amb24447227 [0,1,0,0,0,0|3,0,0]=4 750 B11R1.22 C#CC(=O)c1ccc(N)cc1 Amb24488157 [0,1,0,0,0,0|3,0,0]=4 751 B11R1.22 C=C(CN)c1ccc(Br)cc1 Amb25121108 [0,1,0,0,0,0|3,0,0]=4 752 B11R1.22 C=C(CN)c1ccc(C)cc1 Amb18124857 [0,1,0,0,0,0|3,0,0]=4 753 B11R1.22 C=C(CN)c1ccc(Cl)cc1 Amb18908725 [0,1,0,0,0,0|3,0,0]=4 754 B11R1.22 C=C(CN)c1ccc(F)cc1 Amb18125278 [0,1,0,0,0,0|3,0,0]=4 755 B11R1.22 C=C(CN)c1ccc(O)cc1 Amb26880201 [0,1,0,0,0,0|3,0,0]=4 756 B11R1.22 C=CC(=O)c1ccc(Br)cc1 Amb18066306 [0,1,0,0,0,0|3,0,0]=4 757 B11R1.22 C=CC(=O)c1ccc(C)cc1 Amb18063916 [0,1,0,0,0,0|3,0,0]=4 758 B11R1.22 C=CC(=O)c1ccc(Cl)cc1 Amb18563779 [0,1,0,0,0,0|3,0,0]=4 759 B11R1.22 C=CC(=O)c1ccc(F)cc1 Amb18065313 [0,1,0,0,0,0|3,0,0]=4 760 B11R1.22 C=CC(=O)c1ccc(N)cc1 Amb27253822 [0,1,0,0,0,0|3,0,0]=4 761 B11R1.22 C=CC(=O)c1ccc(O)cc1 Amb24121488 [0,1,0,0,0,0|3,0,0]=4 762 B11R1.22 CC(NN)c1ccc(Br)cc1 Amb13951417 [0,1,0,0,0,0|2,0,1]=4 763 B11R1.22 CC(NN)c1ccc(Br)cc1 Amb28990938 [0,1,0,0,0,0|2,0,1]=4 764 B11R1.22 CC(NN)c1ccc(Br)cc1 Amb6252295 [0,1,0,0,0,0|2,0,1]=4 765 B11R1.22 CC(NN)c1ccc(Cl)cc1 Amb13952413 [0,1,0,0,0,0|2,0,1]=4 766 B11R1.22 CC(NN)c1ccc(Cl)cc1 Amb28990885 [0,1,0,0,0,0|2,0,1]=4 767 B11R1.22 CC(NN)c1ccc(Cl)cc1 Amb32411826 [0,1,0,0,0,0|2,0,1]=4 768 B11R1.22 CC(NN)c1ccc(Cl)cc1 Amb6245571 [0,1,0,0,0,0|2,0,1]=4 769 B11R1.22 CC(NN)c1ccc(F)cc1 Amb6249161 [0,1,0,0,0,0|2,0,1]=4 770 B11R1.22 CCC(=O)c1ccc(Br)cc1 Amb267378 [0,1,0,0,0,0|3,0,0]=4 771 B11R1.22 CCC(=O)c1ccc(C)cc1 Amb5740248 [0,1,0,0,0,0|3,0,0]=4 772 B11R1.22 CCC(=O)c1ccc(Cl)cc1 Amb6365763 [0,1,0,0,0,0|3,0,0]=4 773 B11R1.22 CCC(=O)c1ccc(F)cc1 Amb2688408 [0,1,0,0,0,0|3,0,0]=4 774 B11R1.22 CCC(=O)c1ccc(I)cc1 Amb6244842 [0,1,0,0,0,0|3,0,0]=4 775 B11R1.22 CCC(=O)c1ccc(N)cc1 Amb2610525 [0,1,0,0,0,0|3,0,0]=4 776 B11R1.22 CCC(=O)c1ccc(N)cc1 Amb34896232 [0,1,0,0,0,0|3,0,0]=4 777 B11R1.22 CCC(=O)c1ccc(O)cc1 Amb1336085 [0,1,0,0,0,0|3,0,0]=4 778 B11R1.22 CN1C=CC(C(=O)NN)=CC1 Amb25970526 [0,1,0,0,0,0|0,0,2]=3 779 B11R1.22 CNC(=N)c1ccc(Br)cc1 Amb27175134 [0,1,0,0,0,0|3,0,0]=4 780 B11R1.22 CNC(=N)c1ccc(C)cc1 Amb8480217 [0,1,0,0,0,0|3,0,0]=4 781 B11R1.22 CNC(=O)C1=CNC(=O)C=C1 Amb18799400 [0,1,0,0,0,0|3,0,0]=4 782 B11R1.22 CNC(=O)C1=COC(=O)C=C1 Amb27982783 [0,1,0,0,0,0|3,0,0]=4 783 B11R1.22 CNC(=O)c1ccc(Br)cc1 Amb1232931 [0,1,0,0,0,0|2,0,0]=3 784 B11R1.22 CNC(=O)c1ccc(Br)cn1 Amb10068169 [0,1,0,0,0,0|3,0,0]=4 785 B11R1.22 CNC(=O)c1ccc(Br)nc1 Amb19959847 [0,1,0,0,0,0|3,0,0]=4 786 B11R1.22 CNC(=O)c1ccc(C)cc1 Amb2721101 [0,1,0,0,0,0|2,0,0]=3 787 B11R1.22 CNC(=O)c1ccc(C)cn1 Amb25151403 [0,1,0,0,0,0|3,0,0]=4 788 B11R1.22 CNC(=O)c1ccc(Cl)cc1 Amb2707199 [0,1,0,0,0,0|2,0,0]=3 789 B11R1.22 CNC(=O)c1ccc(Cl)cn1 Amb27601396 [0,1,0,0,0,0|3,0,0]=4 790 B11R1.22 CNC(=O)c1ccc(Cl)nc1 Amb2106608 [0,1,0,0,0,0|3,0,0]=4 791 B11R1.22 CNC(=O)c1ccc(F)cc1 Amb3886603 [0,1,0,0,0,0|2,0,0]=3 792 B11R1.22 CNC(=O)c1ccc(F)cn1 Amb27607820 [0,1,0,0,0,0|3,0,0]=4 793 B11R1.22 CNC(=O)c1ccc(I)cc1 Amb1230427 [0,1,0,0,0,0|2,0,0]=3 794 B11R1.22 CNC(=O)c1ccc(I)cn1 Amb27268655 [0,1,0,0,0,0|3,0,0]=4 795 B11R1.22 CNC(=O)c1ccc(N)cc1 Amb6334818 [0,1,0,0,0,0|2,0,0]=3 796 B11R1.22 CNC(=O)c1ccc(N)cn1 Amb25923162 [0,1,0,0,0,0|3,0,0]=4 797 B11R1.22 CNC(=O)c1ccc(N)nc1 Amb18946779 [0,1,0,0,0,0|3,0,0]=4 798 B11R1.22 CNC(=O)c1ccc(O)cc1 Amb6671651 [0,1,0,0,0,0|2,0,0]=3 799 B11R1.22 CNC(=O)c1ccc(O)cn1 Amb19895115 [0,1,0,0,0,0|3,0,0]=4 800 B11R1.22 CNC(=O)c1ccc(S)cc1 Amb24486099 [0,1,0,0,0,0|2,0,0]=3 801 B11R1.22 CNC(=S)c1ccc(Cl)cc1 Amb28436657 [0,1,0,0,0,0|2,1,0]=4 802 B11R1.22 CNC(=S)c1ccc(O)cc1 Amb28056735 [0,1,0,0,0,0|2,1,0]=4 803 B11R1.22 CNS(=O)c1ccc(N)cc1 Amb18862841 [0,1,0,0,0,0|3,0,0]=4 804 B11R1.22 COC(=O)c1cc[n+](C)cc1 Amb4005009 [0,1,0,0,0,0|2,0,1]=4 805 B11R1.22 COC(=O)c1cc[n+]([O-])cc1 Amb4017366 [0,1,0,0,0,0|2,0,1]=4 806 B11R1.22 COC(=O)c1ccc(Br)cc1 Amb1394975 [0,1,0,0,0,0|3,0,0]=4 807 B11R1.22 COC(=O)c1ccc(C)cc1 Amb1210121 [0,1,0,0,0,0|3,0,0]=4 808 B11R1.22 COC(=O)c1ccc(Cl)cc1 Amb2726180 [0,1,0,0,0,0|3,0,0]=4 809 B11R1.22 COC(=O)c1ccc(F)cc1 Amb2227542 [0,1,0,0,0,0|3,0,0]=4 810 B11R1.22 COC(=O)c1ccc(I)cc1 Amb2411582 [0,1,0,0,0,0|3,0,0]=4 811 B11R1.22 COC(=O)c1ccc(N)cc1 Amb1215269 [0,1,0,0,0,0|3,0,0]=4 812 B11R1.22 COC(=O)c1ccc(N)cc1 Amb2726185 [0,1,0,0,0,0|3,0,0]=4 813 B11R1.22 COC(=O)c1ccc(O)cc1 Amb534309 [0,1,0,0,0,0|3,0,0]=4 814 B11R1.22 COC(=O)c1ccc(S)cc1 Amb341395 [0,1,0,0,0,0|3,0,0]=4 815 B11R1.22 COC(=O)c1ccc([O-])cc1 Amb6296112 [0,1,0,0,0,0|3,0,0]=4 816 B11R1.22 CSC(=O)c1ccc(N)cc1 Amb27831413 [0,1,0,0,0,0|3,0,0]=4 817 B11R1.22 C[n+]1ccc(C(=O)NO)cc1 Amb4008085 [0,1,0,0,0,0|1,0,1]=3 818 B11R1.22 C\C(=N/N)c1ccc(C)cc1 Amb4019900 [0,1,0,0,0,0|2,0,1]=4 819 B11R1.22 C\C(=N/N)c1ccc(N)cc1 Amb27225960 [0,1,0,0,0,0|2,0,1]=4 820 B11R1.22 C\C(=N\N)c1ccc(Br)cc1 Amb10552972 [0,1,0,0,0,0|2,0,1]=4 821 B11R1.22 C\C(=N\N)c1ccc(C)cc1 Amb27840228 [0,1,0,0,0,0|2,0,1]=4 822 B11R1.22 Cc1ccc(C(=N)NN)cc1 Amb22231277 [0,1,0,0,0,0|2,0,0]=3 823 B11R1.22 Cc1ccc(C(=N)NO)cc1 Amb33715887 [0,1,0,0,0,0|3,0,0]=4 824 B11R1.22 Cc1ccc(C(=N)NO)cc1 Amb8631025 [0,1,0,0,0,0|3,0,0]=4 825 B11R1.22 Cc1ccc(C(=O)C#N)cc1 Amb17231996 [0,1,0,0,0,0|2,0,1]=4 826 B11R1.22 Cc1ccc(C(=O)C=O)cc1 Amb10067935 [0,1,0,0,0,0|3,0,0]=4 827 B11R1.22 Cc1ccc(C(=O)C=O)cc1 Amb2609863 [0,1,0,0,0,0|3,0,0]=4 828 B11R1.22 Cc1ccc(C(=O)CBr)cc1 Amb1981331 [0,1,0,0,0,0|3,0,0]=4 829 B11R1.22 Cc1ccc(C(=O)CCl)cc1 Amb1105496 [0,1,0,0,0,0|3,0,0]=4 830 B11R1.22 Cc1ccc(C(=O)CF)cc1 Amb24084136 [0,1,0,0,0,0|3,0,0]=4 831 B11R1.22 Cc1ccc(C(=O)CN)cc1 Amb2693534 [0,1,0,0,0,0|2,0,0]=3 832 B11R1.22 Cc1ccc(C(=O)CN)cc1 Amb33513193 [0,1,0,0,0,0|2,0,0]=3 833 B11R1.22 Cc1ccc(C(=O)CN)cc1 Amb5739530 [0,1,0,0,0,0|2,0,0]=3 834 B11R1.22 Cc1ccc(C(=O)CN)cn1 Amb26546876 [0,1,0,0,0,0|3,0,0]=4 835 B11R1.22 Cc1ccc(C(=O)CN)nc1 Amb27204900 [0,1,0,0,0,0|3,0,0]=4 836 B11R1.22 Cc1ccc(C(=O)CO)cc1 Amb5638929 [0,1,0,0,0,0|3,0,0]=4 837 B11R1.22 Cc1ccc(C(=O)CS)cc1 Amb17400215 [0,1,0,0,0,0|3,0,0]=4 838 B11R1.22 Cc1ccc(C(=O)C[NH3+])cc1 Amb10606218 [0,1,0,0,0,0|2,0,1]=4 839 B11R1.22 Cc1ccc(C(=O)NN)cc1 Amb6355393 [0,1,0,0,0,0|1,0,0]=2 840 B11R1.22 Cc1ccc(C(=O)NN)cn1 Amb1139431 [0,1,0,0,0,0|2,0,0]=3 841 B11R1.22 Cc1ccc(C(=O)NN)nc1 Amb27663313 [0,1,0,0,0,0|2,0,0]=3 842 B11R1.22 Cc1ccc(C(=O)NN)nn1 Amb28436240 [0,1,0,0,0,0|3,0,0]=4 843 B11R1.22 Cc1ccc(C(=O)NO)cc1 Amb6444120 [0,1,0,0,0,0|2,0,0]=3 844 B11R1.22 Cc1ccc(C(=O)NO)nc1 Amb25115686 [0,1,0,0,0,0|3,0,0]=4 845 B11R1.22 Cc1cnc(C(=O)NN)cn1 Amb1141131 [0,1,0,0,0,0|3,0,0]=4 846 B11R1.22 Cc1ncc(C(=O)NN)cn1 Amb17621997 [0,1,0,0,0,0|3,0,0]=4 847 B11R1.22 N#CC(=O)c1ccc(Br)cc1 Amb3991577 [0,1,0,0,0,0|2,0,1]=4 848 B11R1.22 N#CC(=O)c1ccc(Cl)cc1 Amb17939433 [0,1,0,0,0,0|2,0,1]=4 849 B11R1.22 N#CC(=O)c1ccc(F)cc1 Amb17232050 [0,1,0,0,0,0|2,0,1]=4 850 B11R1.22 N#CC(=O)c1ccc(I)cc1 Amb22495535 [0,1,0,0,0,0|2,0,1]=4 851 B11R1.22 N=C(NN)c1ccc(Br)cc1 Amb32789699 [0,1,0,0,0,0|2,0,0]=3 852 B11R1.22 N=C(NO)c1ccc(N)cc1 Amb8631027 [0,1,0,0,0,0|3,0,0]=4 853 B11R1.22 N=C1C=CC(=C(N)NO)C=C1 Amb27398679 [0,1,0,0,0,0|3,0,0]=4 854 B11R1.22 NCC(=O)c1ccc(Br)cc1 Amb1811968 [0,1,0,0,0,0|2,0,0]=3 855 B11R1.22 NCC(=O)c1ccc(Br)cc1 Amb2728641 [0,1,0,0,0,0|2,0,0]=3 856 B11R1.22 NCC(=O)c1ccc(Br)cc1 Amb3940739 [0,1,0,0,0,0|2,0,0]=3 857 B11R1.22 NCC(=O)c1ccc(Br)cn1 Amb27169579 [0,1,0,0,0,0|3,0,0]=4 858 B11R1.22 NCC(=O)c1ccc(Br)cn1 Amb30868020 [0,1,0,0,0,0|3,0,0]=4 859 B11R1.22 NCC(=O)c1ccc(Br)nc1 Amb25778172 [0,1,0,0,0,0|3,0,0]=4 860 B11R1.22 NCC(=O)c1ccc(Cl)cc1 Amb1208662 [0,1,0,0,0,0|2,0,0]=3 861 B11R1.22 NCC(=O)c1ccc(Cl)cc1 Amb2370537 [0,1,0,0,0,0|2,0,0]=3 862 B11R1.22 NCC(=O)c1ccc(Cl)cn1 Amb28071512 [0,1,0,0,0,0|3,0,0]=4 863 B11R1.22 NCC(=O)c1ccc(Cl)nc1 Amb26880354 [0,1,0,0,0,0|3,0,0]=4 864 B11R1.22 NCC(=O)c1ccc(Cl)nc1 Amb32671466 [0,1,0,0,0,0|3,0,0]=4 865 B11R1.22 NCC(=O)c1ccc(F)cc1 Amb1419069 [0,1,0,0,0,0|2,0,0]=3 866 B11R1.22 NCC(=O)c1ccc(F)cc1 Amb5739537 [0,1,0,0,0,0|2,0,0]=3 867 B11R1.22 NCC(=O)c1ccc(F)cc1 Amb6384072 [0,1,0,0,0,0|2,0,0]=3 868 B11R1.22 NCC(=O)c1ccc(F)cn1 Amb26340235 [0,1,0,0,0,0|3,0,0]=4 869 B11R1.22 NCC(=O)c1ccc(F)nc1 Amb24106028 [0,1,0,0,0,0|3,0,0]=4 870 B11R1.22 NCC(=O)c1ccc(I)cc1 Amb21962789 [0,1,0,0,0,0|2,0,0]=3 871 B11R1.22 NCC(=O)c1ccc(I)cc1 Amb25876415 [0,1,0,0,0,0|2,0,0]=3 872 B11R1.22 NCC(=O)c1ccc(O)cc1 Amb17593762 [0,1,0,0,0,0|2,0,0]=3 873 B11R1.22 NCC(=O)c1ccc(O)cc1 Amb22001575 [0,1,0,0,0,0|2,0,0]=3 874 B11R1.22 NNC(=O)C1=CNC(=O)C=N1 Amb27756156 [0,1,0,0,0,0|3,0,0]=4 875 B11R1.22 NNC(=O)C1=NNC(=O)C=C1 Amb18182891 [0,1,0,0,0,0|3,0,0]=4 876 B11R1.22 NNC(=O)c1cc[n+]([O-])cc1 Amb598305 [0,1,0,0,0,0|0,0,1]=2 877 B11R1.22 NNC(=O)c1ccc(Br)cc1 Amb1207367 [0,1,0,0,0,0|1,0,0]=2 878 B11R1.22 NNC(=O)c1ccc(Br)cn1 Amb28064363 [0,1,0,0,0,0|2,0,0]=3 879 B11R1.22 NNC(=O)c1ccc(Br)nc1 Amb27796131 [0,1,0,0,0,0|2,0,0]=3 880 B11R1.22 NNC(=O)c1ccc(Cl)cc1 Amb1209335 [0,1,0,0,0,0|1,0,0]=2 881 B11R1.22 NNC(=O)c1ccc(Cl)cn1 Amb13882790 [0,1,0,0,0,0|2,0,0]=3 882 B11R1.22 NNC(=O)c1ccc(Cl)nc1 Amb2726081 [0,1,0,0,0,0|2,0,0]=3 883 B11R1.22 NNC(=O)c1ccc(F)cc1 Amb1104475 [0,1,0,0,0,0|1,0,0]=2 884 B11R1.22 NNC(=O)c1ccc(F)cn1 Amb21856829 [0,1,0,0,0,0|2,0,0]=3 885 B11R1.22 NNC(=O)c1ccc(I)cc1 Amb1788092 [0,1,0,0,0,0|1,0,0]=2 886 B11R1.22 NNC(=O)c1ccc(N)cc1 Amb6335760 [0,1,0,0,0,0|1,0,0]=2 887 B11R1.22 NNC(=O)c1ccc(N)nc1 Amb3427757 [0,1,0,0,0,0|2,0,0]=3 888 B11R1.22 NNC(=O)c1ccc(O)cc1 Amb1212100 [0,1,0,0,0,0|1,0,0]=2 889 B11R1.22 NNC(=O)c1ccc(O)cn1 Amb27252039 [0,1,0,0,0,0|2,0,0]=3 890 B11R1.22 NNC(=O)c1ccc(O)nc1 Amb22736279 [0,1,0,0,0,0|2,0,0]=3 891 B11R1.22 NNC(=O)c1cnc(Cl)cn1 Amb19957691 [0,1,0,0,0,0|3,0,0]=4 892 B11R1.22 NNC(=O)c1cnc(Cl)nc1 Amb27949978 [0,1,0,0,0,0|3,0,0]=4 893 B11R1.22 NNC(=O)c1cnc(N)nc1 Amb28396539 [0,1,0,0,0,0|3,0,0]=4 894 B11R1.22 NNC(=O)c1cnc(O)nc1 Amb27834993 [0,1,0,0,0,0|3,0,0]=4 895 B11R1.22 NNC(=O)c1ncc(Br)cn1 Amb25826402 [0,1,0,0,0,0|3,0,0]=4 896 B11R1.22 NNC(=O)c1ncc(Cl)cn1 Amb27442165 [0,1,0,0,0,0|3,0,0]=4 897 B11R1.22 NNC(=O)c1ncc(F)cn1 Amb28341778 [0,1,0,0,0,0|3,0,0]=4 898 B11R1.22 NNC(=S)c1ccc(Cl)cc1 Amb27489915 [0,1,0,0,0,0|1,1,0]=3 899 B11R1.22 NOC(=O)c1ccc(Cl)cc1 Amb24539350 [0,1,0,0,0,0|2,0,0]=3 900 B11R1.22 N\N=C(/N)c1ccc(Br)cc1 Amb33250363 [0,1,0,0,0,0|2,0,1]=4 901 B11R1.22 N\N=C(/N)c1ccc(Cl)cc1 Amb2695041 [0,1,0,0,0,0|2,0,1]=4 902 B11R1.22 N\N=C(\N)c1ccc(Br)cc1 Amb25169225 [0,1,0,0,0,0|2,0,1]=4 903 B11R1.22 N\N=C(\N)c1ccc(F)cc1 Amb18787467 [0,1,0,0,0,0|2,0,1]=4 904 B11R1.22 Nc1ccc(C(=O)C=O)cc1 Amb28341792 [0,1,0,0,0,0|3,0,0]=4 905 B11R1.22 Nc1ccc(C(=O)CBr)cc1 Amb8631324 [0,1,0,0,0,0|3,0,0]=4 906 B11R1.22 Nc1ccc(C(=O)CCl)cc1 Amb9782884 [0,1,0,0,0,0|3,0,0]=4 907 B11R1.22 Nc1ccc(C(=O)CO)cc1 Amb28255444 [0,1,0,0,0,0|3,0,0]=4 908 B11R1.22 Nc1ccc(C(=O)NO)cn1 Amb26331544 [0,1,0,0,0,0|3,0,0]=4 909 B11R1.22 Nc1ccc(C(=O)NO)nc1 Amb26318975 [0,1,0,0,0,0|3,0,0]=4 910 B11R1.22 O=C(CBr)c1ccc(Br)cc1 Amb6337421 [0,1,0,0,0,0|3,0,0]=4 911 B11R1.22 O=C(CBr)c1ccc(Cl)cc1 Amb2505006 [0,1,0,0,0,0|3,0,0]=4 912 B11R1.22 O=C(CBr)c1ccc(F)cc1 Amb1885038 [0,1,0,0,0,0|3,0,0]=4 913 B11R1.22 O=C(CBr)c1ccc(I)cc1 Amb2612426 [0,1,0,0,0,0|3,0,0]=4 914 B11R1.22 O=C(CBr)c1ccc(O)cc1 Amb6297896 [0,1,0,0,0,0|3,0,0]=4 915 B11R1.22 O=C(CCl)c1ccc(Br)cc1 Amb1103620 [0,1,0,0,0,0|3,0,0]=4 916 B11R1.22 O=C(CCl)c1ccc(Cl)cc1 Amb6608728 [0,1,0,0,0,0|3,0,0]=4 917 B11R1.22 O=C(CCl)c1ccc(F)cc1 Amb1221364 [0,1,0,0,0,0|3,0,0]=4 918 B11R1.22 O=C(CCl)c1ccc(I)cc1 Amb420189 [0,1,0,0,0,0|3,0,0]=4 919 B11R1.22 O=C(CCl)c1ccc(O)cc1 Amb1218323 [0,1,0,0,0,0|3,0,0]=4 920 B11R1.22 O=C(CF)c1ccc(Br)cc1 Amb26595064 [0,1,0,0,0,0|3,0,0]=4 921 B11R1.22 O=C(CF)c1ccc(Cl)cc1 Amb10603324 [0,1,0,0,0,0|3,0,0]=4 922 B11R1.22 O=C(CF)c1ccc(F)cc1 Amb22490651 [0,1,0,0,0,0|3,0,0]=4 923 B11R1.22 O=C(CI)c1ccc(Br)cc1 Amb23579956 [0,1,0,0,0,0|3,0,0]=4 924 B11R1.22 O=C(CO)c1ccc(Br)cc1 Amb2726212 [0,1,0,0,0,0|3,0,0]=4 925 B11R1.22 O=C(CO)c1ccc(Cl)cc1 Amb2736179 [0,1,0,0,0,0|3,0,0]=4 926 B11R1.22 O=C(CO)c1ccc(F)cc1 Amb2740436 [0,1,0,0,0,0|3,0,0]=4 927 B11R1.22 O=C(CO)c1ccc(I)cc1 Amb5638978 [0,1,0,0,0,0|3,0,0]=4 928 B11R1.22 O=C(CS)c1ccc(Br)cc1 Amb17407556 [0,1,0,0,0,0|3,0,0]=4 929 B11R1.22 O=C(CS)c1ccc(Cl)cc1 Amb17401093 [0,1,0,0,0,0|3,0,0]=4 930 B11R1.22 O=C(CS)c1ccc(F)cc1 Amb17400324 [0,1,0,0,0,0|3,0,0]=4 931 B11R1.22 O=C(NO)c1ccc(Br)cc1 Amb6444119 [0,1,0,0,0,0|2,0,0]=3 932 B11R1.22 O=C(NO)c1ccc(Br)cn1 Amb26977047 [0,1,0,0,0,0|3,0,0]=4 933 B11R1.22 O=C(NO)c1ccc(Br)nc1 Amb25935468 [0,1,0,0,0,0|3,0,0]=4 934 B11R1.22 O=C(NO)c1ccc(Cl)cc1 Amb6264774 [0,1,0,0,0,0|2,0,0]=3 935 B11R1.22 O=C(NO)c1ccc(Cl)cn1 Amb25704752 [0,1,0,0,0,0|3,0,0]=4 936 B11R1.22 O=C(NO)c1ccc(Cl)nc1 Amb19929453 [0,1,0,0,0,0|3,0,0]=4 937 B11R1.22 O=C(NO)c1ccc(F)cc1 Amb6271764 [0,1,0,0,0,0|2,0,0]=3 938 B11R1.22 O=C(NO)c1ccc(F)cn1 Amb26980721 [0,1,0,0,0,0|3,0,0]=4 939 B11R1.22 O=C(NO)c1ccc(F)nc1 Amb33035191 [0,1,0,0,0,0|3,0,0]=4 940 B11R1.22 O=C(NO)c1ccc(I)cc1 Amb7756049 [0,1,0,0,0,0|2,0,0]=3 941 B11R1.22 O=C1C=CC(C(=O)NO)=CN1 Amb27753127 [0,1,0,0,0,0|3,0,0]=4 942 B11R1.22 O=CC(=O)c1ccc(Br)cc1 Amb10067934 [0,1,0,0,0,0|3,0,0]=4 943 B11R1.22 O=CC(=O)c1ccc(Br)cc1 Amb8391398 [0,1,0,0,0,0|3,0,0]=4 944 B11R1.22 O=CC(=O)c1ccc(Cl)cc1 Amb10067933 [0,1,0,0,0,0|3,0,0]=4 945 B11R1.22 O=CC(=O)c1ccc(Cl)cc1 Amb4479326 [0,1,0,0,0,0|3,0,0]=4 946 B11R1.22 O=CC(=O)c1ccc(F)cc1 Amb2688344 [0,1,0,0,0,0|3,0,0]=4 947 B11R1.22 O=CC(=O)c1ccc(F)cc1 Amb9826943 [0,1,0,0,0,0|3,0,0]=4 948 B11R1.22 O=CC(=O)c1ccc(I)cc1 Amb28455510 [0,1,0,0,0,0|3,0,0]=4 949 B11R1.22 O=CC(=O)c1ccc(O)cc1 Amb10069044 [0,1,0,0,0,0|3,0,0]=4 950 B11R1.22 O=CC(=O)c1ccc(O)cc1 Amb6373643 [0,1,0,0,0,0|3,0,0]=4 951 B11R1.22 [CH2]c1ccc(C(=O)OC)cc1 Amb35825242 [0,1,0,0,0,0|3,0,0]=4 952 B11R1.22 [NH3+]CC(=O)c1ccc(Br)cc1 Amb24113825 [0,1,0,0,0,0|2,0,1]=4 953 B11R1.22 [NH3+]CC(=O)c1ccc(Br)cc1 Amb6366127 [0,1,0,0,0,0|2,0,1]=4 954 B11R1.22 [NH3+]CC(=O)c1ccc(Cl)cc1 Amb33513069 [0,1,0,0,0,0|2,0,1]=4 955 B11R1.22 [NH3+]CC(=O)c1ccc(Cl)cc1 Amb3987034 [0,1,0,0,0,0|2,0,1]=4 956 B11R1.22 [NH3+]CC(=O)c1ccc(F)cc1 Amb4014040 [0,1,0,0,0,0|2,0,1]=4 957 B11R1.22 [NH3+]CC(=O)c1ccc(F)cc1 Amb4324947 [0,1,0,0,0,0|2,0,1]=4 958 B11R1.23 C#CC(=O)c1cccc(Cl)c1 Amb25687191 [0,1,0,0,0,0|3,0,0]=4 959 B11R1.23 C#CC(=O)c1cccc(N)c1 Amb24550417 [0,1,0,0,0,0|3,0,0]=4 960 B11R1.23 C=C(CBr)c1ccnc(C)c1 Amb33004989 [0,1,0,0,0,0|3,0,0]=4 961 B11R1.23 C=C(CBr)c1ccnc(Cl)c1 Amb33435735 [0,1,0,0,0,0|3,0,0]=4 962 B11R1.23 C=C(CCl)c1ccnc(C)c1 Amb33057996 [0,1,0,0,0,0|3,0,0]=4 963 B11R1.23 C=C(CN)c1cccc(C)c1 Amb18251308 [0,1,0,0,0,0|3,0,0]=4 964 B11R1.23 C=C(CN)c1cccc(Cl)c1 Amb18908724 [0,1,0,0,0,0|3,0,0]=4 965 B11R1.23 C=C(CN)c1cccc(F)c1 Amb18908419 [0,1,0,0,0,0|3,0,0]=4 966 B11R1.23 C=C(CN)c1cccc(O)c1 Amb25326353 [0,1,0,0,0,0|3,0,0]=4 967 B11R1.23 C=C(CN)c1ccnc(C)c1 Amb32733046 [0,1,0,0,0,0|2,0,0]=3 968 B11R1.23 C=CC(=O)c1cccc(Br)c1 Amb26372631 [0,1,0,0,0,0|3,0,0]=4 969 B11R1.23 C=CC(=O)c1cccc(C)c1 Amb25861091 [0,1,0,0,0,0|3,0,0]=4 970 B11R1.23 C=CC(=O)c1cccc(Cl)c1 Amb25783480 [0,1,0,0,0,0|3,0,0]=4 971 B11R1.23 C=CC(=O)c1cccc(F)c1 Amb26460816 [0,1,0,0,0,0|3,0,0]=4 972 B11R1.23 C=CC(=O)c1cccc(I)c1 Amb28136092 [0,1,0,0,0,0|3,0,0]=4 973 B11R1.23 C=CC(=O)c1cccc(N)c1 Amb25291745 [0,1,0,0,0,0|3,0,0]=4 974 B11R1.23 C=CC(=O)c1cccc(O)c1 Amb18124877 [0,1,0,0,0,0|3,0,0]=4 975 B11R1.23 C=CC(=O)c1ccnc(C)c1 Amb27452440 [0,1,0,0,0,0|2,0,0]=3 976 B11R1.23 C=CC(=O)c1ccnc(C)n1 Amb27823392 [0,1,0,0,0,0|3,0,0]=4 977 B11R1.23 C=CC(=O)c1ccnc(Cl)c1 Amb25890876 [0,1,0,0,0,0|2,0,0]=3 978 B11R1.23 CC(CN)c1ccnc(F)c1 Amb33735126 [0,1,0,0,0,0|2,0,1]=4 979 B11R1.23 CC(CN)c1ccnc(N)c1 Amb27974524 [0,1,0,0,0,0|2,0,1]=4 980 B11R1.23 CC(NN)c1cccc(I)c1 Amb27830005 [0,1,0,0,0,0|2,0,1]=4 981 B11R1.23 CCC(=O)C1=CC(=O)NC=C1 Amb27471883 [0,1,0,0,0,0|2,0,1]=4 982 B11R1.23 CCC(=O)c1cccc(Br)c1 Amb1233199 [0,1,0,0,0,0|3,0,0]=4 983 B11R1.23 CCC(=O)c1cccc(C)c1 Amb33534981 [0,1,0,0,0,0|3,0,0]=4 984 B11R1.23 CCC(=O)c1cccc(Cl)c1 Amb2686437 [0,1,0,0,0,0|3,0,0]=4 985 B11R1.23 CCC(=O)c1cccc(F)c1 Amb2688407 [0,1,0,0,0,0|3,0,0]=4 986 B11R1.23 CCC(=O)c1cccc(I)c1 Amb27230465 [0,1,0,0,0,0|3,0,0]=4 987 B11R1.23 CCC(=O)c1cccc(N)c1 Amb3429288 [0,1,0,0,0,0|3,0,0]=4 988 B11R1.23 CCC(=O)c1cccc(O)c1 Amb8387616 [0,1,0,0,0,0|3,0,0]=4 989 B11R1.23 CCC(=O)c1ccnc(C)c1 Amb28184697 [0,1,0,0,0,0|2,0,0]=3 990 B11R1.23 CCC(=O)c1ccnc(C)n1 Amb26847077 [0,1,0,0,0,0|3,0,0]=4 991 B11R1.23 CCC(=O)c1ccnc(Cl)c1 Amb6301673 [0,1,0,0,0,0|2,0,0]=3 992 B11R1.23 CCS(=O)c1ccnc(Br)c1 Amb27968080 [0,1,0,0,0,0|3,0,0]=4 993 B11R1.23 CNC(=N)c1cccc(Br)c1 Amb27484944 [0,1,0,0,0,0|3,0,0]=4 994 B11R1.23 CNC(=N)c1cccc(F)c1 Amb27395007 [0,1,0,0,0,0|3,0,0]=4 995 B11R1.23 CNC(=O)C1=CC(=O)NC=C1 Amb27169726 [0,1,0,0,0,0|1,0,1]=3 996 B11R1.23 CNC(=O)C1=CC=NC(=O)N1 Amb32419037 [0,1,0,0,0,0|2,0,0]=3 997 B11R1.23 CNC(=O)c1cc(Br)ccn1 Amb25312186 [0,1,0,0,0,0|3,0,0]=4 998 B11R1.23 CNC(=O)c1cc(C)ccn1 Amb26907343 [0,1,0,0,0,0|3,0,0]=4 999 B11R1.23 CNC(=O)c1cc(Cl)ccn1 Amb1216582 [0,1,0,0,0,0|3,0,0]=4 1000 B11R1.23 CNC(=O)c1cc(Cl)ccn1 Amb17611087 [0,1,0,0,0,0|3,0,0]=4 1001 B11R1.23 CNC(=O)c1cc(I)ccn1 Amb27877595 [0,1,0,0,0,0|3,0,0]=4 1002 B11R1.23 CNC(=O)c1cc(N)ccn1 Amb33531654 [0,1,0,0,0,0|3,0,0]=4 1003 B11R1.23 CNC(=O)c1cc(O)ccn1 Amb22755769 [0,1,0,0,0,0|3,0,0]=4 1004 B11R1.23 CNC(=O)c1ccc[n+](C)c1 Amb27827345 [0,1,0,0,0,0|3,0,0]=4 1005 B11R1.23 CNC(=O)c1ccc[n+](C)c1 Amb29846115 [0,1,0,0,0,0|3,0,0]=4 1006 B11R1.23 CNC(=O)c1cccc(Br)c1 Amb3887216 [0,1,0,0,0,0|2,0,0]=3 1007 B11R1.23 CNC(=O)c1cccc(Br)n1 Amb19959848 [0,1,0,0,0,0|3,0,0]=4 1008 B11R1.23 CNC(=O)c1cccc(C)n1 Amb8333372 [0,1,0,0,0,0|3,0,0]=4 1009 B11R1.23 CNC(=O)c1cccc(Cl)n1 Amb10877696 [0,1,0,0,0,0|3,0,0]=4 1010 B11R1.23 CNC(=O)c1cccc(F)c1 Amb3886602 [0,1,0,0,0,0|2,0,0]=3 1011 B11R1.23 CNC(=O)c1cccc(F)n1 Amb27176229 [0,1,0,0,0,0|3,0,0]=4 1012 B11R1.23 CNC(=O)c1cccc(I)c1 Amb6403460 [0,1,0,0,0,0|2,0,0]=3 1013 B11R1.23 CNC(=O)c1cccc(N)c1 Amb1212262 [0,1,0,0,0,0|2,0,0]=3 1014 B11R1.23 CNC(=O)c1cccc(N)c1 Amb24053079 [0,1,0,0,0,0|2,0,0]=3 1015 B11R1.23 CNC(=O)c1cccc(N)n1 Amb18946961 [0,1,0,0,0,0|3,0,0]=4 1016 B11R1.23 CNC(=O)c1cccc(O)c1 Amb6671640 [0,1,0,0,0,0|2,0,0]=3 1017 B11R1.23 CNC(=O)c1ccnc(Br)c1 Amb15691039 [0,1,0,0,0,0|1,0,0]=2 1018 B11R1.23 CNC(=O)c1ccnc(Cl)c1 Amb6667937 [0,1,0,0,0,0|1,0,0]=2 1019 B11R1.23 CNC(=O)c1ccnc(F)c1 Amb18787496 [0,1,0,0,0,0|1,0,0]=2 1020 B11R1.23 CNC(=O)c1ccnc(N)c1 Amb33529707 [0,1,0,0,0,0|1,0,0]=2 1021 B11R1.23 CNC(=O)c1cncc(N)c1 Amb23452695 [0,1,0,0,0,0|3,0,0]=4 1022 B11R1.23 CNC(C)c1ccnc(F)c1 Amb28250928 [0,1,0,0,0,0|2,0,1]=4 1023 B11R1.23 CN[C@@H](C)c1ccnc(N)c1 Amb27860394 [0,1,0,0,0,0|2,0,1]=4 1024 B11R1.23 CN[C@H](C)c1ccnc(Br)c1 Amb27459882 [0,1,0,0,0,0|2,0,1]=4 1025 B11R1.23 CN[C@H](C)c1ccnc(C)c1 Amb28145005 [0,1,0,0,0,0|2,0,1]=4 1026 B11R1.23 COC(=N)c1ccnc(F)c1 Amb27462629 [0,1,0,0,0,0|3,0,0]=4 1027 B11R1.23 COC(=O)C1=CC(=N)NC=C1 Amb19281876 [0,1,0,0,0,0|2,0,1]=4 1028 B11R1.23 COC(=O)C1=CC(=O)N=CN1 Amb22497602 [0,1,0,0,0,0|3,0,0]=4 1029 B11R1.23 COC(=O)c1cc(Br)ncn1 Amb22752399 [0,1,0,0,0,0|3,0,0]=4 1030 B11R1.23 COC(=O)c1cc(C)ncn1 Amb22233997 [0,1,0,0,0,0|3,0,0]=4 1031 B11R1.23 COC(=O)c1cc(Cl)ncn1 Amb20241221 [0,1,0,0,0,0|3,0,0]=4 1032 B11R1.23 COC(=O)c1cc(F)ncn1 Amb27192376 [0,1,0,0,0,0|3,0,0]=4 1033 B11R1.23 COC(=O)c1cc(N)ncn1 Amb21963300 [0,1,0,0,0,0|3,0,0]=4 1034 B11R1.23 COC(=O)c1cccc(Br)c1 Amb3939648 [0,1,0,0,0,0|3,0,0]=4 1035 B11R1.23 COC(=O)c1cccc(C)c1 Amb2726160 [0,1,0,0,0,0|3,0,0]=4 1036 B11R1.23 COC(=O)c1cccc(Cl)c1 Amb6365788 [0,1,0,0,0,0|3,0,0]=4 1037 B11R1.23 COC(=O)c1cccc(F)c1 Amb2689435 [0,1,0,0,0,0|3,0,0]=4 1038 B11R1.23 COC(=O)c1cccc(I)c1 Amb4009338 [0,1,0,0,0,0|3,0,0]=4 1039 B11R1.23 COC(=O)c1cccc(N)c1 Amb22001392 [0,1,0,0,0,0|3,0,0]=4 1040 B11R1.23 COC(=O)c1cccc(N)c1 Amb6358036 [0,1,0,0,0,0|3,0,0]=4 1041 B11R1.23 COC(=O)c1cccc(O)c1 Amb6355858 [0,1,0,0,0,0|3,0,0]=4 1042 B11R1.23 COC(=O)c1cccc(S)c1 Amb17617595 [0,1,0,0,0,0|3,0,0]=4 1043 B11R1.23 COC(=O)c1ccnc(Br)c1 Amb6565027 [0,1,0,0,0,0|2,0,0]=3 1044 B11R1.23 COC(=O)c1ccnc(Br)n1 Amb21964601 [0,1,0,0,0,0|3,0,0]=4 1045 B11R1.23 COC(=O)c1ccnc(C)c1 Amb19944358 [0,1,0,0,0,0|2,0,0]=3 1046 B11R1.23 COC(=O)c1ccnc(C)c1 Amb35789118 [0,1,0,0,0,0|2,0,0]=3 1047 B11R1.23 COC(=O)c1ccnc(C)n1 Amb20171561 [0,1,0,0,0,0|3,0,0]=4 1048 B11R1.23 COC(=O)c1ccnc(Cl)c1 Amb4477428 [0,1,0,0,0,0|2,0,0]=3 1049 B11R1.23 COC(=O)c1ccnc(Cl)n1 Amb33544512 [0,1,0,0,0,0|3,0,0]=4 1050 B11R1.23 COC(=O)c1ccnc(F)c1 Amb16231929 [0,1,0,0,0,0|2,0,0]=3 1051 B11R1.23 COC(=O)c1ccnc(F)n1 Amb25249346 [0,1,0,0,0,0|3,0,0]=4 1052 B11R1.23 COC(=O)c1ccnc(I)c1 Amb6565067 [0,1,0,0,0,0|2,0,0]=3 1053 B11R1.23 COC(=O)c1ccnc(N)c1 Amb842441 [0,1,0,0,0,0|2,0,0]=3 1054 B11R1.23 COC(=O)c1ccnc(N)n1 Amb22275936 [0,1,0,0,0,0|3,0,0]=4 1055 B11R1.23 COC(=O)c1ccnc(O)c1 Amb22741052 [0,1,0,0,0,0|2,0,0]=3 1056 B11R1.23 COC(=O)c1ccnc(O)c1 Amb35749332 [0,1,0,0,0,0|2,0,0]=3 1057 B11R1.23 COC(=O)c1ccnc(S)c1 Amb2612003 [0,1,0,0,0,0|2,0,0]=3 1058 B11R1.23 COC(=O)c1cnnc(Cl)c1 Amb10604004 [0,1,0,0,0,0|3,0,0]=4 1059 B11R1.23 C[C@@H](CN)c1ccnc(F)c1 Amb33727241 [0,1,0,0,0,0|2,0,1]=4 1060 B11R1.23 C[C@H](CN)c1ccnc(F)c1 Amb33738150 [0,1,0,0,0,0|2,0,1]=4 1061 B11R1.23 C[n+]1cccc(C(=O)CN)c1 Amb27429107 [0,1,0,0,0,0|3,0,0]=4 1062 B11R1.23 C[n+]1cccc(C(=O)N[O-])c1 Amb27423573 [0,1,0,0,0,0|3,0,0]=4 1063 B11R1.23 C\C(=N/N)c1cccc(O)c1 Amb24484530 [0,1,0,0,0,0|2,0,1]=4 1064 B11R1.23 C\C(=N\N)c1cccc(Cl)c1 Amb27425260 [0,1,0,0,0,0|2,0,1]=4 1065 B11R1.23 C\C(=N\N)c1ccnc(C)n1 Amb27457584 [0,1,0,0,0,0|2,0,1]=4 1066 B11R1.23 C\C(=N\O)c1ccnc(F)c1 Amb27453095 [0,1,0,0,0,0|2,0,1]=4 1067 B11R1.23 C\C(=N\O)c1ccnc(N)c1 Amb27659327 [0,1,0,0,0,0|2,0,1]=4 1068 B11R1.23 Cc1cc(C(=O)CBr)ccn1 Amb27842062 [0,1,0,0,0,0|2,0,0]=3 1069 B11R1.23 Cc1cc(C(=O)CCl)ccn1 Amb24605579 [0,1,0,0,0,0|2,0,0]=3 1070 B11R1.23 Cc1cc(C(=O)CN)ccn1 Amb24106014 [0,1,0,0,0,0|1,0,0]=2 1071 B11R1.23 Cc1cc(C(=O)NN)ccn1 Amb26887393 [0,1,0,0,0,0|0,0,0]=1 1072 B11R1.23 Cc1cc(C(=O)NO)ncn1 Amb28127312 [0,1,0,0,0,0|2,0,0]=3 1073 B11R1.23 Cc1cc(C(C)CN)ccn1 Amb18201826 [0,1,0,0,0,0|2,0,1]=4 1074 B11R1.23 Cc1cc(C(C)NN)ccn1 Amb27405269 [0,1,0,0,0,0|1,0,1]=3 1075 B11R1.23 Cc1cc(C(C)ON)ccn1 Amb32732952 [0,1,0,0,0,0|2,0,1]=4 1076 B11R1.23 Cc1cc(C(F)CN)ccn1 Amb32732968 [0,1,0,0,0,0|2,0,1]=4 1077 B11R1.23 Cc1cc(C(O)CN)ccn1 Amb33268552 [0,1,0,0,0,0|1,0,2]=4 1078 B11R1.23 Cc1cc([C@@H](O)CN)ccn1 Amb32732966 [0,1,0,0,0,0|1,0,2]=4 1079 B11R1.23 Cc1cc([C@H](O)CN)ccn1 Amb32732965 [0,1,0,0,0,0|1,0,2]=4 1080 B11R1.23 Cc1cc(\C(N)=N\O)ccn1 Amb24358402 [0,1,0,0,0,0|2,0,1]=4 1081 B11R1.23 Cc1cccc(C(=O)C#N)c1 Amb17231995 [0,1,0,0,0,0|2,0,1]=4 1082 B11R1.23 Cc1cccc(C(=O)C=O)c1 Amb24055227 [0,1,0,0,0,0|3,0,0]=4 1083 B11R1.23 Cc1cccc(C(=O)CBr)c1 Amb5395410 [0,1,0,0,0,0|3,0,0]=4 1084 B11R1.23 Cc1cccc(C(=O)CCl)c1 Amb18806064 [0,1,0,0,0,0|3,0,0]=4 1085 B11R1.23 Cc1cccc(C(=O)CF)c1 Amb24084129 [0,1,0,0,0,0|3,0,0]=4 1086 B11R1.23 Cc1cccc(C(=O)CN)c1 Amb10976904 [0,1,0,0,0,0|2,0,0]=3 1087 B11R1.23 Cc1cccc(C(=O)CN)c1 Amb20171473 [0,1,0,0,0,0|2,0,0]=3 1088 B11R1.23 Cc1cccc(C(=O)CN)n1 Amb25152776 [0,1,0,0,0,0|3,0,0]=4 1089 B11R1.23 Cc1cccc(C(=O)CO)c1 Amb18182731 [0,1,0,0,0,0|3,0,0]=4 1090 B11R1.23 Cc1cccc(C(=O)NN)c1 Amb6336466 [0,1,0,0,0,0|1,0,0]=2 1091 B11R1.23 Cc1cccc(C(=O)NN)n1 Amb33543348 [0,1,0,0,0,0|2,0,0]=3 1092 B11R1.23 Cc1cccc(C(=O)NO)c1 Amb6258947 [0,1,0,0,0,0|2,0,0]=3 1093 B11R1.23 Cc1cccc(C(=O)NO)n1 Amb6272417 [0,1,0,0,0,0|3,0,0]=4 1094 B11R1.23 Cc1cccc(C(C)NN)c1 Amb18787419 [0,1,0,0,0,0|2,0,1]=4 1095 B11R1.23 Cc1cccc(\C(N)=N\N)c1 Amb25282227 [0,1,0,0,0,0|2,0,1]=4 1096 B11R1.23 Cc1ccnc(C(=O)CN)c1 Amb24564185 [0,1,0,0,0,0|3,0,0]=4 1097 B11R1.23 Cc1cncc(C(=O)CN)c1 Amb25800562 [0,1,0,0,0,0|3,0,0]=4 1098 B11R1.23 Cc1cncc(C(=O)NN)c1 Amb2752934 [0,1,0,0,0,0|2,0,0]=3 1099 B11R1.23 Cc1cncc(C(=O)NO)c1 Amb28365484 [0,1,0,0,0,0|3,0,0]=4 1100 B11R1.23 Cc1nccc(C(=O)CBr)n1 Amb27964575 [0,1,0,0,0,0|3,0,0]=4 1101 B11R1.23 Cc1nccc(C(=O)NN)n1 Amb22345830 [0,1,0,0,0,0|1,0,0]=2 1102 B11R1.23 N#CC(=O)c1cccc(Br)c1 Amb22269768 [0,1,0,0,0,0|2,0,1]=4 1103 B11R1.23 N#CC(=O)c1cccc(Cl)c1 Amb6297070 [0,1,0,0,0,0|2,0,1]=4 1104 B11R1.23 N#CC(=O)c1cccc(F)c1 Amb17232049 [0,1,0,0,0,0|2,0,1]=4 1105 B11R1.23 N=C(NN)c1cc(Br)ccn1 Amb19515738 [0,1,0,0,0,0|3,0,0]=4 1106 B11R1.23 N=C(NN)c1cc(Cl)ccn1 Amb19515661 [0,1,0,0,0,0|3,0,0]=4 1107 B11R1.23 N=C(NN)c1cc(F)ccn1 Amb19515737 [0,1,0,0,0,0|3,0,0]=4 1108 B11R1.23 N=C(NN)c1cccc(Br)n1 Amb25208808 [0,1,0,0,0,0|3,0,0]=4 1109 B11R1.23 N=C(NN)c1ccnc(Cl)c1 Amb10975619 [0,1,0,0,0,0|1,0,0]=2 1110 B11R1.23 NCC(=O)c1cc(Cl)ccn1 Amb28197150 [0,1,0,0,0,0|3,0,0]=4 1111 B11R1.23 NCC(=O)c1cc(F)ccn1 Amb33415311 [0,1,0,0,0,0|3,0,0]=4 1112 B11R1.23 NCC(=O)c1cc(N)ccn1 Amb27490821 [0,1,0,0,0,0|3,0,0]=4 1113 B11R1.23 NCC(=O)c1cccc(Br)c1 Amb18281391 [0,1,0,0,0,0|2,0,0]=3 1114 B11R1.23 NCC(=O)c1cccc(Br)c1 Amb2693526 [0,1,0,0,0,0|2,0,0]=3 1115 B11R1.23 NCC(=O)c1cccc(Br)n1 Amb25864894 [0,1,0,0,0,0|3,0,0]=4 1116 B11R1.23 NCC(=O)c1cccc(Cl)c1 Amb18951219 [0,1,0,0,0,0|2,0,0]=3 1117 B11R1.23 NCC(=O)c1cccc(Cl)c1 Amb2693527 [0,1,0,0,0,0|2,0,0]=3 1118 B11R1.23 NCC(=O)c1cccc(Cl)n1 Amb33223300 [0,1,0,0,0,0|3,0,0]=4 1119 B11R1.23 NCC(=O)c1cccc(F)c1 Amb10840040 [0,1,0,0,0,0|2,0,0]=3 1120 B11R1.23 NCC(=O)c1cccc(F)c1 Amb18951218 [0,1,0,0,0,0|2,0,0]=3 1121 B11R1.23 NCC(=O)c1cccc(N)c1 Amb27209101 [0,1,0,0,0,0|2,0,0]=3 1122 B11R1.23 NCC(=O)c1cccc(O)c1 Amb17593761 [0,1,0,0,0,0|2,0,0]=3 1123 B11R1.23 NCC(=O)c1cccc(O)c1 Amb33801517 [0,1,0,0,0,0|2,0,0]=3 1124 B11R1.23 NCC(=O)c1ccnc(Br)c1 Amb28421879 [0,1,0,0,0,0|1,0,0]=2 1125 B11R1.23 NCC(=O)c1cncc(Br)c1 Amb23586097 [0,1,0,0,0,0|3,0,0]=4 1126 B11R1.23 NCC(=O)c1cncc(Br)c1 Amb30584758 [0,1,0,0,0,0|3,0,0]=4 1127 B11R1.23 NCC(=O)c1cncc(F)c1 Amb27170605 [0,1,0,0,0,0|3,0,0]=4 1128 B11R1.23 NCC(=O)c1cncc(O)c1 Amb26339346 [0,1,0,0,0,0|3,0,0]=4 1129 B11R1.23 NCC(=O)c1cncc(O)c1 Amb33096750 [0,1,0,0,0,0|3,0,0]=4 1130 B11R1.23 NCC(N)c1ccnc(F)c1 Amb27831976 [0,1,0,0,0,0|2,0,1]=4 1131 B11R1.23 NCC(N)c1ccnc(N)c1 Amb27170631 [0,1,0,0,0,0|2,0,1]=4 1132 B11R1.23 NCC(N)c1ccnc(O)c1 Amb27975800 [0,1,0,0,0,0|2,0,1]=4 1133 B11R1.23 NCC(O)c1ccnc(N)c1 Amb27839930 [0,1,0,0,0,0|1,0,2]=4 1134 B11R1.23 NCC(O)c1ccnc(O)c1 Amb27624406 [0,1,0,0,0,0|1,0,2]=4 1135 B11R1.23 NC[C@H](N)c1ccnc(Cl)c1 Amb27455842 [0,1,0,0,0,0|2,0,1]=4 1136 B11R1.23 NNC(=O)C1=CC(=O)NC=C1 Amb24066779 [0,1,0,0,0,0|0,0,1]=2 1137 B11R1.23 NNC(=O)C1=CC=CC(=O)N1 Amb27963703 [0,1,0,0,0,0|2,0,0]=3 1138 B11R1.23 NNC(=O)C1=NC(=O)NC=C1 Amb22499755 [0,1,0,0,0,0|1,0,1]=3 1139 B11R1.23 NNC(=O)c1c[n+]([O-])ccn1 Amb27154796 [0,1,0,0,0,0|3,0,0]=4 1140 B11R1.23 NNC(=O)c1cc(Br)ccn1 Amb22500472 [0,1,0,0,0,0|2,0,0]=3 1141 B11R1.23 NNC(=O)c1cc(Cl)ccn1 Amb3318875 [0,1,0,0,0,0|2,0,0]=3 1142 B11R1.23 NNC(=O)c1cc(Cl)ncn1 Amb27813366 [0,1,0,0,0,0|1,0,0]=2 1143 B11R1.23 NNC(=O)c1cc(S)ncn1 Amb2747592 [0,1,0,0,0,0|1,0,0]=2 1144 B11R1.23 NNC(=O)c1ccc[n+]([O-])c1 Amb22522544 [0,1,0,0,0,0|2,0,0]=3 1145 B11R1.23 NNC(=O)c1cccc(Br)c1 Amb1906809 [0,1,0,0,0,0|1,0,0]=2 1146 B11R1.23 NNC(=O)c1cccc(Br)n1 Amb25801935 [0,1,0,0,0,0|2,0,0]=3 1147 B11R1.23 NNC(=O)c1cccc(Cl)c1 Amb1207384 [0,1,0,0,0,0|1,0,0]=2 1148 B11R1.23 NNC(=O)c1cccc(Cl)n1 Amb33529840 [0,1,0,0,0,0|2,0,0]=3 1149 B11R1.23 NNC(=O)c1cccc(F)c1 Amb1129033 [0,1,0,0,0,0|1,0,0]=2 1150 B11R1.23 NNC(=O)c1cccc(F)n1 Amb28457230 [0,1,0,0,0,0|2,0,0]=3 1151 B11R1.23 NNC(=O)c1cccc(F)n1 Amb32667865 [0,1,0,0,0,0|2,0,0]=3 1152 B11R1.23 NNC(=O)c1cccc(I)c1 Amb6402804 [0,1,0,0,0,0|1,0,0]=2 1153 B11R1.23 NNC(=O)c1cccc(I)n1 Amb6565085 [0,1,0,0,0,0|2,0,0]=3 1154 B11R1.23 NNC(=O)c1cccc(N)c1 Amb2712415 [0,1,0,0,0,0|1,0,0]=2 1155 B11R1.23 NNC(=O)c1cccc(N)n1 Amb24071879 [0,1,0,0,0,0|2,0,0]=3 1156 B11R1.23 NNC(=O)c1cccc(O)c1 Amb1208719 [0,1,0,0,0,0|1,0,0]=2 1157 B11R1.23 NNC(=O)c1ccnc(Br)c1 Amb22236121 [0,1,0,0,0,0|0,0,0]=1 1158 B11R1.23 NNC(=O)c1ccnc(Cl)c1 Amb3429829 [0,1,0,0,0,0|0,0,0]=1 1159 B11R1.23 NNC(=O)c1ccnc(N)c1 Amb2697294 [0,1,0,0,0,0|0,0,0]=1 1160 B11R1.23 NNC(=O)c1cncc(Br)c1 Amb1789856 [0,1,0,0,0,0|2,0,0]=3 1161 B11R1.23 NNC(=O)c1cncc(Cl)c1 Amb24679938 [0,1,0,0,0,0|2,0,0]=3 1162 B11R1.23 NNC(=O)c1cncc(Cl)n1 Amb27466725 [0,1,0,0,0,0|3,0,0]=4 1163 B11R1.23 NNC(=O)c1cncc(F)c1 Amb28050807 [0,1,0,0,0,0|2,0,0]=3 1164 B11R1.23 NNC(=O)c1cncc(I)c1 Amb28382925 [0,1,0,0,0,0|2,0,0]=3 1165 B11R1.23 NNC(=O)c1cncc(N)c1 Amb25112233 [0,1,0,0,0,0|2,0,0]=3 1166 B11R1.23 NNC(=O)c1cncc(O)c1 Amb576575 [0,1,0,0,0,0|2,0,0]=3 1167 B11R1.23 NNC(=O)c1nccc(Br)n1 Amb25147853 [0,1,0,0,0,0|3,0,0]=4 1168 B11R1.23 NNC(=S)c1cccc(F)c1 Amb27455353 [0,1,0,0,0,0|1,1,0]=3 1169 B11R1.23 N\C(=N/O)c1ccnc(Cl)c1 Amb20527641 [0,1,0,0,0,0|2,0,1]=4 1170 B11R1.23 N\C(=N\O)c1ccnc(Cl)c1 Amb10975614 [0,1,0,0,0,0|2,0,1]=4 1171 B11R1.23 N\C(=N\O)c1ccnc(F)c1 Amb25764540 [0,1,0,0,0,0|2,0,1]=4 1172 B11R1.23 N\C(=N\O)c1ccnc(S)c1 Amb25127400 [0,1,0,0,0,0|2,0,1]=4 1173 B11R1.23 N\N=C(\N)C1=CC(=O)NC=C1 Amb28460663 [0,1,0,0,0,0|1,0,2]=4 1174 B11R1.23 N\N=C(\N)c1cccc(Br)c1 Amb25304357 [0,1,0,0,0,0|2,0,1]=4 1175 B11R1.23 N\N=C(\N)c1cccc(F)c1 Amb18177247 [0,1,0,0,0,0|2,0,1]=4 1176 B11R1.23 Nc1cc(C(=O)CBr)ccn1 Amb20670962 [0,1,0,0,0,0|2,0,0]=3 1177 B11R1.23 Nc1cc(C(=O)CBr)ncn1 Amb18132083 [0,1,0,0,0,0|3,0,0]=4 1178 B11R1.23 Nc1cccc(C(=O)CCl)c1 Amb27613503 [0,1,0,0,0,0|3,0,0]=4 1179 B11R1.23 Nc1cccc(C(=O)NO)n1 Amb28067146 [0,1,0,0,0,0|3,0,0]=4 1180 B11R1.23 O=C(CBr)c1cc(Cl)ncn1 Amb26456870 [0,1,0,0,0,0|3,0,0]=4 1181 B11R1.23 O=C(CBr)c1cccc(Br)c1 Amb2685384 [0,1,0,0,0,0|3,0,0]=4 1182 B11R1.23 O=C(CBr)c1cccc(Cl)c1 Amb1224657 [0,1,0,0,0,0|3,0,0]=4 1183 B11R1.23 O=C(CBr)c1cccc(F)c1 Amb33533061 [0,1,0,0,0,0|3,0,0]=4 1184 B11R1.23 O=C(CBr)c1cccc(I)c1 Amb1885036 [0,1,0,0,0,0|3,0,0]=4 1185 B11R1.23 O=C(CBr)c1cccc(O)c1 Amb1981340 [0,1,0,0,0,0|3,0,0]=4 1186 B11R1.23 O=C(CBr)c1ccnc(Cl)c1 Amb21964312 [0,1,0,0,0,0|2,0,0]=3 1187 B11R1.23 O=C(CBr)c1ccnc(Cl)c1 Amb6572113 [0,1,0,0,0,0|2,0,0]=3 1188 B11R1.23 O=C(CBr)c1ccnc(Cl)n1 Amb22750489 [0,1,0,0,0,0|3,0,0]=4 1189 B11R1.23 O=C(CBr)c1ccnc(F)c1 Amb27480331 [0,1,0,0,0,0|2,0,0]=3 1190 B11R1.23 O=C(CBr)c1ccnc(F)c1 Amb33483993 [0,1,0,0,0,0|2,0,0]=3 1191 B11R1.23 O=C(CCl)c1cccc(Br)c1 Amb17345812 [0,1,0,0,0,0|3,0,0]=4 1192 B11R1.23 O=C(CCl)c1cccc(Cl)c1 Amb8393232 [0,1,0,0,0,0|3,0,0]=4 1193 B11R1.23 O=C(CCl)c1cccc(F)c1 Amb10873159 [0,1,0,0,0,0|3,0,0]=4 1194 B11R1.23 O=C(CCl)c1ccnc(Cl)c1 Amb25101602 [0,1,0,0,0,0|2,0,0]=3 1195 B11R1.23 O=C(CF)c1cccc(Br)c1 Amb27786161 [0,1,0,0,0,0|3,0,0]=4 1196 B11R1.23 O=C(CF)c1cccc(Cl)c1 Amb25714827 [0,1,0,0,0,0|3,0,0]=4 1197 B11R1.23 O=C(CF)c1cccc(F)c1 Amb23454840 [0,1,0,0,0,0|3,0,0]=4 1198 B11R1.23 O=C(CI)c1cccc(F)c1 Amb33483673 [0,1,0,0,0,0|3,0,0]=4 1199 B11R1.23 O=C(CO)c1cccc(Br)c1 Amb24579747 [0,1,0,0,0,0|3,0,0]=4 1200 B11R1.23 O=C(CO)c1cccc(Cl)c1 Amb18185666 [0,1,0,0,0,0|3,0,0]=4 1201 B11R1.23 O=C(CO)c1cccc(F)c1 Amb18182894 [0,1,0,0,0,0|3,0,0]=4 1202 B11R1.23 O=C(CO)c1cccc(I)c1 Amb33623872 [0,1,0,0,0,0|3,0,0]=4 1203 B11R1.23 O=C(NO)c1cc(Cl)ccn1 Amb26351747 [0,1,0,0,0,0|3,0,0]=4 1204 B11R1.23 O=C(NO)c1cccc(Br)c1 Amb6275747 [0,1,0,0,0,0|2,0,0]=3 1205 B11R1.23 O=C(NO)c1cccc(Cl)c1 Amb6265167 [0,1,0,0,0,0|2,0,0]=3 1206 B11R1.23 O=C(NO)c1cccc(Cl)n1 Amb25187424 [0,1,0,0,0,0|3,0,0]=4 1207 B11R1.23 O=C(NO)c1cccc(F)c1 Amb6267435 [0,1,0,0,0,0|2,0,0]=3 1208 B11R1.23 O=C(NO)c1cccc(F)n1 Amb28400271 [0,1,0,0,0,0|3,0,0]=4 1209 B11R1.23 O=C(NO)c1cccc(O)c1 Amb6270436 [0,1,0,0,0,0|2,0,0]=3 1210 B11R1.23 O=C(NO)c1ccnc(Cl)c1 Amb25122516 [0,1,0,0,0,0|1,0,0]=2 1211 B11R1.23 O=C(NO)c1ccnc(F)c1 Amb25848316 [0,1,0,0,0,0|1,0,0]=2 1212 B11R1.23 O=C(NO)c1cncc(Br)c1 Amb7756051 [0,1,0,0,0,0|3,0,0]=4 1213 B11R1.23 O=C(NO)c1cncc(Cl)c1 Amb26338113 [0,1,0,0,0,0|3,0,0]=4 1214 B11R1.23 O=C(NO)c1cncc(F)c1 Amb24486835 [0,1,0,0,0,0|3,0,0]=4 1215 B11R1.23 O=C(NO)c1cncc(O)c1 Amb27479252 [0,1,0,0,0,0|3,0,0]=4 1216 B11R1.23 O=C(OO)c1cccc(Cl)c1 Amb6365645 [0,1,0,0,0,0|3,0,0]=4 1217 B11R1.23 O=C1C=CC=C(C(=O)NO)N1 Amb28285969 [0,1,0,0,0,0|3,0,0]=4 1218 B11R1.23 O=CC(=O)c1cccc(Br)c1 Amb10067951 [0,1,0,0,0,0|3,0,0]=4 1219 B11R1.23 O=CC(=O)c1cccc(Br)c1 Amb20671217 [0,1,0,0,0,0|3,0,0]=4 1220 B11R1.23 O=CC(=O)c1cccc(Cl)c1 Amb10067952 [0,1,0,0,0,0|3,0,0]=4 1221 B11R1.23 O=CC(=O)c1cccc(Cl)c1 Amb18126569 [0,1,0,0,0,0|3,0,0]=4 1222 B11R1.23 O=CC(=O)c1cccc(F)c1 Amb10605526 [0,1,0,0,0,0|3,0,0]=4 1223 B11R1.23 O=CC(=O)c1cccc(F)c1 Amb10982490 [0,1,0,0,0,0|3,0,0]=4 1224 B11R1.23 O=CC(=O)c1cccc(O)c1 Amb18125054 [0,1,0,0,0,0|3,0,0]=4 1225 B11R1.36 C=C(Br)C(=O)c1ccccc1 Amb25208336 [0,1,0,0,0,0|3,0,0]=4 1226 B11R1.36 C=C(C(=O)O)c1ccncc1 Amb26880206 [0,1,0,0,0,0|3,0,0]=4 1227 B11R1.36 C=C(C(C)=O)c1ccncc1 Amb27955060 [0,1,0,0,0,0|3,0,0]=4 1228 B11R1.36 C=C(C)C(=O)c1ccccc1 Amb17593661 [0,1,0,0,0,0|3,0,0]=4 1229 B11R1.36 C=C(C)C(=O)c1ccncc1 Amb24413658 [0,1,0,0,0,0|2,0,0]=3 1230 B11R1.36 C=C(Cl)C(=O)c1ccccc1 Amb28075337 [0,1,0,0,0,0|3,0,0]=4 1231 B11R1.36 CC(=O)C(=O)c1ccccc1 Amb2099500 [0,1,0,0,0,0|3,0,0]=4 1232 B11R1.36 CC(=O)C(=O)c1ccncc1 Amb26074229 [0,1,0,0,0,0|2,0,0]=3 1233 B11R1.36 CC(Br)C(=O)c1ccccc1 Amb9732279 [0,1,0,0,0,0|3,0,0]=4 1234 B11R1.36 CC(C)C(=O)c1ccccc1 Amb4605986 [0,1,0,0,0,0|3,0,0]=4 1235 B11R1.36 CC(C)C(=O)c1ccncc1 Amb19374024 [0,1,0,0,0,0|2,0,0]=3 1236 B11R1.36 CC(Cl)C(=O)c1ccccc1 Amb477908 [0,1,0,0,0,0|3,0,0]=4 1237 B11R1.36 CC(F)C(=O)c1ccccc1 Amb10603603 [0,1,0,0,0,0|3,0,0]=4 1238 B11R1.36 CC(N)C(=O)c1ccccc1 Amb6543419 [0,1,0,0,0,0|2,0,0]=3 1239 B11R1.36 CC(N)C(=O)c1ccccn1 Amb18201931 [0,1,0,0,0,0|3,0,0]=4 1240 B11R1.36 CC(N)C(=O)c1cccnc1 Amb18201928 [0,1,0,0,0,0|3,0,0]=4 1241 B11R1.36 CC(N)C(=O)c1ccncc1 Amb18201927 [0,1,0,0,0,0|1,0,0]=2 1242 B11R1.36 CC(N)C(=O)c1ccncn1 Amb33269323 [0,1,0,0,0,0|2,0,0]=3 1243 B11R1.36 CC(N)C(C)c1ccncc1 Amb18201858 [0,1,0,0,0,0|2,0,1]=4 1244 B11R1.36 CC(N)C(N)c1ccncc1 Amb13953208 [0,1,0,0,0,0|2,0,1]=4 1245 B11R1.36 CC(N)C(O)c1ccncc1 Amb19373096 [0,1,0,0,0,0|1,0,2]=4 1246 B11R1.36 CC(N)C(O)c1ccncc1 Amb6740242 [0,1,0,0,0,0|1,0,2]=4 1247 B11R1.36 CC(O)C(=O)c1ccccc1 Amb18799361 [0,1,0,0,0,0|3,0,0]=4 1248 B11R1.36 CC(O)C(=O)c1ccncc1 Amb28367025 [0,1,0,0,0,0|2,0,0]=3 1249 B11R1.36 CC(S)C(=O)c1ccccc1 Amb25142605 [0,1,0,0,0,0|3,0,0]=4 1250 B11R1.36 CN(C)C(=N)c1ccccc1 Amb23447126 [0,1,0,0,0,0|3,0,0]=4 1251 B11R1.36 CN(C)C(=O)c1ccccc1 Amb33513268 [0,1,0,0,0,0|2,0,0]=3 1252 B11R1.36 CN(C)C(=O)c1ccccc1 Amb3886594 [0,1,0,0,0,0|2,0,0]=3 1253 B11R1.36 CN(C)C(=O)c1cccnc1 Amb3886597 [0,1,0,0,0,0|3,0,0]=4 1254 B11R1.36 CN(C)C(=O)c1ccncc1 Amb8343640 [0,1,0,0,0,0|1,0,0]=2 1255 B11R1.36 CN(C)C(=S)c1ccccc1 Amb2733763 [0,1,0,0,0,0|2,1,0]=4 1256 B11R1.36 CN(C)C(=S)c1ccncc1 Amb26425514 [0,1,0,0,0,0|1,1,0]=3 1257 B11R1.36 CN(N)C(=N)c1ccccc1 Amb10870953 [0,1,0,0,0,0|2,0,0]=3 1258 B11R1.36 CN(N)C(=O)c1ccccc1 Amb18125146 [0,1,0,0,0,0|1,0,0]=2 1259 B11R1.36 CN(N)C(=O)c1ccccn1 Amb27238080 [0,1,0,0,0,0|2,0,0]=3 1260 B11R1.36 CN(N)C(=O)c1cccnc1 Amb839670 [0,1,0,0,0,0|2,0,0]=3 1261 B11R1.36 CN(N)C(=S)c1ccccc1 Amb26880376 [0,1,0,0,0,0|1,1,0]=3 1262 B11R1.36 CN(O)C(=O)c1ccccc1 Amb25082592 [0,1,0,0,0,0|2,0,0]=3 1263 B11R1.36 CN(O)C(=O)c1ccccn1 Amb10572675 [0,1,0,0,0,0|3,0,0]=4 1264 B11R1.36 CN(O)C(=O)c1ccncc1 Amb27949143 [0,1,0,0,0,0|1,0,0]=2 1265 B11R1.36 C[C@@H](Br)C(=O)c1ccccc1 Amb27176347 [0,1,0,0,0,0|3,0,0]=4 1266 B11R1.36 C[C@@H](N)C(=O)c1ccccc1 Amb25757602 [0,1,0,0,0,0|2,0,0]=3 1267 B11R1.36 C[C@@H](N)C(=O)c1cccnc1 Amb30024811 [0,1,0,0,0,0|3,0,0]=4 1268 B11R1.36 C[C@@H](N)[C@@H](O)c1ccncc1 Amb27882675 [0,1,0,0,0,0|1,0,2]=4 1269 B11R1.36 C[C@H](Br)C(=O)c1ccccc1 Amb25689646 [0,1,0,0,0,0|3,0,0]=4 1270 B11R1.36 C[C@H](N)C(=O)c1cccnc1 Amb33131781 [0,1,0,0,0,0|3,0,0]=4 1271 B11R1.36 C[C@H](N)[C@@H](N)c1ccncc1 Amb28075271 [0,1,0,0,0,0|2,0,1]=4 1272 B11R1.36 C[C@H](N)[C@H](O)c1ccncc1 Amb27430303 [0,1,0,0,0,0|1,0,2]=4 1273 B11R1.36 C\C(c1ccncc1)=[N+](/C)[O-] Amb25348488 [0,1,0,0,0,0|2,0,1]=4 1274 B11R1.36 N=C(N)C(=O)c1ccccc1 Amb27654024 [0,1,0,0,0,0|2,0,0]=3 1275 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [0,1,0,0,0,0|2,0,0]=3 1276 B11R1.36 NC(=O)C(=O)c1cccnc1 Amb18063199 [0,1,0,0,0,0|3,0,0]=4 1277 B11R1.36 NC(=O)C(N)c1ccncc1 Amb17334313 [0,1,0,0,0,0|2,0,1]=4 1278 B11R1.36 NC(=O)C(O)c1ccncc1 Amb25783931 [0,1,0,0,0,0|1,0,2]=4 1279 B11R1.36 NC(=S)C(=O)c1ccccc1 Amb6892994 [0,1,0,0,0,0|2,0,0]=3 1280 B11R1.36 N[NH+]([O-])C(=O)c1ccccn1 Amb27660762 [0,1,0,0,0,0|2,0,1]=4 1281 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb2611302 [0,1,0,0,0,0|3,0,0]=4 1282 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb33204525 [0,1,0,0,0,0|3,0,0]=4 1283 B11R1.36 O=C(O)C(=O)c1ccncn1 Amb33269065 [0,1,0,0,0,0|3,0,0]=4 1284 B11R1.36 O=C(O)C(=O)c1ccnnc1 Amb28189420 [0,1,0,0,0,0|3,0,0]=4 1285 B11R1.36 O=C([O-])C(=O)c1ccccc1 Amb33204524 [0,1,0,0,0,0|3,0,0]=4 1286 B11R1.36 O=C(c1ccccc1)C(Br)Br Amb17940392 [0,1,0,0,0,0|3,0,0]=4 1287 B11R1.36 O=C(c1ccccc1)C(Cl)Cl Amb8513102 [0,1,0,0,0,0|3,0,0]=4 1288 B11R1.36 O=C(c1ccccc1)C(F)Br Amb24104059 [0,1,0,0,0,0|3,0,0]=4 1289 B11R1.36 O=C(c1ccccc1)C(F)F Amb9826858 [0,1,0,0,0,0|3,0,0]=4 1290 B11R1.36 O=C(c1ccccc1)C(O)Cl Amb24528115 [0,1,0,0,0,0|3,0,0]=4 1291 B11R1.36 O=C(c1ccccc1)C(O)O Amb8392241 [0,1,0,0,0,0|3,0,0]=4 1292 B11R1.36 O=C(c1ccncc1)C(F)F Amb22388666 [0,1,0,0,0,0|2,0,0]=3 1293 B11R1.36 O=C(c1ccncn1)C(F)F Amb33410091 [0,1,0,0,0,0|3,0,0]=4 1294 B11R1.222 C#CC(=O)c1ccccc1Br Amb27391927 [0,1,0,0,0,0|3,0,0]=4 1295 B11R1.222 C#CC(=O)c1ccccc1C Amb28399059 [0,1,0,0,0,0|3,0,0]=4 1296 B11R1.222 C#CC(=O)c1ccccc1Cl Amb25872974 [0,1,0,0,0,0|3,0,0]=4 1297 B11R1.222 C#CC(=O)c1ccccc1F Amb27868130 [0,1,0,0,0,0|3,0,0]=4 1298 B11R1.222 C#CC(=O)c1ccccc1N Amb24351123 [0,1,0,0,0,0|3,0,0]=4 1299 B11R1.222 C#CC(=O)c1ncncc1Br Amb27476580 [0,1,0,0,0,0|3,0,0]=4 1300 B11R1.222 C=C(CBr)c1ccncc1Br Amb33388682 [0,1,0,0,0,0|3,0,0]=4 1301 B11R1.222 C=C(CBr)c1ccncc1C Amb33334072 [0,1,0,0,0,0|3,0,0]=4 1302 B11R1.222 C=C(CBr)c1ccncc1Cl Amb33336343 [0,1,0,0,0,0|3,0,0]=4 1303 B11R1.222 C=C(CBr)c1ccncc1F Amb33388766 [0,1,0,0,0,0|3,0,0]=4 1304 B11R1.222 C=C(CCl)c1ccncc1Br Amb33388685 [0,1,0,0,0,0|3,0,0]=4 1305 B11R1.222 C=C(CCl)c1ccncc1Cl Amb33413793 [0,1,0,0,0,0|3,0,0]=4 1306 B11R1.222 C=C(CCl)c1ccncc1F Amb33261742 [0,1,0,0,0,0|3,0,0]=4 1307 B11R1.222 C=C(CN)c1ccccc1Br Amb33388495 [0,1,0,0,0,0|3,0,0]=4 1308 B11R1.222 C=C(CN)c1ccccc1C Amb18251307 [0,1,0,0,0,0|3,0,0]=4 1309 B11R1.222 C=C(CN)c1ccccc1Cl Amb18251924 [0,1,0,0,0,0|3,0,0]=4 1310 B11R1.222 C=C(CN)c1ccccc1F Amb18908418 [0,1,0,0,0,0|3,0,0]=4 1311 B11R1.222 C=C(CN)c1ccccc1O Amb33196166 [0,1,0,0,0,0|3,0,0]=4 1312 B11R1.222 C=C(CN)c1ccncc1Br Amb33388640 [0,1,0,0,0,0|2,0,0]=3 1313 B11R1.222 C=C(CN)c1ccncc1C Amb33424629 [0,1,0,0,0,0|2,0,0]=3 1314 B11R1.222 C=C(CN)c1ccncc1Cl Amb33413764 [0,1,0,0,0,0|2,0,0]=3 1315 B11R1.222 C=C(CN)c1ccncc1F Amb33317174 [0,1,0,0,0,0|2,0,0]=3 1316 B11R1.222 C=C(NN)c1ccccc1O Amb28351595 [0,1,0,0,0,0|2,0,0]=3 1317 B11R1.222 C=CC(=O)c1ccccc1Br Amb26333627 [0,1,0,0,0,0|3,0,0]=4 1318 B11R1.222 C=CC(=O)c1ccccc1C Amb28144593 [0,1,0,0,0,0|3,0,0]=4 1319 B11R1.222 C=CC(=O)c1ccccc1Cl Amb25307612 [0,1,0,0,0,0|3,0,0]=4 1320 B11R1.222 C=CC(=O)c1ccccc1F Amb27883395 [0,1,0,0,0,0|3,0,0]=4 1321 B11R1.222 C=CC(=O)c1ccccc1N Amb26987473 [0,1,0,0,0,0|3,0,0]=4 1322 B11R1.222 C=CC(=O)c1ccccc1O Amb17593686 [0,1,0,0,0,0|3,0,0]=4 1323 B11R1.222 C=CC(=O)c1ccncc1Br Amb27442812 [0,1,0,0,0,0|2,0,0]=3 1324 B11R1.222 C=CC(=O)c1ccncc1C Amb26501413 [0,1,0,0,0,0|2,0,0]=3 1325 B11R1.222 C=CC(=O)c1ccncc1Cl Amb25893372 [0,1,0,0,0,0|2,0,0]=3 1326 B11R1.222 C=CC(=O)c1ccncc1F Amb26079030 [0,1,0,0,0,0|2,0,0]=3 1327 B11R1.222 CC(CN)c1ccncc1Br Amb33389527 [0,1,0,0,0,0|2,0,1]=4 1328 B11R1.222 CC(CN)c1ccncc1Cl Amb33413506 [0,1,0,0,0,0|2,0,1]=4 1329 B11R1.222 CC(CN)c1ccncc1F Amb25677090 [0,1,0,0,0,0|2,0,1]=4 1330 B11R1.222 CC(NN)c1ccncc1Cl Amb27868198 [0,1,0,0,0,0|1,0,1]=3 1331 B11R1.222 CC(ON)c1ccncc1Br Amb33388683 [0,1,0,0,0,0|2,0,1]=4 1332 B11R1.222 CC(ON)c1ccncc1Cl Amb33413774 [0,1,0,0,0,0|2,0,1]=4 1333 B11R1.222 CC(ON)c1ccncc1F Amb33317191 [0,1,0,0,0,0|2,0,1]=4 1334 B11R1.222 CCC(=O)c1ccccc1Br Amb17339933 [0,1,0,0,0,0|3,0,0]=4 1335 B11R1.222 CCC(=O)c1ccccc1C Amb16185657 [0,1,0,0,0,0|3,0,0]=4 1336 B11R1.222 CCC(=O)c1ccccc1Cl Amb17198735 [0,1,0,0,0,0|3,0,0]=4 1337 B11R1.222 CCC(=O)c1ccccc1F Amb4605916 [0,1,0,0,0,0|3,0,0]=4 1338 B11R1.222 CCC(=O)c1ccccc1I Amb26353010 [0,1,0,0,0,0|3,0,0]=4 1339 B11R1.222 CCC(=O)c1ccccc1N Amb1772753 [0,1,0,0,0,0|3,0,0]=4 1340 B11R1.222 CCC(=O)c1ccccc1O Amb1210123 [0,1,0,0,0,0|3,0,0]=4 1341 B11R1.222 CCC(=O)c1ccncc1C Amb28062284 [0,1,0,0,0,0|2,0,0]=3 1342 B11R1.222 CCC(=O)c1ccncc1F Amb23455228 [0,1,0,0,0,0|2,0,0]=3 1343 B11R1.222 CCC(=O)c1ccncc1N Amb23401919 [0,1,0,0,0,0|2,0,0]=3 1344 B11R1.222 CCC(=O)c1ncncc1Br Amb23455705 [0,1,0,0,0,0|3,0,0]=4 1345 B11R1.222 CCS(=O)c1ccncc1N Amb18284722 [0,1,0,0,0,0|3,0,0]=4 1346 B11R1.222 CNC(=N)c1ccccc1Cl Amb24509222 [0,1,0,0,0,0|3,0,0]=4 1347 B11R1.222 CNC(=N)c1ccccc1Cl Amb28652842 [0,1,0,0,0,0|3,0,0]=4 1348 B11R1.222 CNC(=N)c1ccncc1Br Amb27444779 [0,1,0,0,0,0|2,0,0]=3 1349 B11R1.222 CNC(=N)c1ccncc1Cl Amb28074997 [0,1,0,0,0,0|2,0,0]=3 1350 B11R1.222 CNC(=O)C1=CNC=CC1=O Amb25980915 [0,1,0,0,0,0|3,0,0]=4 1351 B11R1.222 CNC(=O)c1ccccc1Br Amb2625865 [0,1,0,0,0,0|2,0,0]=3 1352 B11R1.222 CNC(=O)c1ccccc1C Amb2613120 [0,1,0,0,0,0|2,0,0]=3 1353 B11R1.222 CNC(=O)c1ccccc1I Amb2754649 [0,1,0,0,0,0|2,0,0]=3 1354 B11R1.222 CNC(=O)c1ccccc1N Amb6541338 [0,1,0,0,0,0|2,0,0]=3 1355 B11R1.222 CNC(=O)c1ccccc1N Amb6773994 [0,1,0,0,0,0|2,0,0]=3 1356 B11R1.222 CNC(=O)c1ccccc1O Amb534308 [0,1,0,0,0,0|2,0,0]=3 1357 B11R1.222 CNC(=O)c1cccnc1Br Amb28184490 [0,1,0,0,0,0|3,0,0]=4 1358 B11R1.222 CNC(=O)c1cccnc1Cl Amb6252044 [0,1,0,0,0,0|3,0,0]=4 1359 B11R1.222 CNC(=O)c1cccnc1N Amb16233797 [0,1,0,0,0,0|3,0,0]=4 1360 B11R1.222 CNC(=O)c1cccnc1O Amb18125363 [0,1,0,0,0,0|3,0,0]=4 1361 B11R1.222 CNC(=O)c1ccncc1Br Amb28074145 [0,1,0,0,0,0|1,0,0]=2 1362 B11R1.222 CNC(=O)c1ccncc1Cl Amb27976491 [0,1,0,0,0,0|1,0,0]=2 1363 B11R1.222 CNC(=O)c1ccncc1N Amb23556941 [0,1,0,0,0,0|1,0,0]=2 1364 B11R1.222 CNC(=O)c1cnccc1N Amb22263729 [0,1,0,0,0,0|3,0,0]=4 1365 B11R1.222 CNC(=O)c1ncccc1C Amb24413396 [0,1,0,0,0,0|3,0,0]=4 1366 B11R1.222 CNC(=O)c1ncccc1Cl Amb28127963 [0,1,0,0,0,0|3,0,0]=4 1367 B11R1.222 CNC(=O)c1ncncc1Br Amb25147873 [0,1,0,0,0,0|2,0,0]=3 1368 B11R1.222 CNC(=O)c1ncncc1Cl Amb27638060 [0,1,0,0,0,0|2,0,0]=3 1369 B11R1.222 CNC(=S)c1ccccc1F Amb27412514 [0,1,0,0,0,0|2,1,0]=4 1370 B11R1.222 CNC(=S)c1ccccc1N Amb26845442 [0,1,0,0,0,0|2,1,0]=4 1371 B11R1.222 CNC(=S)c1ccccc1O Amb27215302 [0,1,0,0,0,0|2,1,0]=4 1372 B11R1.222 CNC(C)c1ccncc1N Amb27791980 [0,1,0,0,0,0|2,0,1]=4 1373 B11R1.222 CNC(O)c1ccncc1O Amb27176839 [0,1,0,0,0,0|1,0,2]=4 1374 B11R1.222 CN[C@H](C)c1ccncc1Br Amb27393586 [0,1,0,0,0,0|2,0,1]=4 1375 B11R1.222 CN[C@H](C)c1ccncc1C Amb27798729 [0,1,0,0,0,0|2,0,1]=4 1376 B11R1.222 CN[C@H](C)c1ccncc1O Amb27617420 [0,1,0,0,0,0|2,0,1]=4 1377 B11R1.222 COC(=O)C1=CC=NNC1=O Amb21857256 [0,1,0,0,0,0|3,0,0]=4 1378 B11R1.222 COC(=O)c1ccccc1Br Amb2725116 [0,1,0,0,0,0|3,0,0]=4 1379 B11R1.222 COC(=O)c1ccccc1C Amb2726227 [0,1,0,0,0,0|3,0,0]=4 1380 B11R1.222 COC(=O)c1ccccc1Cl Amb2700777 [0,1,0,0,0,0|3,0,0]=4 1381 B11R1.222 COC(=O)c1ccccc1F Amb2689434 [0,1,0,0,0,0|3,0,0]=4 1382 B11R1.222 COC(=O)c1ccccc1I Amb2689458 [0,1,0,0,0,0|3,0,0]=4 1383 B11R1.222 COC(=O)c1ccccc1N Amb1229837 [0,1,0,0,0,0|3,0,0]=4 1384 B11R1.222 COC(=O)c1ccccc1N Amb22741062 [0,1,0,0,0,0|3,0,0]=4 1385 B11R1.222 COC(=O)c1ccccc1O Amb1200750 [0,1,0,0,0,0|3,0,0]=4 1386 B11R1.222 COC(=O)c1ccccc1S Amb2689742 [0,1,0,0,0,0|3,0,0]=4 1387 B11R1.222 COC(=O)c1ccncc1Br Amb10606114 [0,1,0,0,0,0|2,0,0]=3 1388 B11R1.222 COC(=O)c1ccncc1C Amb2694740 [0,1,0,0,0,0|2,0,0]=3 1389 B11R1.222 COC(=O)c1ccncc1Cl Amb8630940 [0,1,0,0,0,0|2,0,0]=3 1390 B11R1.222 COC(=O)c1ccncc1F Amb22411142 [0,1,0,0,0,0|2,0,0]=3 1391 B11R1.222 COC(=O)c1ccncc1I Amb10602323 [0,1,0,0,0,0|2,0,0]=3 1392 B11R1.222 COC(=O)c1ccncc1N Amb2440807 [0,1,0,0,0,0|2,0,0]=3 1393 B11R1.222 COC(=O)c1ccncc1O Amb33321485 [0,1,0,0,0,0|2,0,0]=3 1394 B11R1.222 COC(=O)c1ccncc1O Amb5559272 [0,1,0,0,0,0|2,0,0]=3 1395 B11R1.222 COC(=O)c1ccnnc1N Amb22523474 [0,1,0,0,0,0|3,0,0]=4 1396 B11R1.222 COC(=O)c1cnncc1C Amb22406186 [0,1,0,0,0,0|3,0,0]=4 1397 B11R1.222 COC(=O)c1cnncc1O Amb27636460 [0,1,0,0,0,0|3,0,0]=4 1398 B11R1.222 COC(=O)c1ncncc1Br Amb10603996 [0,1,0,0,0,0|3,0,0]=4 1399 B11R1.222 COC(=O)c1ncncc1C Amb27636420 [0,1,0,0,0,0|3,0,0]=4 1400 B11R1.222 COC(=O)c1ncncc1Cl Amb26655959 [0,1,0,0,0,0|3,0,0]=4 1401 B11R1.222 COC(=O)c1ncncc1F Amb28129857 [0,1,0,0,0,0|3,0,0]=4 1402 B11R1.222 COC(=O)c1ncncc1I Amb27171316 [0,1,0,0,0,0|3,0,0]=4 1403 B11R1.222 COC(=O)c1ncncc1N Amb27852807 [0,1,0,0,0,0|3,0,0]=4 1404 B11R1.222 C\C(=N/O)c1ccncc1F Amb32651919 [0,1,0,0,0,0|2,0,1]=4 1405 B11R1.222 C\C(=N/O)c1ccncc1F Amb32652194 [0,1,0,0,0,0|2,0,1]=4 1406 B11R1.222 C\C(=N\O)c1ccncc1F Amb28454405 [0,1,0,0,0,0|2,0,1]=4 1407 B11R1.222 C\C(NO)=C1\C=CC=CC1=O Amb33512951 [0,1,0,0,0,0|3,0,0]=4 1408 B11R1.222 Cc1ccccc1C(=O)C#N Amb16231820 [0,1,0,0,0,0|2,0,1]=4 1409 B11R1.222 Cc1ccccc1C(=O)C=O Amb18124884 [0,1,0,0,0,0|3,0,0]=4 1410 B11R1.222 Cc1ccccc1C(=O)CBr Amb2792913 [0,1,0,0,0,0|3,0,0]=4 1411 B11R1.222 Cc1ccccc1C(=O)CCl Amb18185586 [0,1,0,0,0,0|3,0,0]=4 1412 B11R1.222 Cc1ccccc1C(=O)CF Amb25807621 [0,1,0,0,0,0|3,0,0]=4 1413 B11R1.222 Cc1ccccc1C(=O)CN Amb18281552 [0,1,0,0,0,0|2,0,0]=3 1414 B11R1.222 Cc1ccccc1C(=O)CN Amb2693529 [0,1,0,0,0,0|2,0,0]=3 1415 B11R1.222 Cc1ccccc1C(=O)CO Amb18182730 [0,1,0,0,0,0|3,0,0]=4 1416 B11R1.222 Cc1ccccc1C(=O)NN Amb6355883 [0,1,0,0,0,0|1,0,0]=2 1417 B11R1.222 Cc1ccccc1C(=O)NO Amb6278426 [0,1,0,0,0,0|2,0,0]=3 1418 B11R1.222 Cc1ccccc1C(C)NN Amb6249679 [0,1,0,0,0,0|2,0,1]=4 1419 B11R1.222 Cc1ccccc1\C(N)=N\N Amb28410471 [0,1,0,0,0,0|2,0,1]=4 1420 B11R1.222 Cc1cccnc1C(=O)CN Amb26494369 [0,1,0,0,0,0|3,0,0]=4 1421 B11R1.222 Cc1cccnc1C(=O)NN Amb18181689 [0,1,0,0,0,0|2,0,0]=3 1422 B11R1.222 Cc1cccnc1C(=O)NO Amb18796666 [0,1,0,0,0,0|3,0,0]=4 1423 B11R1.222 Cc1ccncc1C(=O)CN Amb18201929 [0,1,0,0,0,0|3,0,0]=4 1424 B11R1.222 Cc1ccncc1C(=O)NN Amb17843885 [0,1,0,0,0,0|2,0,0]=3 1425 B11R1.222 Cc1cnccc1C(=O)CCl Amb25080273 [0,1,0,0,0,0|2,0,0]=3 1426 B11R1.222 Cc1cnccc1C(=O)CN Amb33414527 [0,1,0,0,0,0|1,0,0]=2 1427 B11R1.222 Cc1cnccc1C(C)CN Amb27853963 [0,1,0,0,0,0|2,0,1]=4 1428 B11R1.222 Cc1cnccc1C(C)ON Amb33414176 [0,1,0,0,0,0|2,0,1]=4 1429 B11R1.222 Cc1cnccc1C(F)CN Amb33414469 [0,1,0,0,0,0|2,0,1]=4 1430 B11R1.222 Cc1cnccc1C(N)CN Amb27475952 [0,1,0,0,0,0|2,0,1]=4 1431 B11R1.222 Cc1cnccc1C(O)CN Amb28246816 [0,1,0,0,0,0|1,0,2]=4 1432 B11R1.222 Cc1cnccc1S(=O)O[Na] Amb33328801 [0,1,0,0,0,0|3,0,0]=4 1433 B11R1.222 Cc1cnccc1[C@@H](O)CN Amb33414187 [0,1,0,0,0,0|1,0,2]=4 1434 B11R1.222 Cc1cnccc1[C@H](O)CN Amb33414191 [0,1,0,0,0,0|1,0,2]=4 1435 B11R1.222 Cc1cnccc1\C(Cl)=N\O Amb27198972 [0,1,0,0,0,0|2,0,1]=4 1436 B11R1.222 Cc1cnccc1\C(N)=N\N Amb27648340 [0,1,0,0,0,0|1,0,1]=3 1437 B11R1.222 Cc1cnccc1\C(N)=N\O Amb25065278 [0,1,0,0,0,0|2,0,1]=4 1438 B11R1.222 Cc1ncccc1C(=O)CN Amb18201918 [0,1,0,0,0,0|3,0,0]=4 1439 B11R1.222 Cc1ncccc1C(=O)NN Amb16231212 [0,1,0,0,0,0|2,0,0]=3 1440 B11R1.222 Cc1ncccc1C(=O)NO Amb25675184 [0,1,0,0,0,0|3,0,0]=4 1441 B11R1.222 Cc1ncncc1C(=O)NN Amb19516899 [0,1,0,0,0,0|3,0,0]=4 1442 B11R1.222 Cc1nnccc1C(=O)NN Amb25909589 [0,1,0,0,0,0|1,0,0]=2 1443 B11R1.222 N#CC(=O)c1ccccc1Br Amb22269824 [0,1,0,0,0,0|2,0,1]=4 1444 B11R1.222 N#CC(=O)c1ccccc1Cl Amb6383873 [0,1,0,0,0,0|2,0,1]=4 1445 B11R1.222 N#CC(=O)c1ccccc1F Amb17232048 [0,1,0,0,0,0|2,0,1]=4 1446 B11R1.222 N#CC(=O)c1ccccc1I Amb22367991 [0,1,0,0,0,0|2,0,1]=4 1447 B11R1.222 N#CC(=O)c1ccccc1N Amb27487371 [0,1,0,0,0,0|2,0,1]=4 1448 B11R1.222 N=C(NN)c1ccnnc1N Amb25145923 [0,1,0,0,0,0|2,0,0]=3 1449 B11R1.222 N=C(NO)c1ccccc1Br Amb22489654 [0,1,0,0,0,0|3,0,0]=4 1450 B11R1.222 N=C(NO)c1ccccc1Cl Amb33714746 [0,1,0,0,0,0|3,0,0]=4 1451 B11R1.222 N=C(NO)c1ccccc1N Amb8631029 [0,1,0,0,0,0|3,0,0]=4 1452 B11R1.222 NCC(=O)c1ccccc1Br Amb10069326 [0,1,0,0,0,0|2,0,0]=3 1453 B11R1.222 NCC(=O)c1ccccc1Br Amb8383857 [0,1,0,0,0,0|2,0,0]=3 1454 B11R1.222 NCC(=O)c1ccccc1Cl Amb10069325 [0,1,0,0,0,0|2,0,0]=3 1455 B11R1.222 NCC(=O)c1ccccc1Cl Amb8383856 [0,1,0,0,0,0|2,0,0]=3 1456 B11R1.222 NCC(=O)c1ccccc1F Amb10840039 [0,1,0,0,0,0|2,0,0]=3 1457 B11R1.222 NCC(=O)c1ccccc1F Amb8383855 [0,1,0,0,0,0|2,0,0]=3 1458 B11R1.222 NCC(=O)c1ccccc1O Amb18125235 [0,1,0,0,0,0|2,0,0]=3 1459 B11R1.222 NCC(=O)c1ccccc1O Amb32664086 [0,1,0,0,0,0|2,0,0]=3 1460 B11R1.222 NCC(=O)c1ccccc1O Amb33801554 [0,1,0,0,0,0|2,0,0]=3 1461 B11R1.222 NCC(=O)c1cccnc1Br Amb25718599 [0,1,0,0,0,0|3,0,0]=4 1462 B11R1.222 NCC(=O)c1cccnc1Cl Amb27954551 [0,1,0,0,0,0|3,0,0]=4 1463 B11R1.222 NCC(=O)c1cccnc1Cl Amb32671339 [0,1,0,0,0,0|3,0,0]=4 1464 B11R1.222 NCC(=O)c1cccnc1F Amb24106012 [0,1,0,0,0,0|3,0,0]=4 1465 B11R1.222 NCC(=O)c1cccnc1N Amb28282757 [0,1,0,0,0,0|3,0,0]=4 1466 B11R1.222 NCC(=O)c1ccncc1Br Amb33389483 [0,1,0,0,0,0|1,0,0]=2 1467 B11R1.222 NCC(=O)c1ccncc1Cl Amb33413568 [0,1,0,0,0,0|1,0,0]=2 1468 B11R1.222 NCC(=O)c1ccncc1F Amb24680459 [0,1,0,0,0,0|1,0,0]=2 1469 B11R1.222 NCC(=O)c1cnccc1N Amb24586812 [0,1,0,0,0,0|3,0,0]=4 1470 B11R1.222 NCC(=O)c1ncccc1Br Amb33335701 [0,1,0,0,0,0|3,0,0]=4 1471 B11R1.222 NCC(=O)c1ncccc1Cl Amb24601329 [0,1,0,0,0,0|3,0,0]=4 1472 B11R1.222 NCC(=O)c1ncccc1Cl Amb30584717 [0,1,0,0,0,0|3,0,0]=4 1473 B11R1.222 NCC(=O)c1ncccc1F Amb25939616 [0,1,0,0,0,0|3,0,0]=4 1474 B11R1.222 NCC(F)c1ccncc1Br Amb33388256 [0,1,0,0,0,0|2,0,1]=4 1475 B11R1.222 NCC(F)c1ccncc1Cl Amb33413768 [0,1,0,0,0,0|2,0,1]=4 1476 B11R1.222 NCC(F)c1ccncc1F Amb25321024 [0,1,0,0,0,0|2,0,1]=4 1477 B11R1.222 NCC(N)c1ccncc1Br Amb27801071 [0,1,0,0,0,0|2,0,1]=4 1478 B11R1.222 NCC(N)c1ccncc1Cl Amb27165132 [0,1,0,0,0,0|2,0,1]=4 1479 B11R1.222 NCC(N)c1ccncc1N Amb27173265 [0,1,0,0,0,0|2,0,1]=4 1480 B11R1.222 NCC(N)c1ccncc1O Amb28313703 [0,1,0,0,0,0|2,0,1]=4 1481 B11R1.222 NCC(O)c1ccncc1Br Amb33430084 [0,1,0,0,0,0|1,0,2]=4 1482 B11R1.222 NCC(O)c1ccncc1Cl Amb33407322 [0,1,0,0,0,0|1,0,2]=4 1483 B11R1.222 NCC(O)c1ccncc1F Amb25863245 [0,1,0,0,0,0|1,0,2]=4 1484 B11R1.222 NC[C@@H](O)c1ccncc1Br Amb33388510 [0,1,0,0,0,0|1,0,2]=4 1485 B11R1.222 NC[C@@H](O)c1ccncc1Cl Amb33413775 [0,1,0,0,0,0|1,0,2]=4 1486 B11R1.222 NC[C@@H](O)c1ccncc1F Amb33317200 [0,1,0,0,0,0|1,0,2]=4 1487 B11R1.222 NC[C@H](N)c1ccncc1Cl Amb27233806 [0,1,0,0,0,0|2,0,1]=4 1488 B11R1.222 NC[C@H](N)c1ccncc1F Amb27409349 [0,1,0,0,0,0|2,0,1]=4 1489 B11R1.222 NC[C@H](O)c1ccncc1Br Amb33388509 [0,1,0,0,0,0|1,0,2]=4 1490 B11R1.222 NC[C@H](O)c1ccncc1Cl Amb33413771 [0,1,0,0,0,0|1,0,2]=4 1491 B11R1.222 NC[C@H](O)c1ccncc1F Amb33317201 [0,1,0,0,0,0|1,0,2]=4 1492 B11R1.222 NNC(=O)C1=CC=CNC1=O Amb18261745 [0,1,0,0,0,0|2,0,0]=3 1493 B11R1.222 NNC(=O)C1=CC=NNC1=O Amb27769004 [0,1,0,0,0,0|1,0,0]=2 1494 B11R1.222 NNC(=O)C1=CNC=CC1=O Amb26410826 [0,1,0,0,0,0|2,0,0]=3 1495 B11R1.222 NNC(=O)c1ccccc1Br Amb6366604 [0,1,0,0,0,0|1,0,0]=2 1496 B11R1.222 NNC(=O)c1ccccc1Cl Amb6335230 [0,1,0,0,0,0|1,0,0]=2 1497 B11R1.222 NNC(=O)c1ccccc1F Amb1104489 [0,1,0,0,0,0|1,0,0]=2 1498 B11R1.222 NNC(=O)c1ccccc1F Amb33313449 [0,1,0,0,0,0|1,0,0]=2 1499 B11R1.222 NNC(=O)c1ccccc1I Amb6317927 [0,1,0,0,0,0|1,0,0]=2 1500 B11R1.222 NNC(=O)c1ccccc1N Amb1775193 [0,1,0,0,0,0|1,0,0]=2 1501 B11R1.222 NNC(=O)c1ccccc1O Amb1796080 [0,1,0,0,0,0|1,0,0]=2 1502 B11R1.222 NNC(=O)c1cccnc1Cl Amb26609694 [0,1,0,0,0,0|2,0,0]=3 1503 B11R1.222 NNC(=O)c1cccnc1Cl Amb27762294 [0,1,0,0,0,0|2,0,0]=3 1504 B11R1.222 NNC(=O)c1cccnc1N Amb2751700 [0,1,0,0,0,0|2,0,0]=3 1505 B11R1.222 NNC(=O)c1cccnc1S Amb25808034 [0,1,0,0,0,0|2,0,0]=3 1506 B11R1.222 NNC(=O)c1ccncc1Cl Amb24087354 [0,1,0,0,0,0|0,0,0]=1 1507 B11R1.222 NNC(=O)c1ccncc1F Amb24509082 [0,1,0,0,0,0|0,0,0]=1 1508 B11R1.222 NNC(=O)c1ccncc1N Amb8630332 [0,1,0,0,0,0|0,0,0]=1 1509 B11R1.222 NNC(=O)c1cnccc1N Amb23554909 [0,1,0,0,0,0|2,0,0]=3 1510 B11R1.222 NNC(=O)c1cnccc1S Amb27829476 [0,1,0,0,0,0|2,0,0]=3 1511 B11R1.222 NNC(=O)c1ncccc1Br Amb13882826 [0,1,0,0,0,0|2,0,0]=3 1512 B11R1.222 NNC(=O)c1ncccc1N Amb26338388 [0,1,0,0,0,0|2,0,0]=3 1513 B11R1.222 NNC(=O)c1ncccc1O Amb18179468 [0,1,0,0,0,0|2,0,0]=3 1514 B11R1.222 NNC(=O)c1nccnc1N Amb1271154 [0,1,0,0,0,0|3,0,0]=4 1515 B11R1.222 NNC(=S)c1ncccc1Cl Amb27447193 [0,1,0,0,0,0|2,1,0]=4 1516 B11R1.222 N\C(=N\O)c1ccncc1Br Amb24562891 [0,1,0,0,0,0|2,0,1]=4 1517 B11R1.222 N\C(=N\O)c1ccncc1Cl Amb26622037 [0,1,0,0,0,0|2,0,1]=4 1518 B11R1.222 N\N=C(\N)c1ccccc1Br Amb27171792 [0,1,0,0,0,0|2,0,1]=4 1519 B11R1.222 N\N=C(\N)c1ccccc1F Amb18787466 [0,1,0,0,0,0|2,0,1]=4 1520 B11R1.222 N\N=C(\N)c1ccncc1Br Amb27967041 [0,1,0,0,0,0|1,0,1]=3 1521 B11R1.222 Nc1ccccc1C(=O)NO Amb3094175 [0,1,0,0,0,0|2,0,0]=3 1522 B11R1.222 Nc1cccnc1C(=O)NO Amb22432384 [0,1,0,0,0,0|3,0,0]=4 1523 B11R1.222 Nc1ccncc1C(=O)NO Amb26590990 [0,1,0,0,0,0|3,0,0]=4 1524 B11R1.222 Nc1cnccc1C(=O)NO Amb27664574 [0,1,0,0,0,0|1,0,0]=2 1525 B11R1.222 Nc1ncccc1C(=O)NO Amb27407097 [0,1,0,0,0,0|3,0,0]=4 1526 B11R1.222 O=C(CBr)c1ccccc1Br Amb1106771 [0,1,0,0,0,0|3,0,0]=4 1527 B11R1.222 O=C(CBr)c1ccccc1Cl Amb2608538 [0,1,0,0,0,0|3,0,0]=4 1528 B11R1.222 O=C(CBr)c1ccccc1F Amb1106770 [0,1,0,0,0,0|3,0,0]=4 1529 B11R1.222 O=C(CBr)c1ccccc1I Amb22737619 [0,1,0,0,0,0|3,0,0]=4 1530 B11R1.222 O=C(CBr)c1ccccc1O Amb4418417 [0,1,0,0,0,0|3,0,0]=4 1531 B11R1.222 O=C(CBr)c1ccncc1Br Amb25678043 [0,1,0,0,0,0|2,0,0]=3 1532 B11R1.222 O=C(CBr)c1ccncc1Br Amb33457416 [0,1,0,0,0,0|2,0,0]=3 1533 B11R1.222 O=C(CBr)c1ccncc1Cl Amb24087519 [0,1,0,0,0,0|2,0,0]=3 1534 B11R1.222 O=C(CBr)c1ccncc1Cl Amb25880646 [0,1,0,0,0,0|2,0,0]=3 1535 B11R1.222 O=C(CBr)c1ccncc1F Amb27487332 [0,1,0,0,0,0|2,0,0]=3 1536 B11R1.222 O=C(CBr)c1ccncc1F Amb32662583 [0,1,0,0,0,0|2,0,0]=3 1537 B11R1.222 O=C(CBr)c1ncncc1Br Amb27634436 [0,1,0,0,0,0|3,0,0]=4 1538 B11R1.222 O=C(CCl)c1ccccc1Cl Amb18330058 [0,1,0,0,0,0|3,0,0]=4 1539 B11R1.222 O=C(CCl)c1ccccc1F Amb18807753 [0,1,0,0,0,0|3,0,0]=4 1540 B11R1.222 O=C(CCl)c1ccccc1O Amb2209413 [0,1,0,0,0,0|3,0,0]=4 1541 B11R1.222 O=C(CCl)c1ccncc1Br Amb27403431 [0,1,0,0,0,0|2,0,0]=3 1542 B11R1.222 O=C(CCl)c1ccncc1Cl Amb26615709 [0,1,0,0,0,0|2,0,0]=3 1543 B11R1.222 O=C(CCl)c1ccncc1F Amb26887236 [0,1,0,0,0,0|2,0,0]=3 1544 B11R1.222 O=C(CCl)c1ncncc1Br Amb27244191 [0,1,0,0,0,0|3,0,0]=4 1545 B11R1.222 O=C(CF)c1ccccc1Br Amb22489704 [0,1,0,0,0,0|3,0,0]=4 1546 B11R1.222 O=C(CF)c1ccccc1Cl Amb23454835 [0,1,0,0,0,0|3,0,0]=4 1547 B11R1.222 O=C(CF)c1ccccc1F Amb23454839 [0,1,0,0,0,0|3,0,0]=4 1548 B11R1.222 O=C(CO)c1ccccc1Br Amb24639690 [0,1,0,0,0,0|3,0,0]=4 1549 B11R1.222 O=C(CO)c1ccccc1Cl Amb18185665 [0,1,0,0,0,0|3,0,0]=4 1550 B11R1.222 O=C(CO)c1ccccc1F Amb18182895 [0,1,0,0,0,0|3,0,0]=4 1551 B11R1.222 O=C(CO)c1ccccc1I Amb33623873 [0,1,0,0,0,0|3,0,0]=4 1552 B11R1.222 O=C(CO)c1ccccc1O Amb18125347 [0,1,0,0,0,0|3,0,0]=4 1553 B11R1.222 O=C(NO)C1=CC=CNC1=S Amb26515565 [0,1,0,0,0,0|3,0,0]=4 1554 B11R1.222 O=C(NO)c1cccc[n+]1[O-] Amb27768235 [0,1,0,0,0,0|3,0,0]=4 1555 B11R1.222 O=C(NO)c1ccccc1Br Amb6269839 [0,1,0,0,0,0|2,0,0]=3 1556 B11R1.222 O=C(NO)c1ccccc1Cl Amb6259829 [0,1,0,0,0,0|2,0,0]=3 1557 B11R1.222 O=C(NO)c1ccccc1F Amb6269743 [0,1,0,0,0,0|2,0,0]=3 1558 B11R1.222 O=C(NO)c1ccccc1O Amb2504335 [0,1,0,0,0,0|2,0,0]=3 1559 B11R1.222 O=C(NO)c1cccnc1Cl Amb8439449 [0,1,0,0,0,0|3,0,0]=4 1560 B11R1.222 O=C(NO)c1cccnc1F Amb26622975 [0,1,0,0,0,0|3,0,0]=4 1561 B11R1.222 O=C(NO)c1ccncc1Br Amb27660438 [0,1,0,0,0,0|1,0,0]=2 1562 B11R1.222 O=C(NO)c1ccncc1F Amb25276068 [0,1,0,0,0,0|1,0,0]=2 1563 B11R1.222 O=C(NO)c1ccncc1O Amb10975474 [0,1,0,0,0,0|1,0,0]=2 1564 B11R1.222 O=C(NO)c1cnccc1Cl Amb28140485 [0,1,0,0,0,0|3,0,0]=4 1565 B11R1.222 O=C(NO)c1ncccc1O Amb18791558 [0,1,0,0,0,0|3,0,0]=4 1566 B11R1.222 O=C(NO)c1ncncc1Cl Amb27980087 [0,1,0,0,0,0|2,0,0]=3 1567 B11R1.222 O=CC(=O)c1ccccc1Br Amb18131520 [0,1,0,0,0,0|3,0,0]=4 1568 B11R1.222 O=CC(=O)c1ccccc1Cl Amb18126568 [0,1,0,0,0,0|3,0,0]=4 1569 B11R1.222 O=CC(=O)c1ccccc1F Amb10838623 [0,1,0,0,0,0|3,0,0]=4 1570 B11R1.222 O=CC(=O)c1ccccc1F Amb22011841 [0,1,0,0,0,0|3,0,0]=4 1571 B11R1.222 O=CC(=O)c1ccccc1O Amb25269559 [0,1,0,0,0,0|3,0,0]=4 1572 B11R1.222 [Li]OC(=O)c1ccccc1O Amb3150540 [0,1,0,0,0,0|3,0,0]=4 1573 B11R2.1 Brc1coc2cnccc12 Amb26912398 [0,0,0,1,0,0|3,0,0]=4 1574 B11R2.1 Brc1csc2cnccc12 Amb10070409 [0,0,0,1,0,0|3,0,0]=4 1575 B11R2.1 Brc1noc2cnccc12 Amb27229155 [0,0,0,1,0,0|2,0,1]=4 1576 B11R2.1 C=C1CNc2ccccc21 Amb27203251 [0,0,0,1,0,0|3,0,0]=4 1577 B11R2.1 CC1CNc2cnccc21 Amb33742877 [0,0,0,1,0,0|2,0,1]=4 1578 B11R2.1 Cc1noc2cnccc12 Amb22741026 [0,0,0,1,0,0|2,0,1]=4 1579 B11R2.1 Clc1nsc2cnccc12 Amb35789173 [0,0,0,1,0,0|2,0,1]=4 1580 B11R2.1 N=C1NCc2ccccc21 Amb7174277 [0,0,0,1,0,0|3,0,0]=4 1581 B11R2.1 Nc1coc2cnccc12 Amb27633514 [0,0,0,1,0,0|3,0,0]=4 1582 B11R2.1 Nc1csc2cnccc12 Amb10067625 [0,0,0,1,0,0|3,0,0]=4 1583 B11R2.1 Nc1noc2cnccc12 Amb18642986 [0,0,0,1,0,0|2,0,1]=4 1584 B11R2.1 Nc1onc2cnccc12 Amb27186474 [0,0,0,1,0,0|2,0,1]=4 1585 B11R2.1 Nc1snc2cnccc12 Amb23401171 [0,0,0,1,0,0|2,0,1]=4 1586 B11R2.1 O=C1C=Cc2ccccc21 Amb10603436 [0,0,0,1,0,0|3,0,0]=4 1587 B11R2.1 O=C1CCc2ccccc21 Amb6458950 [0,0,0,1,0,0|3,0,0]=4 1588 B11R2.1 O=C1CCc2cnccc21 Amb22235532 [0,0,0,1,0,0|2,0,0]=3 1589 B11R2.1 O=C1CCc2cnccc21 Amb5719882 [0,0,0,1,0,0|2,0,0]=3 1590 B11R2.1 O=C1CNc2cccc[n+]21 Amb32664845 [0,0,0,1,0,0|3,0,0]=4 1591 B11R2.1 O=C1CNc2ccccc21 Amb17593399 [0,0,0,1,0,0|2,0,0]=3 1592 B11R2.1 O=C1COc2ccccc21 Amb33534383 [0,0,0,1,0,0|3,0,0]=4 1593 B11R2.1 O=C1COc2cnccc21 Amb20242099 [0,0,0,1,0,0|2,0,0]=3 1594 B11R2.1 O=C1COc2cnccc21 Amb22728783 [0,0,0,1,0,0|2,0,0]=3 1595 B11R2.1 O=C1CSc2ccccc21 Amb4062421 [0,0,0,1,0,0|3,0,0]=4 1596 B11R2.1 O=C1CSc2cnccc21 Amb27265724 [0,0,0,1,0,0|2,0,0]=3 1597 B11R2.1 O=C1N=Cc2ccccc21 Amb25265062 [0,0,0,1,0,0|2,0,1]=4 1598 B11R2.1 O=C1NC=C2C=CC=CN12 Amb26008108 [0,0,0,1,0,0|3,0,0]=4 1599 B11R2.1 O=C1NCc2ccccc21 Amb773532 [0,0,0,1,0,0|2,0,0]=3 1600 B11R2.1 O=C1NCc2cccnc21 Amb22276754 [0,0,0,1,0,0|3,0,0]=4 1601 B11R2.1 O=C1NCc2ccncc21 Amb22388464 [0,0,0,1,0,0|3,0,0]=4 1602 B11R2.1 O=C1NCc2ccncc21 Amb32675690 [0,0,0,1,0,0|3,0,0]=4 1603 B11R2.1 O=C1NCc2cnccc21 Amb23455305 [0,0,0,1,0,0|1,0,0]=2 1604 B11R2.1 O=C1NCc2ncccc21 Amb33530547 [0,0,0,1,0,0|3,0,0]=4 1605 B11R2.1 O=C1NN=C2C=CC=CN12 Amb18012675 [0,0,0,1,0,0|2,0,1]=4 1606 B11R2.1 O=C1NN=C2C=NC=CN12 Amb23401333 [0,0,0,1,0,0|1,0,1]=3 1607 B11R2.1 O=C1NNc2ccccc21 Amb19514505 [0,0,0,1,0,0|1,0,0]=2 1608 B11R2.1 O=C1NNc2cccnc21 Amb21857168 [0,0,0,1,0,0|2,0,0]=3 1609 B11R2.1 O=C1NNc2cnccc21 Amb21857177 [0,0,0,1,0,0|0,0,0]=1 1610 B11R2.1 O=C1NNc2ncccc21 Amb33528585 [0,0,0,1,0,0|2,0,0]=3 1611 B11R2.1 O=C1NNc2nccnc21 Amb27471979 [0,0,0,1,0,0|3,0,0]=4 1612 B11R2.1 O=C1NNc2ncncc21 Amb24062015 [0,0,0,1,0,0|3,0,0]=4 1613 B11R2.1 O=C1NOc2cnccc21 Amb22494128 [0,0,0,1,0,0|1,0,0]=2 1614 B11R2.1 O=C1NSc2ccccc21 Amb17933279 [0,0,0,1,0,0|2,0,0]=3 1615 B11R2.1 O=C1OCc2ccccc21 Amb2610613 [0,0,0,1,0,0|3,0,0]=4 1616 B11R2.1 O=C1ONc2ccccc21 Amb26994489 [0,0,0,1,0,0|2,0,0]=3 1617 B11R2.1 O=C1SCc2ccccc21 Amb2421358 [0,0,0,1,0,0|3,0,0]=4 1618 B11R2.1 O=C1SNc2ccccc21 Amb19416440 [0,0,0,1,0,0|2,0,0]=3 1619 B11R2.1 Oc1csc2cnccc12 Amb32669775 [0,0,0,1,0,0|2,0,1]=4 1620 B11R2.1 Oc1noc2cnccc12 Amb10975477 [0,0,0,1,0,0|1,0,2]=4 1621 B11R2.1 S=C1CNc2ccccc21 Amb27791107 [0,0,0,1,0,0|2,1,0]=4 1622 B11R2.4 NC1CC1c2ccncc2 Amb9677222 [0,0,0,1,0,0|2,0,1]=4 1623 B11R2.4 NN1CC1c2ccccc2 Amb17593419 [0,0,0,1,0,0|2,0,1]=4 1624 B11R2.4 N[C@@H]1C[C@H]1c2ccncc2 Amb33380669 [0,0,0,1,0,0|2,0,1]=4 1625 B11R2.54 CC1C(=O)c2ccccc21 Amb27602983 [0,0,0,1,0,0|3,0,0]=4 1626 B11R2.54 O=C1C(=O)c2ccccc21 Amb18048412 [0,0,0,1,0,0|3,0,0]=4 1627 B11R2.54 O=C1c2ccccc2C1Cl Amb21948336 [0,0,0,1,0,0|3,0,0]=4 1628 B11R2.54 O=C1c2ccccc2C1O Amb27164695 [0,0,0,1,0,0|3,0,0]=4 1629 B11R2.239 c1cc(C2CCN2)ccn1 Amb26960403 [0,0,0,1,0,0|2,0,1]=4 1630 B11R2.239 c1cc(C2CNC2)ccn1 Amb19516821 [0,0,0,1,0,0|2,0,1]=4 1631 B11R2.239 c1cc(C2CNC2)ccn1 Amb20620350 [0,0,0,1,0,0|2,0,1]=4 1632 B9R1.11 C#CC(=O)c1ccco1 Amb27465291 [0,0,0,0,1,0|3,0,0]=4 1633 B9R1.11 C#CC(=O)c1ccoc1 Amb27866790 [0,0,0,0,1,0|3,0,0]=4 1634 B9R1.11 C#CC(=O)c1ccsc1 Amb26510559 [0,0,0,0,1,0|3,0,0]=4 1635 B9R1.11 C=C(CN)c1ccco1 Amb26971270 [0,0,0,0,1,0|3,0,0]=4 1636 B9R1.11 C=C(CN)c1cccs1 Amb18908327 [0,0,0,0,1,0|3,0,0]=4 1637 B9R1.11 C=C(CN)c1ccoc1 Amb24697162 [0,0,0,0,1,0|3,0,0]=4 1638 B9R1.11 C=C(CN)c1ccsc1 Amb27462789 [0,0,0,0,1,0|3,0,0]=4 1639 B9R1.11 C=C(CN)c1cnco1 Amb33414802 [0,0,0,0,1,0|3,0,0]=4 1640 B9R1.11 C=C(CN)c1cncs1 Amb33269111 [0,0,0,0,1,0|3,0,0]=4 1641 B9R1.11 C=CC(=O)c1ccco1 Amb16232452 [0,0,0,0,1,0|3,0,0]=4 1642 B9R1.11 C=CC(=O)c1cccs1 Amb18562033 [0,0,0,0,1,0|3,0,0]=4 1643 B9R1.11 C=CC(=O)c1ccns1 Amb27449528 [0,0,0,0,1,0|3,0,0]=4 1644 B9R1.11 C=CC(=O)c1ccoc1 Amb27227609 [0,0,0,0,1,0|3,0,0]=4 1645 B9R1.11 C=CC(=O)c1ccsc1 Amb24478667 [0,0,0,0,1,0|3,0,0]=4 1646 B9R1.11 C=CC(=O)c1cnco1 Amb33415607 [0,0,0,0,1,0|3,0,0]=4 1647 B9R1.11 C=CC(=O)c1cncs1 Amb26641774 [0,0,0,0,1,0|3,0,0]=4 1648 B9R1.11 C=CC(=O)c1cnsc1 Amb35716778 [0,0,0,0,1,0|3,0,0]=4 1649 B9R1.11 C=CC(=O)n1cccc1 Amb28122830 [0,0,0,0,1,0|3,0,0]=4 1650 B9R1.11 CC(CO)=C1C=CC=C1 Amb27981717 [0,0,0,0,1,0|3,0,0]=4 1651 B9R1.11 CC(NN)c1ccco1 Amb6251505 [0,0,0,0,1,0|2,0,1]=4 1652 B9R1.11 CC(NN)c1ccoc1 Amb27837250 [0,0,0,0,1,0|2,0,1]=4 1653 B9R1.11 CC(NN)c1cncs1 Amb27245785 [0,0,0,0,1,0|2,0,1]=4 1654 B9R1.11 CC(NN)c1cnsc1 Amb35720054 [0,0,0,0,1,0|2,0,1]=4 1655 B9R1.11 CCC(=O)c1ccco1 Amb844124 [0,0,0,0,1,0|3,0,0]=4 1656 B9R1.11 CCC(=O)c1cccs1 Amb2690591 [0,0,0,0,1,0|3,0,0]=4 1657 B9R1.11 CCC(=O)c1ccoc1 Amb27196907 [0,0,0,0,1,0|3,0,0]=4 1658 B9R1.11 CCC(=O)c1ccsc1 Amb6298062 [0,0,0,0,1,0|3,0,0]=4 1659 B9R1.11 CCC(=O)c1cnco1 Amb33328540 [0,0,0,0,1,0|3,0,0]=4 1660 B9R1.11 CCC(=O)c1cnsc1 Amb35716779 [0,0,0,0,1,0|3,0,0]=4 1661 B9R1.11 CCC(=O)n1ccnc1 Amb2690402 [0,0,0,0,1,0|3,0,0]=4 1662 B9R1.11 CNC(=O)c1ccco1 Amb2612183 [0,0,0,0,1,0|2,0,0]=3 1663 B9R1.11 CNC(=O)c1cccs1 Amb2612184 [0,0,0,0,1,0|2,0,0]=3 1664 B9R1.11 CNC(=O)c1ccsc1 Amb2612185 [0,0,0,0,1,0|2,0,0]=3 1665 B9R1.11 CNC(=O)c1cnns1 Amb27259378 [0,0,0,0,1,0|3,0,0]=4 1666 B9R1.11 CNC(=O)c1cocn1 Amb27661402 [0,0,0,0,1,0|3,0,0]=4 1667 B9R1.11 CNC(=O)n1ccnc1 Amb33528879 [0,0,0,0,1,0|2,0,0]=3 1668 B9R1.11 COC(=O)c1ccco1 Amb4302709 [0,0,0,0,1,0|3,0,0]=4 1669 B9R1.11 COC(=O)c1cccs1 Amb1911537 [0,0,0,0,1,0|3,0,0]=4 1670 B9R1.11 COC(=O)c1ccno1 Amb4450531 [0,0,0,0,1,0|3,0,0]=4 1671 B9R1.11 COC(=O)c1ccns1 Amb13883507 [0,0,0,0,1,0|3,0,0]=4 1672 B9R1.11 COC(=O)c1ccoc1 Amb33531546 [0,0,0,0,1,0|3,0,0]=4 1673 B9R1.11 COC(=O)c1ccsc1 Amb9245220 [0,0,0,0,1,0|3,0,0]=4 1674 B9R1.11 COC(=O)c1cnco1 Amb21520455 [0,0,0,0,1,0|3,0,0]=4 1675 B9R1.11 COC(=O)c1cncs1 Amb2455728 [0,0,0,0,1,0|3,0,0]=4 1676 B9R1.11 COC(=O)c1cnoc1 Amb22754239 [0,0,0,0,1,0|3,0,0]=4 1677 B9R1.11 COC(=O)c1cnsc1 Amb25705771 [0,0,0,0,1,0|3,0,0]=4 1678 B9R1.11 COC(=O)n1cccc1 Amb4477192 [0,0,0,0,1,0|3,0,0]=4 1679 B9R1.11 C\C(=N/N)c1cccs1 Amb1152010 [0,0,0,0,1,0|2,0,1]=4 1680 B9R1.11 N#CC(=O)c1ccco1 Amb17231835 [0,0,0,0,1,0|2,0,1]=4 1681 B9R1.11 N#CC(=O)c1cccs1 Amb2779505 [0,0,0,0,1,0|2,0,1]=4 1682 B9R1.11 N#CC(=O)c1ccsc1 Amb27409399 [0,0,0,0,1,0|2,0,1]=4 1683 B9R1.11 N=C(NN)c1nccs1 Amb17593593 [0,0,0,0,1,0|3,0,0]=4 1684 B9R1.11 NCC(=O)c1ccco1 Amb18642269 [0,0,0,0,1,0|2,0,0]=3 1685 B9R1.11 NCC(=O)c1ccco1 Amb19373982 [0,0,0,0,1,0|2,0,0]=3 1686 B9R1.11 NCC(=O)c1cccs1 Amb1286169 [0,0,0,0,1,0|2,0,0]=3 1687 B9R1.11 NCC(=O)c1cccs1 Amb5739529 [0,0,0,0,1,0|2,0,0]=3 1688 B9R1.11 NCC(=O)c1ccns1 Amb25957124 [0,0,0,0,1,0|2,0,0]=3 1689 B9R1.11 NCC(=O)c1ccoc1 Amb18642270 [0,0,0,0,1,0|2,0,0]=3 1690 B9R1.11 NCC(=O)c1ccon1 Amb18832769 [0,0,0,0,1,0|3,0,0]=4 1691 B9R1.11 NCC(=O)c1ccsc1 Amb18643742 [0,0,0,0,1,0|2,0,0]=3 1692 B9R1.11 NCC(=O)c1ccsn1 Amb24471992 [0,0,0,0,1,0|3,0,0]=4 1693 B9R1.11 NCC(=O)c1cnco1 Amb18832770 [0,0,0,0,1,0|2,0,0]=3 1694 B9R1.11 NCC(=O)c1cncs1 Amb18831640 [0,0,0,0,1,0|2,0,0]=3 1695 B9R1.11 NCC(=O)c1cncs1 Amb30585216 [0,0,0,0,1,0|2,0,0]=3 1696 B9R1.11 NCC(=O)c1cncs1 Amb32683464 [0,0,0,0,1,0|2,0,0]=3 1697 B9R1.11 NCC(=O)c1cnsc1 Amb30009640 [0,0,0,0,1,0|2,0,0]=3 1698 B9R1.11 NCC(=O)c1cscn1 Amb18831641 [0,0,0,0,1,0|3,0,0]=4 1699 B9R1.11 NCC(=O)c1csnn1 Amb33321966 [0,0,0,0,1,0|3,0,0]=4 1700 B9R1.11 NCC(=O)c1nccs1 Amb18831642 [0,0,0,0,1,0|3,0,0]=4 1701 B9R1.11 NCC(=O)n1ccnc1 Amb27186086 [0,0,0,0,1,0|2,0,0]=3 1702 B9R1.11 NNC(=O)C1=CN=S=N1 Amb17798588 [0,0,0,0,1,0|2,0,0]=3 1703 B9R1.11 NNC(=O)c1ccco1 Amb6364758 [0,0,0,0,1,0|1,0,0]=2 1704 B9R1.11 NNC(=O)c1cccs1 Amb33038267 [0,0,0,0,1,0|1,0,0]=2 1705 B9R1.11 NNC(=O)c1cccs1 Amb6355875 [0,0,0,0,1,0|1,0,0]=2 1706 B9R1.11 NNC(=O)c1ccno1 Amb26555014 [0,0,0,0,1,0|1,0,0]=2 1707 B9R1.11 NNC(=O)c1ccns1 Amb27852001 [0,0,0,0,1,0|1,0,0]=2 1708 B9R1.11 NNC(=O)c1ccoc1 Amb1137431 [0,0,0,0,1,0|1,0,0]=2 1709 B9R1.11 NNC(=O)c1ccon1 Amb20622665 [0,0,0,0,1,0|2,0,0]=3 1710 B9R1.11 NNC(=O)c1ccsc1 Amb1127945 [0,0,0,0,1,0|1,0,0]=2 1711 B9R1.11 NNC(=O)c1cnco1 Amb19516901 [0,0,0,0,1,0|1,0,0]=2 1712 B9R1.11 NNC(=O)c1cncs1 Amb4413256 [0,0,0,0,1,0|1,0,0]=2 1713 B9R1.11 NNC(=O)c1cnsn1 Amb33533404 [0,0,0,0,1,0|2,0,0]=3 1714 B9R1.11 NNC(=O)c1cocn1 Amb13890531 [0,0,0,0,1,0|2,0,0]=3 1715 B9R1.11 NNC(=O)c1cscn1 Amb1786304 [0,0,0,0,1,0|2,0,0]=3 1716 B9R1.11 NNC(=O)c1csnn1 Amb3205449 [0,0,0,0,1,0|2,0,0]=3 1717 B9R1.11 NNC(=O)c1nccs1 Amb22490247 [0,0,0,0,1,0|2,0,0]=3 1718 B9R1.11 NNC(=O)c1ncns1 Amb27598621 [0,0,0,0,1,0|2,0,0]=3 1719 B9R1.11 NNC(=O)c1ncon1 Amb16231306 [0,0,0,0,1,0|3,0,0]=4 1720 B9R1.11 NNC(=O)c1nncs1 Amb23535960 [0,0,0,0,1,0|2,0,0]=3 1721 B9R1.11 NNC(=O)n1ccnn1 Amb27768088 [0,0,0,0,1,0|2,0,0]=3 1722 B9R1.11 N\N=C(/N)c1ccns1 Amb29851428 [0,0,0,0,1,0|2,0,1]=4 1723 B9R1.11 N\N=C(/N)c1cncs1 Amb27180340 [0,0,0,0,1,0|2,0,1]=4 1724 B9R1.11 N\N=C(\N)c1cccs1 Amb25250535 [0,0,0,0,1,0|2,0,1]=4 1725 B9R1.11 N\N=C(\N)n1ccnc1 Amb24481896 [0,0,0,0,1,0|2,0,1]=4 1726 B9R1.11 O=C(CBr)c1ccco1 Amb2721798 [0,0,0,0,1,0|3,0,0]=4 1727 B9R1.11 O=C(CBr)c1cccs1 Amb2720497 [0,0,0,0,1,0|3,0,0]=4 1728 B9R1.11 O=C(CBr)c1ccsc1 Amb2723197 [0,0,0,0,1,0|3,0,0]=4 1729 B9R1.11 O=C(CBr)c1cncs1 Amb33870854 [0,0,0,0,1,0|3,0,0]=4 1730 B9R1.11 O=C(CBr)n1cccc1 Amb27244789 [0,0,0,0,1,0|3,0,0]=4 1731 B9R1.11 O=C(CBr)n1ccnc1 Amb20573505 [0,0,0,0,1,0|3,0,0]=4 1732 B9R1.11 O=C(CCl)c1ccco1 Amb17138398 [0,0,0,0,1,0|3,0,0]=4 1733 B9R1.11 O=C(CCl)c1cccs1 Amb2686490 [0,0,0,0,1,0|3,0,0]=4 1734 B9R1.11 O=C(CCl)c1ccns1 Amb32664376 [0,0,0,0,1,0|3,0,0]=4 1735 B9R1.11 O=C(CCl)c1ccoc1 Amb22395346 [0,0,0,0,1,0|3,0,0]=4 1736 B9R1.11 O=C(CCl)c1ccsc1 Amb25727715 [0,0,0,0,1,0|3,0,0]=4 1737 B9R1.11 O=C(CCl)c1cnco1 Amb22011645 [0,0,0,0,1,0|3,0,0]=4 1738 B9R1.11 O=C(CCl)c1cncs1 Amb24104081 [0,0,0,0,1,0|3,0,0]=4 1739 B9R1.11 O=C(CCl)c1cnsc1 Amb32664375 [0,0,0,0,1,0|3,0,0]=4 1740 B9R1.11 O=C(CCl)n1ccnc1 Amb20414388 [0,0,0,0,1,0|3,0,0]=4 1741 B9R1.11 O=C(CF)c1cccs1 Amb21964939 [0,0,0,0,1,0|3,0,0]=4 1742 B9R1.11 O=C(CF)n1ccnc1 Amb25825690 [0,0,0,0,1,0|3,0,0]=4 1743 B9R1.11 O=C(CI)c1cccs1 Amb28368856 [0,0,0,0,1,0|3,0,0]=4 1744 B9R1.11 O=C(CI)c1ccoc1 Amb27647081 [0,0,0,0,1,0|3,0,0]=4 1745 B9R1.11 O=C(CO)c1ccco1 Amb17689139 [0,0,0,0,1,0|3,0,0]=4 1746 B9R1.11 O=C(CO)c1cccs1 Amb25742219 [0,0,0,0,1,0|3,0,0]=4 1747 B9R1.11 O=C(CS)c1cccs1 Amb17400035 [0,0,0,0,1,0|3,0,0]=4 1748 B9R1.11 O=C(NO)c1ccco1 Amb6270335 [0,0,0,0,1,0|2,0,0]=3 1749 B9R1.11 O=C(NO)c1cccs1 Amb1151586 [0,0,0,0,1,0|2,0,0]=3 1750 B9R1.11 O=C(NO)c1ccno1 Amb27448090 [0,0,0,0,1,0|2,0,0]=3 1751 B9R1.11 O=C(NO)c1ccon1 Amb27856744 [0,0,0,0,1,0|3,0,0]=4 1752 B9R1.11 O=C(NO)c1cncs1 Amb27494447 [0,0,0,0,1,0|2,0,0]=3 1753 B9R1.11 O=C(NO)c1cnsn1 Amb28318357 [0,0,0,0,1,0|3,0,0]=4 1754 B9R1.11 O=C(NO)c1cocn1 Amb28318358 [0,0,0,0,1,0|3,0,0]=4 1755 B9R1.11 O=C(NO)c1nccs1 Amb27837648 [0,0,0,0,1,0|3,0,0]=4 1756 B9R1.11 O=C(NO)n1cccc1 Amb25114377 [0,0,0,0,1,0|2,0,0]=3 1757 B9R1.11 O=C(N[O-])c1cccs1 Amb471648 [0,0,0,0,1,0|2,0,0]=3 1758 B9R1.11 O=C(O[Cu])c1cccs1 Amb13890298 [0,0,0,0,1,0|3,0,0]=4 1759 B9R1.11 O=C(O[Na])c1cccs1 Amb3150403 [0,0,0,0,1,0|3,0,0]=4 1760 B9R1.11 O=CC(=O)c1ccco1 Amb17593264 [0,0,0,0,1,0|3,0,0]=4 1761 B9R1.11 O=CC(=O)c1cccs1 Amb10067937 [0,0,0,0,1,0|3,0,0]=4 1762 B9R1.11 O=CC(=O)c1cccs1 Amb10607111 [0,0,0,0,1,0|3,0,0]=4 1763 B9R1.11 [NH3+]CC(=O)c1cccs1 Amb17848802 [0,0,0,0,1,0|2,0,1]=4 1764 B11R1.40 C#CC(=O)Cc1ccccc1 Amb22059749 [0,0,0,0,0,1|3,0,0]=4 1765 B11R1.40 C#CC(=O)Nc1ccccc1 Amb2444736 [0,0,0,0,0,1|3,0,0]=4 1766 B11R1.40 C#CC(=O)Nc1ccncc1 Amb28043696 [0,0,0,0,0,1|2,0,0]=3 1767 B11R1.40 C=C(CN)Cc1ccccc1 Amb26614383 [0,0,0,0,0,1|3,0,0]=4 1768 B11R1.40 C=C(CN)Sc1ccccc1 Amb27847529 [0,0,0,0,0,1|3,0,0]=4 1769 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,0,0,0,0,1|3,0,0]=4 1770 B11R1.40 C=CC(=O)Cc1ccncc1 Amb27389580 [0,0,0,0,0,1|2,0,0]=3 1771 B11R1.40 C=CC(=O)Nc1ccccc1 Amb6843666 [0,0,0,0,0,1|3,0,0]=4 1772 B11R1.40 C=CC(=O)Nc1ccncc1 Amb9480418 [0,0,0,0,0,1|2,0,0]=3 1773 B11R1.40 C=C\C(C)=C\c1ccncc1 Amb24103157 [0,0,0,0,0,1|3,0,0]=4 1774 B11R1.40 CC(CN)Cc1ccncc1 Amb5743835 [0,0,0,0,0,1|2,0,1]=4 1775 B11R1.40 CC(CN)Oc1ccncc1 Amb26948680 [0,0,0,0,0,1|2,0,1]=4 1776 B11R1.40 CC(Cc1ccccc1)NN Amb31156530 [0,0,0,0,0,1|2,0,1]=4 1777 B11R1.40 CC(Cc1ccccc1)NN Amb4136392 [0,0,0,0,0,1|2,0,1]=4 1778 B11R1.40 CC(Cc1ccncc1)NN Amb27493950 [0,0,0,0,0,1|1,0,1]=3 1779 B11R1.40 CCC(=O)Cc1ccccc1 Amb4605994 [0,0,0,0,0,1|3,0,0]=4 1780 B11R1.40 CCC(=O)Nc1ccccc1 Amb6358816 [0,0,0,0,0,1|3,0,0]=4 1781 B11R1.40 CCC(=O)Oc1ccccc1 Amb2842289 [0,0,0,0,0,1|3,0,0]=4 1782 B11R1.40 CCC(=O)Sc1ccccc1 Amb26857967 [0,0,0,0,0,1|3,0,0]=4 1783 B11R1.40 CNC(=N)Nc1ccccc1 Amb27656297 [0,0,0,0,0,1|3,0,0]=4 1784 B11R1.40 CNC(=O)C[n+]1ccccc1 Amb10553027 [0,0,0,0,0,1|3,0,0]=4 1785 B11R1.40 CNC(=O)Cc1ccccc1 Amb3099550 [0,0,0,0,0,1|2,0,0]=3 1786 B11R1.40 CNC(=O)Cc1ccccn1 Amb28365941 [0,0,0,0,0,1|3,0,0]=4 1787 B11R1.40 CNC(=O)Cc1cccnc1 Amb16231203 [0,0,0,0,0,1|3,0,0]=4 1788 B11R1.40 CNC(=O)Cc1ccncc1 Amb16231202 [0,0,0,0,0,1|1,0,0]=2 1789 B11R1.40 CNC(=O)Nc1ccccn1 Amb2132780 [0,0,0,0,0,1|3,0,0]=4 1790 B11R1.40 CNC(=O)Oc1ccccc1 Amb27212784 [0,0,0,0,0,1|2,0,0]=3 1791 B11R1.40 CNC(=O)Sc1ccccc1 Amb4407856 [0,0,0,0,0,1|2,0,0]=3 1792 B11R1.40 CNC(=S)Cc1ccncc1 Amb28119234 [0,0,0,0,0,1|1,1,0]=3 1793 B11R1.40 CNC(=S)Nc1ccccc1 Amb6335232 [0,0,0,0,0,1|2,1,0]=4 1794 B11R1.40 CNC(=S)Oc1ccccc1 Amb28208369 [0,0,0,0,0,1|2,1,0]=4 1795 B11R1.40 CNC(C)Cc1ccncc1 Amb5735449 [0,0,0,0,0,1|2,0,1]=4 1796 B11R1.40 CN\C(C)=C\c1ccccc1 Amb32758729 [0,0,0,0,0,1|3,0,0]=4 1797 B11R1.40 COC(=N)Cc1ccncc1 Amb18182737 [0,0,0,0,0,1|3,0,0]=4 1798 B11R1.40 COC(=O)Cc1ccccc1 Amb6608802 [0,0,0,0,0,1|3,0,0]=4 1799 B11R1.40 COC(=O)Cc1ccncc1 Amb20240688 [0,0,0,0,0,1|2,0,0]=3 1800 B11R1.40 COC(=O)Cc1ccncc1 Amb6892645 [0,0,0,0,0,1|2,0,0]=3 1801 B11R1.40 COC(=O)Cc1ccncn1 Amb22500240 [0,0,0,0,0,1|3,0,0]=4 1802 B11R1.40 COC(=O)Cc1ccnnc1 Amb22405879 [0,0,0,0,0,1|3,0,0]=4 1803 B11R1.40 COC(=O)Nc1ccccc1 Amb1200636 [0,0,0,0,0,1|3,0,0]=4 1804 B11R1.40 COC(=O)Nc1ccncc1 Amb8439516 [0,0,0,0,0,1|2,0,0]=3 1805 B11R1.40 COC(=O)Oc1ccccc1 Amb10807421 [0,0,0,0,0,1|3,0,0]=4 1806 B11R1.40 CSC(=O)Nc1ccccc1 Amb26618613 [0,0,0,0,0,1|3,0,0]=4 1807 B11R1.40 CSC(=S)Nc1ccncc1 Amb28198060 [0,0,0,0,0,1|2,1,0]=4 1808 B11R1.40 C[C@@H](CN)Cc1ccncc1 Amb28313701 [0,0,0,0,0,1|2,0,1]=4 1809 B11R1.40 C[C@H](CN)Cc1ccncc1 Amb24745496 [0,0,0,0,0,1|2,0,1]=4 1810 B11R1.40 C\C(=C/c1ccccc1)CN Amb33136473 [0,0,0,0,0,1|3,0,0]=4 1811 B11R1.40 C\C(=C\c1ccccc1)CN Amb24634730 [0,0,0,0,0,1|3,0,0]=4 1812 B11R1.40 C\C(=C\c1ccncc1)CBr Amb28454468 [0,0,0,0,0,1|3,0,0]=4 1813 B11R1.40 C\C(=C\c1ccncc1)CN Amb27242023 [0,0,0,0,0,1|2,0,0]=3 1814 B11R1.40 C\C(=C\c1ccncc1)CO Amb27663027 [0,0,0,0,0,1|3,0,0]=4 1815 B11R1.40 C\C(=N\N)Nc1ccccc1 Amb27198359 [0,0,0,0,0,1|2,0,1]=4 1816 B11R1.40 C\C(C=O)=C/c1ccncc1 Amb17334268 [0,0,0,0,0,1|3,0,0]=4 1817 B11R1.40 C\C(Cc1ccncc1)=N/O Amb32663046 [0,0,0,0,0,1|2,0,1]=4 1818 B11R1.40 C\C(Cc1ccncc1)=N\N Amb27840230 [0,0,0,0,0,1|1,0,1]=3 1819 B11R1.40 C\C(Cc1ccncc1)=N\O Amb24417230 [0,0,0,0,0,1|2,0,1]=4 1820 B11R1.40 N#CC(=O)Cc1ccccc1 Amb26498532 [0,0,0,0,0,1|2,0,1]=4 1821 B11R1.40 N#CC(=O)Nc1ccccc1 Amb4006113 [0,0,0,0,0,1|2,0,1]=4 1822 B11R1.40 N#CC(=O)Oc1ccccc1 Amb27813575 [0,0,0,0,0,1|2,0,1]=4 1823 B11R1.40 N=C(Cc1ccccc1)NN Amb2616207 [0,0,0,0,0,1|2,0,0]=3 1824 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [0,0,0,0,0,1|3,0,0]=4 1825 B11R1.40 N=C(NN)Nc1ccccc1 Amb32712057 [0,0,0,0,0,1|2,0,0]=3 1826 B11R1.40 N=C(NN)Oc1ccccc1 Amb27769041 [0,0,0,0,0,1|2,0,0]=3 1827 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [0,0,0,0,0,1|2,0,0]=3 1828 B11R1.40 NCC(=O)Cc1ccccc1 Amb33548503 [0,0,0,0,0,1|2,0,0]=3 1829 B11R1.40 NCC(=O)Cc1ccccn1 Amb18908409 [0,0,0,0,0,1|3,0,0]=4 1830 B11R1.40 NCC(=O)Cc1cccnc1 Amb18251321 [0,0,0,0,0,1|3,0,0]=4 1831 B11R1.40 NCC(=O)Cc1ccncc1 Amb18201930 [0,0,0,0,0,1|1,0,0]=2 1832 B11R1.40 NCC(=O)Nc1ccccc1 Amb33552339 [0,0,0,0,0,1|2,0,0]=3 1833 B11R1.40 NCC(=O)Nc1ccccc1 Amb6336661 [0,0,0,0,0,1|2,0,0]=3 1834 B11R1.40 NCC(=O)Nc1ccccn1 Amb15741010 [0,0,0,0,0,1|3,0,0]=4 1835 B11R1.40 NCC(=O)Nc1ccccn1 Amb5783162 [0,0,0,0,0,1|3,0,0]=4 1836 B11R1.40 NCC(=O)Nc1cccnc1 Amb21987914 [0,0,0,0,0,1|3,0,0]=4 1837 B11R1.40 NCC(=O)Nc1cccnc1 Amb6261654 [0,0,0,0,0,1|3,0,0]=4 1838 B11R1.40 NCC(=O)Nc1ccncc1 Amb8480235 [0,0,0,0,0,1|1,0,0]=2 1839 B11R1.40 NCC(=O)Oc1ccccc1 Amb17334310 [0,0,0,0,0,1|2,0,0]=3 1840 B11R1.40 NCC(=O)Oc1cccnc1 Amb27193825 [0,0,0,0,0,1|3,0,0]=4 1841 B11R1.40 NCC(O)Cc1ccncc1 Amb18201350 [0,0,0,0,0,1|1,0,2]=4 1842 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb1154171 [0,0,0,0,0,1|2,0,0]=3 1843 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb19748594 [0,0,0,0,0,1|2,0,0]=3 1844 B11R1.40 NNC(=O)Cc1ccccc1 Amb6355837 [0,0,0,0,0,1|1,0,0]=2 1845 B11R1.40 NNC(=O)Cc1ccccn1 Amb19373217 [0,0,0,0,0,1|2,0,0]=3 1846 B11R1.40 NNC(=O)Cc1cccnc1 Amb8387838 [0,0,0,0,0,1|2,0,0]=3 1847 B11R1.40 NNC(=O)Cc1ccncc1 Amb1133661 [0,0,0,0,0,1|0,0,0]=1 1848 B11R1.40 NNC(=O)Nc1ccccc1 Amb1204373 [0,0,0,0,0,1|1,0,0]=2 1849 B11R1.40 NNC(=O)Nc1ccccc1 Amb9825866 [0,0,0,0,0,1|1,0,0]=2 1850 B11R1.40 NNC(=O)Nc1ccccn1 Amb27593969 [0,0,0,0,0,1|2,0,0]=3 1851 B11R1.40 NNC(=O)Nc1cccnc1 Amb24433263 [0,0,0,0,0,1|2,0,0]=3 1852 B11R1.40 NNC(=O)Nc1cccnn1 Amb27464549 [0,0,0,0,0,1|3,0,0]=4 1853 B11R1.40 NNC(=O)Nc1ccncc1 Amb25148277 [0,0,0,0,0,1|0,0,0]=1 1854 B11R1.40 NNC(=O)Oc1ccccc1 Amb2737176 [0,0,0,0,0,1|1,0,0]=2 1855 B11R1.40 NNC(=O)Oc1cccnc1 Amb26958173 [0,0,0,0,0,1|2,0,0]=3 1856 B11R1.40 NNC(=S)Nc1ccccc1 Amb6335759 [0,0,0,0,0,1|1,1,0]=3 1857 B11R1.40 NNC(=S)Nc1ccccn1 Amb20668225 [0,0,0,0,0,1|2,1,0]=4 1858 B11R1.40 NNC(=S)Nc1cccnc1 Amb6608629 [0,0,0,0,0,1|2,1,0]=4 1859 B11R1.40 NNC(=S)Oc1ccccc1 Amb28248761 [0,0,0,0,0,1|1,1,0]=3 1860 B11R1.40 NNC(=S)Oc1ccncc1 Amb27404159 [0,0,0,0,0,1|0,1,0]=2 1861 B11R1.40 NNC(=S)Sc1ccccc1 Amb27254132 [0,0,0,0,0,1|1,1,0]=3 1862 B11R1.40 NN\C(S)=N\c1ccccc1 Amb8468017 [0,0,0,0,0,1|1,1,0]=3 1863 B11R1.40 NOC(=O)Oc1ccccc1 Amb27967373 [0,0,0,0,0,1|2,0,0]=3 1864 B11R1.40 N\C(Cc1ccncc1)=N/O Amb6244226 [0,0,0,0,0,1|2,0,1]=4 1865 B11R1.40 N\N=C(/N)Cc1ccncc1 Amb18182747 [0,0,0,0,0,1|1,0,1]=3 1866 B11R1.40 N\N=C(\N)Nc1ccccc1 Amb25046170 [0,0,0,0,0,1|2,0,1]=4 1867 B11R1.40 O=C(CBr)Cc1ccccc1 Amb17569850 [0,0,0,0,0,1|3,0,0]=4 1868 B11R1.40 O=C(CBr)Nc1ccccc1 Amb2222053 [0,0,0,0,0,1|3,0,0]=4 1869 B11R1.40 O=C(CBr)Nc1ccncn1 Amb28198901 [0,0,0,0,0,1|3,0,0]=4 1870 B11R1.40 O=C(CBr)Oc1ccccc1 Amb3940897 [0,0,0,0,0,1|3,0,0]=4 1871 B11R1.40 O=C(CCl)Cc1ccccc1 Amb2371529 [0,0,0,0,0,1|3,0,0]=4 1872 B11R1.40 O=C(CCl)Cc1ccncc1 Amb27979082 [0,0,0,0,0,1|2,0,0]=3 1873 B11R1.40 O=C(CCl)Nc1ccccc1 Amb6333920 [0,0,0,0,0,1|3,0,0]=4 1874 B11R1.40 O=C(CCl)Nc1ccncc1 Amb1124841 [0,0,0,0,0,1|2,0,0]=3 1875 B11R1.40 O=C(CCl)Nc1ccncc1 Amb20623041 [0,0,0,0,0,1|2,0,0]=3 1876 B11R1.40 O=C(CCl)Oc1ccccc1 Amb1914503 [0,0,0,0,0,1|3,0,0]=4 1877 B11R1.40 O=C(CCl)Oc1ccncc1 Amb27484110 [0,0,0,0,0,1|2,0,0]=3 1878 B11R1.40 O=C(CF)Nc1ccccc1 Amb20246909 [0,0,0,0,0,1|3,0,0]=4 1879 B11R1.40 O=C(CI)Nc1ccccc1 Amb21964671 [0,0,0,0,0,1|3,0,0]=4 1880 B11R1.40 O=C(CO)Nc1ccccc1 Amb1110212 [0,0,0,0,0,1|3,0,0]=4 1881 B11R1.40 O=C(CO)Nc1ccncc1 Amb5798135 [0,0,0,0,0,1|2,0,0]=3 1882 B11R1.40 O=C(CS)Nc1ccccc1 Amb1349645 [0,0,0,0,0,1|3,0,0]=4 1883 B11R1.40 O=C(Cc1ccccn1)NO Amb28059218 [0,0,0,0,0,1|3,0,0]=4 1884 B11R1.40 O=C(NO)Nc1ccccc1 Amb2746999 [0,0,0,0,0,1|2,0,0]=3 1885 B11R1.40 O=C(NO)Oc1ccccc1 Amb22493600 [0,0,0,0,0,1|2,0,0]=3 1886 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,0,0,0,0,1|3,0,0]=4 1887 B11R1.40 O=CC(=O)Nc1ccccc1 Amb27643437 [0,0,0,0,0,1|3,0,0]=4 1888 B11R1.40 ONC(=S)Nc1ccccc1 Amb9824829 [0,0,0,0,0,1|2,1,0]=4 1889 B11R1.40 [NH3+]CC(=O)Nc1cc[nH+]cc1 Amb3990035 [0,0,0,0,0,1|1,0,2]=4 1890 B11R1.852 C=CC(=O)C1=CC=CC=CC1 Amb27854918 [0,0,0,0,0,1|3,0,0]=4 1891 B11R1.852 COC(=O)C1=CC=C=CC=C1 Amb24060625 [0,0,0,0,0,1|3,0,0]=4 1892 B11R1.852 COC(=O)C1=CC=CC=CC1 Amb27229360 [0,0,0,0,0,1|3,0,0]=4 1893 B11R1.852 COC(=O)C1=CC=CC=CO1 Amb27227839 [0,0,0,0,0,1|3,0,0]=4 1894 B11R1.852 COC(=O)C1=CCC=CC=C1 Amb28315041 [0,0,0,0,0,1|3,0,0]=4 1895 B11R1.852 O=C(NO)C1=CC=CC=CC1 Amb25225570 [0,0,0,0,0,1|2,0,0]=3 1896 B8R0.6 C\C=C\C=C\C(=O)NO Amb27449096 [1,0,1,0,0,0|1,0,1]=4 1897 B8R0.15 C=C\C(=C\C=O)C(=O)O Amb27789887 [1,0,1,0,0,0|2,0,0]=4 1898 B8R0.7 C=C\C=C\C=C\C(=O)O Amb28346293 [1,0,1,0,0,0|2,0,0]=4 1899 B8R1.2 BrCc1ccncc1 Amb3939991 [2,0,0,0,0,0|1,0,1]=4 1900 B8R1.2 BrCc1ccncc1 Amb9826062 [2,0,0,0,0,0|1,0,1]=4 1901 B8R1.2 C#Cc1ccncc1 Amb13891877 [2,0,0,0,0,0|1,0,1]=4 1902 B8R1.2 C#Cc1ccncc1 Amb33541704 [2,0,0,0,0,0|1,0,1]=4 1903 B8R1.2 C=Cc1ccccc1 Amb6608811 [2,0,0,0,0,0|2,0,0]=4 1904 B8R1.2 C=Cc1ccncc1 Amb3940417 [2,0,0,0,0,0|1,0,0]=3 1905 B8R1.2 C=Cc1ccncn1 Amb24056360 [2,0,0,0,0,0|2,0,0]=4 1906 B8R1.2 CCc1ccncc1 Amb8513449 [2,0,0,0,0,0|1,0,1]=4 1907 B8R1.2 CNc1ccccc1 Amb2721038 [2,0,0,0,0,0|2,0,0]=4 1908 B8R1.2 CNc1ccccc1 Amb4037054 [2,0,0,0,0,0|2,0,0]=4 1909 B8R1.2 CNc1ccncc1 Amb2610661 [2,0,0,0,0,0|1,0,0]=3 1910 B8R1.2 CNc1ccncn1 Amb18944730 [2,0,0,0,0,0|2,0,0]=4 1911 B8R1.2 CNc1ccnnc1 Amb23560757 [2,0,0,0,0,0|2,0,0]=4 1912 B8R1.2 COc1ccncc1 Amb2609546 [2,0,0,0,0,0|2,0,0]=4 1913 B8R1.2 COc1ccncc1 Amb28991347 [2,0,0,0,0,0|2,0,0]=4 1914 B8R1.2 CSc1ccncc1 Amb24103013 [2,0,0,0,0,0|2,0,0]=4 1915 B8R1.2 ClCc1ccncc1 Amb2715054 [2,0,0,0,0,0|1,0,1]=4 1916 B8R1.2 FCc1ccncc1 Amb22372287 [2,0,0,0,0,0|1,0,1]=4 1917 B8R1.2 ICc1ccncc1 Amb33552994 [2,0,0,0,0,0|1,0,1]=4 1918 B8R1.2 N#Cc1ccncc1 Amb2609937 [2,0,0,0,0,0|0,0,2]=4 1919 B8R1.2 NCc1ccccc1 Amb19958612 [2,0,0,0,0,0|1,0,1]=4 1920 B8R1.2 NCc1ccccc1 Amb2725314 [2,0,0,0,0,0|1,0,1]=4 1921 B8R1.2 NCc1ccccc1 Amb2792834 [2,0,0,0,0,0|1,0,1]=4 1922 B8R1.2 NCc1ccccc1 Amb6383294 [2,0,0,0,0,0|1,0,1]=4 1923 B8R1.2 NCc1ccncc1 Amb1156526 [2,0,0,0,0,0|0,0,1]=3 1924 B8R1.2 NCc1ccncc1 Amb20622010 [2,0,0,0,0,0|0,0,1]=3 1925 B8R1.2 NCc1ccncn1 Amb3941350 [2,0,0,0,0,0|1,0,1]=4 1926 B8R1.2 NCc1ccncn1 Amb7101495 [2,0,0,0,0,0|1,0,1]=4 1927 B8R1.2 NCc1ccncn1 Amb8503484 [2,0,0,0,0,0|1,0,1]=4 1928 B8R1.2 NCc1ccnnc1 Amb19957512 [2,0,0,0,0,0|1,0,1]=4 1929 B8R1.2 NCc1ccnnc1 Amb22405863 [2,0,0,0,0,0|1,0,1]=4 1930 B8R1.2 NCc1ccnnc1 Amb8009406 [2,0,0,0,0,0|1,0,1]=4 1931 B8R1.2 NNc1ccccc1 Amb22002446 [2,0,0,0,0,0|1,0,0]=3 1932 B8R1.2 NNc1ccccc1 Amb2793062 [2,0,0,0,0,0|1,0,0]=3 1933 B8R1.2 NNc1ccccc1 Amb8513467 [2,0,0,0,0,0|1,0,0]=3 1934 B8R1.2 NNc1ccccn1 Amb1104567 [2,0,0,0,0,0|2,0,0]=4 1935 B8R1.2 NNc1ccccn1 Amb6297231 [2,0,0,0,0,0|2,0,0]=4 1936 B8R1.2 NNc1cccnc1 Amb10177783 [2,0,0,0,0,0|2,0,0]=4 1937 B8R1.2 NNc1cccnc1 Amb16192849 [2,0,0,0,0,0|2,0,0]=4 1938 B8R1.2 NNc1cccnc1 Amb2092671 [2,0,0,0,0,0|2,0,0]=4 1939 B8R1.2 NNc1ccncc1 Amb32409472 [2,0,0,0,0,0|0,0,0]=2 1940 B8R1.2 NNc1ccncc1 Amb5494094 [2,0,0,0,0,0|0,0,0]=2 1941 B8R1.2 NNc1ccncc1 Amb6296706 [2,0,0,0,0,0|0,0,0]=2 1942 B8R1.2 NNc1ccncc1 Amb6297752 [2,0,0,0,0,0|0,0,0]=2 1943 B8R1.2 NNc1ccncn1 Amb22011554 [2,0,0,0,0,0|1,0,0]=3 1944 B8R1.2 NNc1ccncn1 Amb22757340 [2,0,0,0,0,0|1,0,0]=3 1945 B8R1.2 NNc1ccnnc1 Amb22896609 [2,0,0,0,0,0|1,0,0]=3 1946 B8R1.2 NNc1ccnnc1 Amb35750211 [2,0,0,0,0,0|1,0,0]=3 1947 B8R1.2 NOc1ccccc1 Amb18123833 [2,0,0,0,0,0|2,0,0]=4 1948 B8R1.2 NOc1ccccc1 Amb22231364 [2,0,0,0,0,0|2,0,0]=4 1949 B8R1.2 NOc1ccncc1 Amb8386473 [2,0,0,0,0,0|1,0,0]=3 1950 B8R1.2 O=Bc1ccccc1 Amb25221658 [2,0,0,0,0,0|2,0,0]=4 1951 B8R1.2 O=Cc1ccccc1 Amb2792754 [2,0,0,0,0,0|1,0,0]=3 1952 B8R1.2 O=Cc1ccccn1 Amb2720349 [2,0,0,0,0,0|2,0,0]=4 1953 B8R1.2 O=Cc1cccnc1 Amb2720350 [2,0,0,0,0,0|2,0,0]=4 1954 B8R1.2 O=Cc1ccncc1 Amb932832 [2,0,0,0,0,0|0,0,0]=2 1955 B8R1.2 O=Cc1ccncn1 Amb8009550 [2,0,0,0,0,0|1,0,0]=3 1956 B8R1.2 O=Cc1ccnnc1 Amb8010397 [2,0,0,0,0,0|1,0,0]=3 1957 B8R1.2 O=Cc1cnncn1 Amb18833127 [2,0,0,0,0,0|2,0,0]=4 1958 B8R1.2 O=Cc1ncncn1 Amb24409104 [2,0,0,0,0,0|2,0,0]=4 1959 B8R1.2 O=Nc1ccccc1 Amb9785158 [2,0,0,0,0,0|2,0,0]=4 1960 B8R1.2 O=Nc1ccnnc1 Amb28368778 [2,0,0,0,0,0|2,0,0]=4 1961 B8R1.2 O=[IH2]c1ccccc1 Amb15692855 [2,0,0,0,0,0|2,0,0]=4 1962 B8R1.2 OCc1ccncc1 Amb24183964 [2,0,0,0,0,0|0,0,2]=4 1963 B8R1.2 OCc1ccncc1 Amb2720348 [2,0,0,0,0,0|0,0,2]=4 1964 B8R1.2 ONc1ccccc1 Amb17672282 [2,0,0,0,0,0|2,0,0]=4 1965 B8R1.2 ONc1ccncc1 Amb27829868 [2,0,0,0,0,0|1,0,0]=3 1966 B8R1.2 SCc1ccncc1 Amb22008603 [2,0,0,0,0,0|0,1,1]=4 1967 B8R1.2 [C-]#[N+]c1ccncc1 Amb27805408 [2,0,0,0,0,0|1,0,1]=4 1968 B10R1.13 CC(=O)c1cc[n+](C)cc1 Amb32455995 [1,1,0,0,0,0|1,0,1]=4 1969 B10R1.13 CC(=O)c1ccc(Br)cc1 Amb1221363 [1,1,0,0,0,0|2,0,0]=4 1970 B10R1.13 CC(=O)c1ccc(C)cc1 Amb2447132 [1,1,0,0,0,0|2,0,0]=4 1971 B10R1.13 CC(=O)c1ccc(Cl)cc1 Amb2685747 [1,1,0,0,0,0|2,0,0]=4 1972 B10R1.13 CC(=O)c1ccc(F)cc1 Amb2688007 [1,1,0,0,0,0|2,0,0]=4 1973 B10R1.13 CC(=O)c1ccc(I)cc1 Amb1233200 [1,1,0,0,0,0|2,0,0]=4 1974 B10R1.13 CC(=O)c1ccc(N)cc1 Amb22734863 [1,1,0,0,0,0|2,0,0]=4 1975 B10R1.13 CC(=O)c1ccc(N)cc1 Amb534112 [1,1,0,0,0,0|2,0,0]=4 1976 B10R1.13 CC(=O)c1ccc(O)cc1 Amb1212250 [1,1,0,0,0,0|2,0,0]=4 1977 B10R1.13 CC(=O)c1ccc(S)cc1 Amb17593795 [1,1,0,0,0,0|2,0,0]=4 1978 B10R1.13 CN1C=CC(C(N)=O)=CC1 Amb27795981 [1,1,0,0,0,0|0,0,2]=4 1979 B10R1.13 C[n+]1ccc(C(N)=O)cc1 Amb2609609 [1,1,0,0,0,0|0,0,1]=3 1980 B10R1.13 Cc1ccc(C(=N)N)cc1 Amb2696306 [1,1,0,0,0,0|2,0,0]=4 1981 B10R1.13 Cc1ccc(C(=N)N)cc1 Amb2726087 [1,1,0,0,0,0|2,0,0]=4 1982 B10R1.13 Cc1ccc(C(=O)Cl)cc1 Amb3939031 [1,1,0,0,0,0|2,0,0]=4 1983 B10R1.13 Cc1ccc(C(=O)F)cc1 Amb27791617 [1,1,0,0,0,0|2,0,0]=4 1984 B10R1.13 Cc1ccc(C(=O)O)cc1 Amb2609016 [1,1,0,0,0,0|2,0,0]=4 1985 B10R1.13 Cc1ccc(C(N)=O)cc1 Amb6335792 [1,1,0,0,0,0|1,0,0]=3 1986 B10R1.13 Cc1ccc(C(N)=O)cn1 Amb2719765 [1,1,0,0,0,0|2,0,0]=4 1987 B10R1.13 Cc1ccc(C(N)=O)nc1 Amb25288938 [1,1,0,0,0,0|2,0,0]=4 1988 B10R1.13 Cc1ccc(C(N)=S)cc1 Amb6336552 [1,1,0,0,0,0|1,1,0]=4 1989 B10R1.13 Cc1ccc([S@@](N)=O)cc1 Amb16233804 [1,1,0,0,0,0|2,0,0]=4 1990 B10R1.13 Cc1ccc([S@](N)=O)cc1 Amb19889838 [1,1,0,0,0,0|2,0,0]=4 1991 B10R1.13 N=C(/N)c1ccc(N)cc1 Amb20665523 [1,1,0,0,0,0|2,0,0]=4 1992 B10R1.13 N=C(N)c1ccc(Br)cc1 Amb2695927 [1,1,0,0,0,0|2,0,0]=4 1993 B10R1.13 N=C(N)c1ccc(Br)cc1 Amb33551892 [1,1,0,0,0,0|2,0,0]=4 1994 B10R1.13 N=C(N)c1ccc(Br)cc1 Amb33553371 [1,1,0,0,0,0|2,0,0]=4 1995 B10R1.13 N=C(N)c1ccc(Cl)cc1 Amb1145037 [1,1,0,0,0,0|2,0,0]=4 1996 B10R1.13 N=C(N)c1ccc(Cl)cc1 Amb22489466 [1,1,0,0,0,0|2,0,0]=4 1997 B10R1.13 N=C(N)c1ccc(Cl)cc1 Amb2685750 [1,1,0,0,0,0|2,0,0]=4 1998 B10R1.13 N=C(N)c1ccc(Cl)cc1 Amb4007580 [1,1,0,0,0,0|2,0,0]=4 1999 B10R1.13 N=C(N)c1ccc(F)cc1 Amb2694799 [1,1,0,0,0,0|2,0,0]=4 2000 B10R1.13 N=C(N)c1ccc(F)cc1 Amb2697890 [1,1,0,0,0,0|2,0,0]=4 2001 B10R1.13 N=C(N)c1ccc(F)cc1 Amb4296874 [1,1,0,0,0,0|2,0,0]=4 2002 B10R1.13 N=C(N)c1ccc(F)cc1 Amb7365497 [1,1,0,0,0,0|2,0,0]=4 2003 B10R1.13 N=C(N)c1ccc(I)cc1 Amb22463737 [1,1,0,0,0,0|2,0,0]=4 2004 B10R1.13 N=C(N)c1ccc(I)cc1 Amb2700571 [1,1,0,0,0,0|2,0,0]=4 2005 B10R1.13 N=C(N)c1ccc(N)cc1 Amb2694849 [1,1,0,0,0,0|2,0,0]=4 2006 B10R1.13 N=C(N)c1ccc(N)cc1 Amb2720214 [1,1,0,0,0,0|2,0,0]=4 2007 B10R1.13 N=C(N)c1ccc(N)cc1 Amb2720432 [1,1,0,0,0,0|2,0,0]=4 2008 B10R1.13 N=C(N)c1ccc(O)cc1 Amb2691367 [1,1,0,0,0,0|2,0,0]=4 2009 B10R1.13 N=C(N)c1ccc(O)cc1 Amb2696161 [1,1,0,0,0,0|2,0,0]=4 2010 B10R1.13 NC(=O)C1=CNC(=O)C=C1 Amb19419628 [1,1,0,0,0,0|2,0,0]=4 2011 B10R1.13 NC(=O)C1=COC(=O)C=C1 Amb25147558 [1,1,0,0,0,0|2,0,0]=4 2012 B10R1.13 NC(=O)c1cc[n+]([O-])cc1 Amb10573737 [1,1,0,0,0,0|0,0,1]=3 2013 B10R1.13 NC(=O)c1ccc(Br)cc1 Amb1232839 [1,1,0,0,0,0|1,0,0]=3 2014 B10R1.13 NC(=O)c1ccc(Br)cn1 Amb2795794 [1,1,0,0,0,0|2,0,0]=4 2015 B10R1.13 NC(=O)c1ccc(Br)nc1 Amb10070703 [1,1,0,0,0,0|2,0,0]=4 2016 B10R1.13 NC(=O)c1ccc(Cl)cc1 Amb2778205 [1,1,0,0,0,0|1,0,0]=3 2017 B10R1.13 NC(=O)c1ccc(Cl)cn1 Amb22500440 [1,1,0,0,0,0|2,0,0]=4 2018 B10R1.13 NC(=O)c1ccc(Cl)nc1 Amb6370850 [1,1,0,0,0,0|2,0,0]=4 2019 B10R1.13 NC(=O)c1ccc(F)cc1 Amb1230540 [1,1,0,0,0,0|1,0,0]=3 2020 B10R1.13 NC(=O)c1ccc(F)cn1 Amb22001839 [1,1,0,0,0,0|2,0,0]=4 2021 B10R1.13 NC(=O)c1ccc(F)nc1 Amb33545196 [1,1,0,0,0,0|2,0,0]=4 2022 B10R1.13 NC(=O)c1ccc(I)cc1 Amb2227687 [1,1,0,0,0,0|1,0,0]=3 2023 B10R1.13 NC(=O)c1ccc(I)cn1 Amb24482132 [1,1,0,0,0,0|2,0,0]=4 2024 B10R1.13 NC(=O)c1ccc(I)nc1 Amb28436361 [1,1,0,0,0,0|2,0,0]=4 2025 B10R1.13 NC(=O)c1ccc(N)cc1 Amb6364742 [1,1,0,0,0,0|1,0,0]=3 2026 B10R1.13 NC(=O)c1ccc(N)cn1 Amb8397288 [1,1,0,0,0,0|2,0,0]=4 2027 B10R1.13 NC(=O)c1ccc(N)nc1 Amb3997308 [1,1,0,0,0,0|2,0,0]=4 2028 B10R1.13 NC(=O)c1ccc(O)cc1 Amb1240570 [1,1,0,0,0,0|1,0,0]=3 2029 B10R1.13 NC(=O)c1ccc(O)cc1 Amb13951374 [1,1,0,0,0,0|1,0,0]=3 2030 B10R1.13 NC(=O)c1ccc(O)cn1 Amb27175316 [1,1,0,0,0,0|2,0,0]=4 2031 B10R1.13 NC(=O)c1ccc(O)nc1 Amb2371669 [1,1,0,0,0,0|2,0,0]=4 2032 B10R1.13 NC(=O)c1ccc(S)cc1 Amb27471980 [1,1,0,0,0,0|1,0,0]=3 2033 B10R1.13 NC(=O)c1ccc(S)nc1 Amb24081719 [1,1,0,0,0,0|2,0,0]=4 2034 B10R1.13 NC(=S)c1cc[n+]([O-])cc1 Amb27832381 [1,1,0,0,0,0|0,1,1]=4 2035 B10R1.13 NC(=S)c1ccc(Br)cc1 Amb1152460 [1,1,0,0,0,0|1,1,0]=4 2036 B10R1.13 NC(=S)c1ccc(Cl)cc1 Amb2589364 [1,1,0,0,0,0|1,1,0]=4 2037 B10R1.13 NC(=S)c1ccc(F)cc1 Amb1152550 [1,1,0,0,0,0|1,1,0]=4 2038 B10R1.13 NC(=S)c1ccc(I)cc1 Amb18617991 [1,1,0,0,0,0|1,1,0]=4 2039 B10R1.13 NC(=S)c1ccc(N)cc1 Amb2684536 [1,1,0,0,0,0|1,1,0]=4 2040 B10R1.13 NC(=S)c1ccc(O)cc1 Amb1154194 [1,1,0,0,0,0|1,1,0]=4 2041 B10R1.13 NC(=S)c1ccc(S)cc1 Amb27862119 [1,1,0,0,0,0|1,1,0]=4 2042 B10R1.13 NC(N)=C1C=CC(=O)C=C1 Amb25278698 [1,1,0,0,0,0|2,0,0]=4 2043 B10R1.13 NC(N)=C1C=CC(=O)C=C1 Amb33513098 [1,1,0,0,0,0|2,0,0]=4 2044 B10R1.13 N[n+]1ccc(C(=O)[O-])cc1 Amb10560830 [1,1,0,0,0,0|1,0,1]=4 2045 B10R1.13 Nc1ccc(C(=O)Br)cc1 Amb28186157 [1,1,0,0,0,0|2,0,0]=4 2046 B10R1.13 Nc1ccc(C(=O)Cl)cc1 Amb2609001 [1,1,0,0,0,0|2,0,0]=4 2047 B10R1.13 Nc1ccc(C(=O)O)cc1 Amb24066899 [1,1,0,0,0,0|2,0,0]=4 2048 B10R1.13 Nc1ccc(C(=O)O)cc1 Amb6238177 [1,1,0,0,0,0|2,0,0]=4 2049 B10R1.13 Nc1ccc(C(=O)[O-])cc1 Amb6296721 [1,1,0,0,0,0|2,0,0]=4 2050 B10R1.13 Nc1ccc(C(=O)[O-])cc1 Amb6366456 [1,1,0,0,0,0|2,0,0]=4 2051 B10R1.13 O=C(Cl)c1cc[n+]([O-])cc1 Amb27822960 [1,1,0,0,0,0|1,0,1]=4 2052 B10R1.13 O=C(Cl)c1ccc(Br)cc1 Amb2684956 [1,1,0,0,0,0|2,0,0]=4 2053 B10R1.13 O=C(Cl)c1ccc(Cl)cc1 Amb3939199 [1,1,0,0,0,0|2,0,0]=4 2054 B10R1.13 O=C(Cl)c1ccc(F)cc1 Amb2688034 [1,1,0,0,0,0|2,0,0]=4 2055 B10R1.13 O=C(Cl)c1ccc(I)cc1 Amb3939136 [1,1,0,0,0,0|2,0,0]=4 2056 B10R1.13 O=C(Cl)c1ccc(O)cc1 Amb6743399 [1,1,0,0,0,0|2,0,0]=4 2057 B10R1.13 O=C(F)c1ccc(Br)cc1 Amb27403647 [1,1,0,0,0,0|2,0,0]=4 2058 B10R1.13 O=C(F)c1ccc(Cl)cc1 Amb27798433 [1,1,0,0,0,0|2,0,0]=4 2059 B10R1.13 O=C(F)c1ccc(F)cc1 Amb27871316 [1,1,0,0,0,0|2,0,0]=4 2060 B10R1.13 O=C(O)c1cc[n+]([O-])cc1 Amb751855 [1,1,0,0,0,0|1,0,1]=4 2061 B10R1.13 O=C(O)c1ccc(Br)cc1 Amb1935068 [1,1,0,0,0,0|2,0,0]=4 2062 B10R1.13 O=C(O)c1ccc(Cl)cc1 Amb2792854 [1,1,0,0,0,0|2,0,0]=4 2063 B10R1.13 O=C(O)c1ccc(F)cc1 Amb2688024 [1,1,0,0,0,0|2,0,0]=4 2064 B10R1.13 O=C(O)c1ccc(I)cc1 Amb6446256 [1,1,0,0,0,0|2,0,0]=4 2065 B10R1.13 O=C(O)c1ccc(O)cc1 Amb2569657 [1,1,0,0,0,0|2,0,0]=4 2066 B10R1.13 O=C(O)c1ccc(S)cc1 Amb2371749 [1,1,0,0,0,0|2,0,0]=4 2067 B10R1.13 O=C([O-])c1ccc(F)cc1 Amb8397065 [1,1,0,0,0,0|2,0,0]=4 2068 B10R1.13 O=C([O-])c1ccc(O)cc1 Amb8517584 [1,1,0,0,0,0|2,0,0]=4 2069 B10R1.28 CC(C)(N)c1ccncc1 Amb33543742 [1,1,0,0,0,0|1,0,1]=4 2070 B10R1.28 CS(=N)(=O)c1ccncc1 Amb27482413 [1,1,0,0,0,0|1,0,1]=4 2071 B10R1.28 C[S@](=N)(=O)c1ccncc1 Amb33744004 [1,1,0,0,0,0|1,0,1]=4 2072 B10R1.28 NP(N)(=O)c1ccccc1 Amb26955815 [1,1,0,0,0,0|2,0,0]=4 2073 B10R1.28 NS(=O)(=O)c1ccccc1 Amb1134014 [1,1,0,0,0,0|2,0,0]=4 2074 B10R1.28 NS(=O)(=O)c1ccncc1 Amb18799913 [1,1,0,0,0,0|1,0,0]=3 2075 B10R1.28 NS(=O)(=O)c1ccncn1 Amb18800077 [1,1,0,0,0,0|2,0,0]=4 2076 B10R1.28 O=S(=O)(Cl)c1ccncc1 Amb16231439 [1,1,0,0,0,0|2,0,0]=4 2077 B10R1.28 O=S(=O)(Cl)c1ccncc1 Amb21864721 [1,1,0,0,0,0|2,0,0]=4 2078 B10R1.28 O=S(=O)(F)c1ccncc1 Amb32665787 [1,1,0,0,0,0|2,0,0]=4 2079 B10R1.28 O=S(=O)(O)c1ccncc1 Amb10071269 [1,1,0,0,0,0|2,0,0]=4 2080 B10R1.28 O=S(=O)([O-])c1ccncc1 Amb8438920 [1,1,0,0,0,0|2,0,0]=4 2081 B10R1.61 C=C(C)c1ccncc1Br Amb26877381 [1,1,0,0,0,0|2,0,0]=4 2082 B10R1.61 C=C(C)c1ccncc1C Amb32641687 [1,1,0,0,0,0|2,0,0]=4 2083 B10R1.61 C=C(C)c1ccncc1Cl Amb32641695 [1,1,0,0,0,0|2,0,0]=4 2084 B10R1.61 C=C(C)c1ccncc1F Amb32641685 [1,1,0,0,0,0|2,0,0]=4 2085 B10R1.61 C=C(C)c1ccncc1N Amb27866575 [1,1,0,0,0,0|2,0,0]=4 2086 B10R1.61 CC(=O)c1ccccc1Br Amb1232838 [1,1,0,0,0,0|2,0,0]=4 2087 B10R1.61 CC(=O)c1ccccc1C Amb2792441 [1,1,0,0,0,0|2,0,0]=4 2088 B10R1.61 CC(=O)c1ccccc1Cl Amb2685746 [1,1,0,0,0,0|2,0,0]=4 2089 B10R1.61 CC(=O)c1ccccc1F Amb2688005 [1,1,0,0,0,0|2,0,0]=4 2090 B10R1.61 CC(=O)c1ccccc1I Amb8517635 [1,1,0,0,0,0|2,0,0]=4 2091 B10R1.61 CC(=O)c1ccccc1N Amb2725478 [1,1,0,0,0,0|2,0,0]=4 2092 B10R1.61 CC(=O)c1ccccc1N Amb6296708 [1,1,0,0,0,0|2,0,0]=4 2093 B10R1.61 CC(=O)c1ccccc1O Amb2792764 [1,1,0,0,0,0|2,0,0]=4 2094 B10R1.61 CC(=O)c1ccccc1S Amb22396354 [1,1,0,0,0,0|2,0,0]=4 2095 B10R1.61 CC(=O)c1ccncc1Br Amb21858252 [1,1,0,0,0,0|1,0,0]=3 2096 B10R1.61 CC(=O)c1ccncc1C Amb25757892 [1,1,0,0,0,0|1,0,0]=3 2097 B10R1.61 CC(=O)c1ccncc1Cl Amb22494032 [1,1,0,0,0,0|1,0,0]=3 2098 B10R1.61 CC(=O)c1ccncc1F Amb10603317 [1,1,0,0,0,0|1,0,0]=3 2099 B10R1.61 CC(=O)c1ccncc1I Amb24638217 [1,1,0,0,0,0|1,0,0]=3 2100 B10R1.61 CC(=O)c1ccncc1N Amb29083603 [1,1,0,0,0,0|1,0,0]=3 2101 B10R1.61 CC(=O)c1ccncc1N Amb8386717 [1,1,0,0,0,0|1,0,0]=3 2102 B10R1.61 CC(=O)c1ccncc1O Amb18643112 [1,1,0,0,0,0|1,0,0]=3 2103 B10R1.61 CC(=O)c1ccncc1S Amb27215298 [1,1,0,0,0,0|1,0,0]=3 2104 B10R1.61 CC(=O)c1ncncc1Br Amb21856954 [1,1,0,0,0,0|2,0,0]=4 2105 B10R1.61 CC(=O)c1ncncc1F Amb27861475 [1,1,0,0,0,0|2,0,0]=4 2106 B10R1.61 CC(N)c1ccncc1Br Amb26057206 [1,1,0,0,0,0|1,0,1]=4 2107 B10R1.61 CC(N)c1ccncc1Br Amb32753261 [1,1,0,0,0,0|1,0,1]=4 2108 B10R1.61 CC(N)c1ccncc1Cl Amb25887560 [1,1,0,0,0,0|1,0,1]=4 2109 B10R1.61 CC(N)c1ccncc1F Amb25146247 [1,1,0,0,0,0|1,0,1]=4 2110 B10R1.61 CC(N)c1ccncc1N Amb23400503 [1,1,0,0,0,0|1,0,1]=4 2111 B10R1.61 CC(N)c1ccncc1O Amb27856504 [1,1,0,0,0,0|1,0,1]=4 2112 B10R1.61 C[C@@H](N)c1ccncc1Br Amb27665649 [1,1,0,0,0,0|1,0,1]=4 2113 B10R1.61 C[C@@H](N)c1ccncc1Br Amb32675467 [1,1,0,0,0,0|1,0,1]=4 2114 B10R1.61 C[C@@H](N)c1ccncc1Cl Amb26619398 [1,1,0,0,0,0|1,0,1]=4 2115 B10R1.61 C[C@@H](N)c1ccncc1F Amb27875029 [1,1,0,0,0,0|1,0,1]=4 2116 B10R1.61 C[C@H](N)c1ccncc1Br Amb25890127 [1,1,0,0,0,0|1,0,1]=4 2117 B10R1.61 C[C@H](N)c1ccncc1Br Amb32675466 [1,1,0,0,0,0|1,0,1]=4 2118 B10R1.61 C[C@H](N)c1ccncc1Cl Amb25742943 [1,1,0,0,0,0|1,0,1]=4 2119 B10R1.61 C[C@H](N)c1ccncc1F Amb25289879 [1,1,0,0,0,0|1,0,1]=4 2120 B10R1.61 C[C@H](N)c1ccncc1O Amb28325117 [1,1,0,0,0,0|1,0,1]=4 2121 B10R1.61 C[n+]1ccccc1C(N)=O Amb2610083 [1,1,0,0,0,0|2,0,0]=4 2122 B10R1.61 Cc1ccccc1C(=N)N Amb10607001 [1,1,0,0,0,0|2,0,0]=4 2123 B10R1.61 Cc1ccccc1C(=N)N Amb2696284 [1,1,0,0,0,0|2,0,0]=4 2124 B10R1.61 Cc1ccccc1C(=O)Br Amb17844075 [1,1,0,0,0,0|2,0,0]=4 2125 B10R1.61 Cc1ccccc1C(=O)Cl Amb3939039 [1,1,0,0,0,0|2,0,0]=4 2126 B10R1.61 Cc1ccccc1C(=O)O Amb2609023 [1,1,0,0,0,0|2,0,0]=4 2127 B10R1.61 Cc1ccccc1C(N)=O Amb2720842 [1,1,0,0,0,0|1,0,0]=3 2128 B10R1.61 Cc1ccccc1C(N)=S Amb6550210 [1,1,0,0,0,0|1,1,0]=4 2129 B10R1.61 Cc1cccnc1C(N)=O Amb5722196 [1,1,0,0,0,0|2,0,0]=4 2130 B10R1.61 Cc1ccncc1C(N)=O Amb2609600 [1,1,0,0,0,0|2,0,0]=4 2131 B10R1.61 Cc1cnccc1C(=N)N Amb27823577 [1,1,0,0,0,0|1,0,0]=3 2132 B10R1.61 Cc1cnccc1C(=N)N Amb32409434 [1,1,0,0,0,0|1,0,0]=3 2133 B10R1.61 Cc1cnccc1C(=O)Cl Amb27838876 [1,1,0,0,0,0|1,0,0]=3 2134 B10R1.61 Cc1cnccc1C(=O)O Amb1950722 [1,1,0,0,0,0|1,0,0]=3 2135 B10R1.61 Cc1cnccc1C(=O)O Amb22490345 [1,1,0,0,0,0|1,0,0]=3 2136 B10R1.61 Cc1cnccc1C(C)N Amb26433213 [1,1,0,0,0,0|1,0,1]=4 2137 B10R1.61 Cc1cnccc1C(N)=O Amb33542976 [1,1,0,0,0,0|0,0,0]=2 2138 B10R1.61 Cc1cnccc1C(N)=S Amb26501773 [1,1,0,0,0,0|0,1,0]=3 2139 B10R1.61 Cc1cnccc1N(=O)=O Amb20621691 [1,1,0,0,0,0|2,0,0]=4 2140 B10R1.61 Cc1cnccc1S(=O)O Amb32992439 [1,1,0,0,0,0|2,0,0]=4 2141 B10R1.61 Cc1cnccc1S(=O)[O-] Amb32992516 [1,1,0,0,0,0|2,0,0]=4 2142 B10R1.61 Cc1cnccc1[C@@H](C)N Amb26501750 [1,1,0,0,0,0|1,0,1]=4 2143 B10R1.61 Cc1cnccc1[C@H](C)N Amb27876688 [1,1,0,0,0,0|1,0,1]=4 2144 B10R1.61 Cc1cnccc1[N+](=O)[O-] Amb22167759 [1,1,0,0,0,0|2,0,0]=4 2145 B10R1.61 Cc1cnccc1[N+](=O)[O-] Amb2610790 [1,1,0,0,0,0|2,0,0]=4 2146 B10R1.61 Cc1cncnc1C(=O)Cl Amb27847149 [1,1,0,0,0,0|2,0,0]=4 2147 B10R1.61 Cc1cncnc1C(=O)O Amb22497343 [1,1,0,0,0,0|2,0,0]=4 2148 B10R1.61 Cc1cnncc1C(=O)O Amb18832259 [1,1,0,0,0,0|2,0,0]=4 2149 B10R1.61 Cc1ncccc1C(N)=O Amb16231197 [1,1,0,0,0,0|2,0,0]=4 2150 B10R1.61 Cc1nnccc1C(=O)O Amb18832267 [1,1,0,0,0,0|2,0,0]=4 2151 B10R1.61 N=C(N)c1ccccc1Br Amb2695923 [1,1,0,0,0,0|2,0,0]=4 2152 B10R1.61 N=C(N)c1ccccc1Br Amb33552522 [1,1,0,0,0,0|2,0,0]=4 2153 B10R1.61 N=C(N)c1ccccc1Cl Amb2696044 [1,1,0,0,0,0|2,0,0]=4 2154 B10R1.61 N=C(N)c1ccccc1Cl Amb2783778 [1,1,0,0,0,0|2,0,0]=4 2155 B10R1.61 N=C(N)c1ccccc1F Amb2696613 [1,1,0,0,0,0|2,0,0]=4 2156 B10R1.61 N=C(N)c1ccccc1F Amb2699659 [1,1,0,0,0,0|2,0,0]=4 2157 B10R1.61 N=C(N)c1ccccc1F Amb28555477 [1,1,0,0,0,0|2,0,0]=4 2158 B10R1.61 N=C(N)c1ccccc1I Amb2700569 [1,1,0,0,0,0|2,0,0]=4 2159 B10R1.61 N=C(N)c1ccccc1N Amb24559098 [1,1,0,0,0,0|2,0,0]=4 2160 B10R1.61 N=C(N)c1ccccc1O Amb2696249 [1,1,0,0,0,0|2,0,0]=4 2161 B10R1.61 N=C(N)c1ccccc1O Amb8630174 [1,1,0,0,0,0|2,0,0]=4 2162 B10R1.61 N=C(N)c1ccccc1S Amb27465157 [1,1,0,0,0,0|2,0,0]=4 2163 B10R1.61 N=C(N)c1ccncc1Br Amb27259514 [1,1,0,0,0,0|1,0,0]=3 2164 B10R1.61 N=C(N)c1ccncc1Cl Amb28066565 [1,1,0,0,0,0|1,0,0]=3 2165 B10R1.61 N=C(N)c1ccncc1F Amb33316478 [1,1,0,0,0,0|1,0,0]=3 2166 B10R1.61 N=C(N)c1ccncc1N Amb28049445 [1,1,0,0,0,0|1,0,0]=3 2167 B10R1.61 N=C(N)c1ccnnc1N Amb27954325 [1,1,0,0,0,0|2,0,0]=4 2168 B10R1.61 N=C(N)c1ccnnc1O Amb28244599 [1,1,0,0,0,0|2,0,0]=4 2169 B10R1.61 NC(=O)C1=CC=NNC1=O Amb21857104 [1,1,0,0,0,0|1,0,0]=3 2170 B10R1.61 NC(=O)C1=COC=CC1=O Amb26392241 [1,1,0,0,0,0|2,0,0]=4 2171 B10R1.61 NC(=O)c1cccc[n+]1[O-] Amb2611966 [1,1,0,0,0,0|2,0,0]=4 2172 B10R1.61 NC(=O)c1ccccc1Br Amb2684949 [1,1,0,0,0,0|1,0,0]=3 2173 B10R1.61 NC(=O)c1ccccc1Cl Amb2611996 [1,1,0,0,0,0|1,0,0]=3 2174 B10R1.61 NC(=O)c1ccccc1F Amb1221270 [1,1,0,0,0,0|1,0,0]=3 2175 B10R1.61 NC(=O)c1ccccc1I Amb2384520 [1,1,0,0,0,0|1,0,0]=3 2176 B10R1.61 NC(=O)c1ccccc1N Amb1212111 [1,1,0,0,0,0|1,0,0]=3 2177 B10R1.61 NC(=O)c1ccccc1O Amb1935248 [1,1,0,0,0,0|1,0,0]=3 2178 B10R1.61 NC(=O)c1ccccc1S Amb6256729 [1,1,0,0,0,0|1,0,0]=3 2179 B10R1.61 NC(=O)c1cccnc1Br Amb2609526 [1,1,0,0,0,0|2,0,0]=4 2180 B10R1.61 NC(=O)c1cccnc1Cl Amb1239475 [1,1,0,0,0,0|2,0,0]=4 2181 B10R1.61 NC(=O)c1cccnc1F Amb16231205 [1,1,0,0,0,0|2,0,0]=4 2182 B10R1.61 NC(=O)c1cccnc1I Amb28315909 [1,1,0,0,0,0|2,0,0]=4 2183 B10R1.61 NC(=O)c1cccnc1N Amb13951562 [1,1,0,0,0,0|2,0,0]=4 2184 B10R1.61 NC(=O)c1cccnc1N Amb8833945 [1,1,0,0,0,0|2,0,0]=4 2185 B10R1.61 NC(=O)c1cccnc1O Amb18643213 [1,1,0,0,0,0|2,0,0]=4 2186 B10R1.61 NC(=O)c1cccnc1S Amb1131765 [1,1,0,0,0,0|2,0,0]=4 2187 B10R1.61 NC(=O)c1ccncc1Br Amb19957712 [1,1,0,0,0,0|0,0,0]=2 2188 B10R1.61 NC(=O)c1ccncc1Cl Amb22490741 [1,1,0,0,0,0|0,0,0]=2 2189 B10R1.61 NC(=O)c1ccncc1F Amb20241733 [1,1,0,0,0,0|0,0,0]=2 2190 B10R1.61 NC(=O)c1ccncc1I Amb25204440 [1,1,0,0,0,0|0,0,0]=2 2191 B10R1.61 NC(=O)c1ccncc1N Amb10069339 [1,1,0,0,0,0|0,0,0]=2 2192 B10R1.61 NC(=O)c1ccncc1N Amb19374970 [1,1,0,0,0,0|0,0,0]=2 2193 B10R1.61 NC(=O)c1ccncc1N Amb30588533 [1,1,0,0,0,0|0,0,0]=2 2194 B10R1.61 NC(=O)c1ccncc1O Amb23401565 [1,1,0,0,0,0|0,0,0]=2 2195 B10R1.61 NC(=O)c1ccncc1S Amb25263979 [1,1,0,0,0,0|0,0,0]=2 2196 B10R1.61 NC(=O)c1ccnnc1N Amb24099505 [1,1,0,0,0,0|1,0,0]=3 2197 B10R1.61 NC(=O)c1cnccc1Cl Amb33544011 [1,1,0,0,0,0|2,0,0]=4 2198 B10R1.61 NC(=O)c1cnccc1F Amb26979844 [1,1,0,0,0,0|2,0,0]=4 2199 B10R1.61 NC(=O)c1cnccc1N Amb21927713 [1,1,0,0,0,0|2,0,0]=4 2200 B10R1.61 NC(=O)c1cnccc1N Amb8396942 [1,1,0,0,0,0|2,0,0]=4 2201 B10R1.61 NC(=O)c1cnccc1O Amb5493990 [1,1,0,0,0,0|2,0,0]=4 2202 B10R1.61 NC(=O)c1cnccc1S Amb27862502 [1,1,0,0,0,0|2,0,0]=4 2203 B10R1.61 NC(=O)c1ncccc1Cl Amb23399605 [1,1,0,0,0,0|2,0,0]=4 2204 B10R1.61 NC(=O)c1ncccc1F Amb23412448 [1,1,0,0,0,0|2,0,0]=4 2205 B10R1.61 NC(=O)c1ncccc1N Amb2700629 [1,1,0,0,0,0|2,0,0]=4 2206 B10R1.61 NC(=O)c1ncccc1O Amb6600564 [1,1,0,0,0,0|2,0,0]=4 2207 B10R1.61 NC(=O)c1ncccc1S Amb25114764 [1,1,0,0,0,0|2,0,0]=4 2208 B10R1.61 NC(=O)c1ncncc1Br Amb22499710 [1,1,0,0,0,0|1,0,0]=3 2209 B10R1.61 NC(=O)c1ncncc1Cl Amb27660457 [1,1,0,0,0,0|1,0,0]=3 2210 B10R1.61 NC(=O)c1ncnnc1N Amb27615046 [1,1,0,0,0,0|2,0,0]=4 2211 B10R1.61 NC(=S)c1ccccc1Br Amb2685503 [1,1,0,0,0,0|1,1,0]=4 2212 B10R1.61 NC(=S)c1ccccc1Cl Amb2686480 [1,1,0,0,0,0|1,1,0]=4 2213 B10R1.61 NC(=S)c1ccccc1F Amb1264600 [1,1,0,0,0,0|1,1,0]=4 2214 B10R1.61 NC(=S)c1ccccc1I Amb19889459 [1,1,0,0,0,0|1,1,0]=4 2215 B10R1.61 NC(=S)c1ccccc1N Amb1217775 [1,1,0,0,0,0|1,1,0]=4 2216 B10R1.61 NC(=S)c1ccccc1O Amb33538948 [1,1,0,0,0,0|1,1,0]=4 2217 B10R1.61 NC(=S)c1ccncc1Br Amb28050027 [1,1,0,0,0,0|0,1,0]=3 2218 B10R1.61 NC(=S)c1ccncc1Cl Amb25889916 [1,1,0,0,0,0|0,1,0]=3 2219 B10R1.61 NC(=S)c1ccncc1F Amb24731409 [1,1,0,0,0,0|0,1,0]=3 2220 B10R1.61 N\C(S)=C1\C=CC=CC1=O Amb33512975 [1,1,0,0,0,0|1,1,0]=4 2221 B10R1.61 Nc1ccccc1C(=O)O Amb1933714 [1,1,0,0,0,0|2,0,0]=4 2222 B10R1.61 Nc1cnccc1C(=O)O Amb1058763 [1,1,0,0,0,0|1,0,0]=3 2223 B10R1.61 Nc1cnccc1[N+](=O)[O-] Amb10602772 [1,1,0,0,0,0|2,0,0]=4 2224 B10R1.61 Nc1cncnc1C(=O)O Amb5751296 [1,1,0,0,0,0|2,0,0]=4 2225 B10R1.61 Nc1nnccc1C(=O)O Amb2695218 [1,1,0,0,0,0|2,0,0]=4 2226 B10R1.61 O=C(Cl)c1ccccc1Br Amb2684955 [1,1,0,0,0,0|2,0,0]=4 2227 B10R1.61 O=C(Cl)c1ccccc1Cl Amb3939030 [1,1,0,0,0,0|2,0,0]=4 2228 B10R1.61 O=C(Cl)c1ccccc1F Amb2688032 [1,1,0,0,0,0|2,0,0]=4 2229 B10R1.61 O=C(Cl)c1ccccc1I Amb3939135 [1,1,0,0,0,0|2,0,0]=4 2230 B10R1.61 O=C(Cl)c1ccccc1O Amb6743363 [1,1,0,0,0,0|2,0,0]=4 2231 B10R1.61 O=C(Cl)c1ccccc1S Amb25770152 [1,1,0,0,0,0|2,0,0]=4 2232 B10R1.61 O=C(Cl)c1ccncc1Br Amb24668867 [1,1,0,0,0,0|1,0,0]=3 2233 B10R1.61 O=C(Cl)c1ccncc1Br Amb32663165 [1,1,0,0,0,0|1,0,0]=3 2234 B10R1.61 O=C(Cl)c1ccncc1Cl Amb24117133 [1,1,0,0,0,0|1,0,0]=3 2235 B10R1.61 O=C(Cl)c1ccnnc1Cl Amb33471795 [1,1,0,0,0,0|2,0,0]=4 2236 B10R1.61 O=C(Cl)c1ncncc1Cl Amb27164860 [1,1,0,0,0,0|2,0,0]=4 2237 B10R1.61 O=C(Cl)c1ncncc1F Amb27638477 [1,1,0,0,0,0|2,0,0]=4 2238 B10R1.61 O=C(O)C1=CC=NNC1=O Amb18643481 [1,1,0,0,0,0|2,0,0]=4 2239 B10R1.61 O=C(O)C1=CNN=CC1=O Amb18202917 [1,1,0,0,0,0|2,0,0]=4 2240 B10R1.61 O=C(O)c1ccccc1Br Amb6365362 [1,1,0,0,0,0|2,0,0]=4 2241 B10R1.61 O=C(O)c1ccccc1Cl Amb1935156 [1,1,0,0,0,0|2,0,0]=4 2242 B10R1.61 O=C(O)c1ccccc1F Amb2688022 [1,1,0,0,0,0|2,0,0]=4 2243 B10R1.61 O=C(O)c1ccccc1I Amb6446255 [1,1,0,0,0,0|2,0,0]=4 2244 B10R1.61 O=C(O)c1ccccc1O Amb1912504 [1,1,0,0,0,0|2,0,0]=4 2245 B10R1.61 O=C(O)c1ccccc1S Amb901970 [1,1,0,0,0,0|2,0,0]=4 2246 B10R1.61 O=C(O)c1ccncc1Br Amb1094019 [1,1,0,0,0,0|1,0,0]=3 2247 B10R1.61 O=C(O)c1ccncc1Cl Amb2447292 [1,1,0,0,0,0|1,0,0]=3 2248 B10R1.61 O=C(O)c1ccncc1F Amb10840476 [1,1,0,0,0,0|1,0,0]=3 2249 B10R1.61 O=C(O)c1ccncc1F Amb2447421 [1,1,0,0,0,0|1,0,0]=3 2250 B10R1.61 O=C(O)c1ccncc1I Amb2610033 [1,1,0,0,0,0|1,0,0]=3 2251 B10R1.61 O=C(O)c1ccncc1O Amb2609529 [1,1,0,0,0,0|1,0,0]=3 2252 B10R1.61 O=C(O)c1ccncc1S Amb18644719 [1,1,0,0,0,0|1,0,0]=3 2253 B10R1.61 O=C(O)c1ccnnc1Br Amb27209034 [1,1,0,0,0,0|2,0,0]=4 2254 B10R1.61 O=C(O)c1ccnnc1Cl Amb20240930 [1,1,0,0,0,0|2,0,0]=4 2255 B10R1.61 O=C(O)c1ccnnc1S Amb33551102 [1,1,0,0,0,0|2,0,0]=4 2256 B10R1.61 O=C(O)c1cnncc1Br Amb27793823 [1,1,0,0,0,0|2,0,0]=4 2257 B10R1.61 O=C(O)c1ncncc1Br Amb4443270 [1,1,0,0,0,0|2,0,0]=4 2258 B10R1.61 O=C(O)c1ncncc1Cl Amb5751295 [1,1,0,0,0,0|2,0,0]=4 2259 B10R1.61 O=C(O)c1ncncc1F Amb27630158 [1,1,0,0,0,0|2,0,0]=4 2260 B10R1.61 O=C([O-])c1ccccc1Cl Amb2610308 [1,1,0,0,0,0|2,0,0]=4 2261 B10R1.61 O=C([O-])c1ccccc1F Amb8397063 [1,1,0,0,0,0|2,0,0]=4 2262 B10R1.61 O=C([O-])c1ccccc1O Amb20246478 [1,1,0,0,0,0|2,0,0]=4 2263 B10R1.61 O=C([O-])c1ccccc1O Amb22338523 [1,1,0,0,0,0|2,0,0]=4 2264 B10R1.61 O=C([O-])c1ccccc1O Amb22732059 [1,1,0,0,0,0|2,0,0]=4 2265 B10R1.61 O=C([O-])c1ccccc1O Amb6383226 [1,1,0,0,0,0|2,0,0]=4 2266 B10R1.61 O=C([O-])c1ccccc1O Amb8485790 [1,1,0,0,0,0|2,0,0]=4 2267 B10R1.61 O=C([O-])c1ccncc1Br Amb2611944 [1,1,0,0,0,0|1,0,0]=3 2268 B10R1.61 O=C([O-])c1cnncc1O Amb2612315 [1,1,0,0,0,0|2,0,0]=4 2269 B10R1.61 O=N(=O)c1ccncc1Cl Amb20620821 [1,1,0,0,0,0|2,0,0]=4 2270 B10R1.61 O=N(=O)c1ccncc1F Amb20621360 [1,1,0,0,0,0|2,0,0]=4 2271 B10R1.61 O=[N+]([O-])c1ccncc1Br Amb2794354 [1,1,0,0,0,0|2,0,0]=4 2272 B10R1.61 O=[N+]([O-])c1ccncc1Cl Amb10576274 [1,1,0,0,0,0|2,0,0]=4 2273 B10R1.61 O=[N+]([O-])c1ccncc1F Amb10067417 [1,1,0,0,0,0|2,0,0]=4 2274 B10R1.61 O=[N+]([O-])c1ccncc1I Amb16231960 [1,1,0,0,0,0|2,0,0]=4 2275 B10R1.61 O=[N+]([O-])c1ccncc1O Amb10602317 [1,1,0,0,0,0|2,0,0]=4 2276 B10R1.61 O=[N+]([O-])c1ccncc1S Amb27405344 [1,1,0,0,0,0|2,0,0]=4 2277 B10R1.113 C=C(C)c1ccnc(Br)c1 Amb20617322 [1,1,0,0,0,0|2,0,0]=4 2278 B10R1.113 C=C(C)c1ccnc(Cl)c1 Amb32641679 [1,1,0,0,0,0|2,0,0]=4 2279 B10R1.113 C=C(C)c1ccnc(N)c1 Amb20617323 [1,1,0,0,0,0|2,0,0]=4 2280 B10R1.113 C=C(Cl)c1ccnc(Cl)c1 Amb25111520 [1,1,0,0,0,0|2,0,0]=4 2281 B10R1.113 CC(=O)C1=CC(=O)NC=C1 Amb33545567 [1,1,0,0,0,0|1,0,1]=4 2282 B10R1.113 CC(=O)c1cc(C)ncn1 Amb8630234 [1,1,0,0,0,0|2,0,0]=4 2283 B10R1.113 CC(=O)c1cc(Cl)ncn1 Amb25146886 [1,1,0,0,0,0|2,0,0]=4 2284 B10R1.113 CC(=O)c1cccc(Br)c1 Amb2684932 [1,1,0,0,0,0|2,0,0]=4 2285 B10R1.113 CC(=O)c1cccc(C)c1 Amb3940080 [1,1,0,0,0,0|2,0,0]=4 2286 B10R1.113 CC(=O)c1cccc(Cl)c1 Amb3940078 [1,1,0,0,0,0|2,0,0]=4 2287 B10R1.113 CC(=O)c1cccc(F)c1 Amb2688006 [1,1,0,0,0,0|2,0,0]=4 2288 B10R1.113 CC(=O)c1cccc(I)c1 Amb2688831 [1,1,0,0,0,0|2,0,0]=4 2289 B10R1.113 CC(=O)c1cccc(N)c1 Amb2684314 [1,1,0,0,0,0|2,0,0]=4 2290 B10R1.113 CC(=O)c1cccc(O)c1 Amb2792768 [1,1,0,0,0,0|2,0,0]=4 2291 B10R1.113 CC(=O)c1cccc(S)c1 Amb19374493 [1,1,0,0,0,0|2,0,0]=4 2292 B10R1.113 CC(=O)c1ccnc(Br)c1 Amb10069912 [1,1,0,0,0,0|1,0,0]=3 2293 B10R1.113 CC(=O)c1ccnc(Br)c1 Amb21964445 [1,1,0,0,0,0|1,0,0]=3 2294 B10R1.113 CC(=O)c1ccnc(C)c1 Amb19957654 [1,1,0,0,0,0|1,0,0]=3 2295 B10R1.113 CC(=O)c1ccnc(C)n1 Amb8630160 [1,1,0,0,0,0|2,0,0]=4 2296 B10R1.113 CC(=O)c1ccnc(Cl)c1 Amb6384342 [1,1,0,0,0,0|1,0,0]=3 2297 B10R1.113 CC(=O)c1ccnc(Cl)n1 Amb21857542 [1,1,0,0,0,0|2,0,0]=4 2298 B10R1.113 CC(=O)c1ccnc(F)c1 Amb33543793 [1,1,0,0,0,0|1,0,0]=3 2299 B10R1.113 CC(=O)c1ccnc(N)c1 Amb18643066 [1,1,0,0,0,0|1,0,0]=3 2300 B10R1.113 CC(=O)c1ccnc(N)n1 Amb10067086 [1,1,0,0,0,0|2,0,0]=4 2301 B10R1.113 CC(=O)c1ccnc(O)c1 Amb27259914 [1,1,0,0,0,0|1,0,0]=3 2302 B10R1.113 CC(=O)c1cnnc(Cl)c1 Amb25169314 [1,1,0,0,0,0|2,0,0]=4 2303 B10R1.113 CC(N)c1ccnc(Cl)c1 Amb24056180 [1,1,0,0,0,0|1,0,1]=4 2304 B10R1.113 CC(N)c1ccnc(F)c1 Amb27424748 [1,1,0,0,0,0|1,0,1]=4 2305 B10R1.113 CC(N)c1ccnc(O)c1 Amb33544289 [1,1,0,0,0,0|1,0,1]=4 2306 B10R1.113 C[C@@H](N)c1ccnc(Br)c1 Amb30869517 [1,1,0,0,0,0|1,0,1]=4 2307 B10R1.113 C[C@@H](N)c1ccnc(Cl)c1 Amb19889553 [1,1,0,0,0,0|1,0,1]=4 2308 B10R1.113 C[C@@H](N)c1ccnc(Cl)c1 Amb25146374 [1,1,0,0,0,0|1,0,1]=4 2309 B10R1.113 C[C@@H](N)c1ccnc(F)c1 Amb28341823 [1,1,0,0,0,0|1,0,1]=4 2310 B10R1.113 C[C@@H](N)c1ccnc(F)c1 Amb30868017 [1,1,0,0,0,0|1,0,1]=4 2311 B10R1.113 C[C@@H](N)c1ccnc(O)c1 Amb27490616 [1,1,0,0,0,0|1,0,1]=4 2312 B10R1.113 C[C@H](N)c1ccnc(Cl)c1 Amb19889552 [1,1,0,0,0,0|1,0,1]=4 2313 B10R1.113 C[C@H](N)c1ccnc(Cl)c1 Amb28290935 [1,1,0,0,0,0|1,0,1]=4 2314 B10R1.113 C[C@H](N)c1ccnc(F)c1 Amb26603816 [1,1,0,0,0,0|1,0,1]=4 2315 B10R1.113 C[C@H](N)c1ccnc(N)c1 Amb27950164 [1,1,0,0,0,0|1,0,1]=4 2316 B10R1.113 C[C@H](N)c1ccnc(O)c1 Amb27860345 [1,1,0,0,0,0|1,0,1]=4 2317 B10R1.113 C[n+]1cccc(C(N)=O)c1 Amb17778548 [1,1,0,0,0,0|2,0,0]=4 2318 B10R1.113 C[n+]1cccc(C(N)=O)c1 Amb2609608 [1,1,0,0,0,0|2,0,0]=4 2319 B10R1.113 C[n+]1cccc(C(N)=O)c1 Amb6366501 [1,1,0,0,0,0|2,0,0]=4 2320 B10R1.113 Cc1cc(C(=N)N)ccn1 Amb24638662 [1,1,0,0,0,0|1,0,0]=3 2321 B10R1.113 Cc1cc(C(=O)Cl)ccn1 Amb25138191 [1,1,0,0,0,0|1,0,0]=3 2322 B10R1.113 Cc1cc(C(=O)O)ccn1 Amb33313466 [1,1,0,0,0,0|1,0,0]=3 2323 B10R1.113 Cc1cc(C(=O)O)ccn1 Amb33545061 [1,1,0,0,0,0|1,0,0]=3 2324 B10R1.113 Cc1cc(C(=O)O)cnn1 Amb24505306 [1,1,0,0,0,0|2,0,0]=4 2325 B10R1.113 Cc1cc(C(=O)O)cnn1 Amb28555551 [1,1,0,0,0,0|2,0,0]=4 2326 B10R1.113 Cc1cc(C(=O)O)ncn1 Amb18948013 [1,1,0,0,0,0|2,0,0]=4 2327 B10R1.113 Cc1cc(C(C)N)ccn1 Amb18832438 [1,1,0,0,0,0|1,0,1]=4 2328 B10R1.113 Cc1cc(C(N)=O)ccn1 Amb22496777 [1,1,0,0,0,0|0,0,0]=2 2329 B10R1.113 Cc1cc(C(N)=S)ccn1 Amb22055850 [1,1,0,0,0,0|0,1,0]=3 2330 B10R1.113 Cc1cc(N(=O)=O)ccn1 Amb8384234 [1,1,0,0,0,0|2,0,0]=4 2331 B10R1.113 Cc1cc([C@@H](C)N)ccn1 Amb27817866 [1,1,0,0,0,0|1,0,1]=4 2332 B10R1.113 Cc1cc([C@H](C)N)ccn1 Amb28282725 [1,1,0,0,0,0|1,0,1]=4 2333 B10R1.113 Cc1cc([N+](=O)[O-])ccn1 Amb2447540 [1,1,0,0,0,0|2,0,0]=4 2334 B10R1.113 Cc1cccc(C(=N)N)c1 Amb2696293 [1,1,0,0,0,0|2,0,0]=4 2335 B10R1.113 Cc1cccc(C(=N)N)c1 Amb2726132 [1,1,0,0,0,0|2,0,0]=4 2336 B10R1.113 Cc1cccc(C(=O)Cl)c1 Amb3939040 [1,1,0,0,0,0|2,0,0]=4 2337 B10R1.113 Cc1cccc(C(=O)O)c1 Amb2609027 [1,1,0,0,0,0|2,0,0]=4 2338 B10R1.113 Cc1cccc(C(N)=O)c1 Amb2720843 [1,1,0,0,0,0|1,0,0]=3 2339 B10R1.113 Cc1cccc(C(N)=O)n1 Amb8858808 [1,1,0,0,0,0|2,0,0]=4 2340 B10R1.113 Cc1cccc(C(N)=S)c1 Amb6549110 [1,1,0,0,0,0|1,1,0]=4 2341 B10R1.113 Cc1ccnc(C(N)=O)c1 Amb16231199 [1,1,0,0,0,0|2,0,0]=4 2342 B10R1.113 Cc1cncc(C(N)=O)c1 Amb8388683 [1,1,0,0,0,0|2,0,0]=4 2343 B10R1.113 Cc1nccc(C(=O)Cl)n1 Amb28135689 [1,1,0,0,0,0|2,0,0]=4 2344 B10R1.113 Cc1nccc(C(=O)O)n1 Amb10602122 [1,1,0,0,0,0|2,0,0]=4 2345 B10R1.113 N=C(N)c1cccc(Br)c1 Amb2695925 [1,1,0,0,0,0|2,0,0]=4 2346 B10R1.113 N=C(N)c1cccc(Br)c1 Amb33530187 [1,1,0,0,0,0|2,0,0]=4 2347 B10R1.113 N=C(N)c1cccc(Cl)c1 Amb2696046 [1,1,0,0,0,0|2,0,0]=4 2348 B10R1.113 N=C(N)c1cccc(Cl)c1 Amb7365504 [1,1,0,0,0,0|2,0,0]=4 2349 B10R1.113 N=C(N)c1cccc(F)c1 Amb2696611 [1,1,0,0,0,0|2,0,0]=4 2350 B10R1.113 N=C(N)c1cccc(F)c1 Amb7365496 [1,1,0,0,0,0|2,0,0]=4 2351 B10R1.113 N=C(N)c1cccc(F)c1 Amb8503429 [1,1,0,0,0,0|2,0,0]=4 2352 B10R1.113 N=C(N)c1cccc(I)c1 Amb2700570 [1,1,0,0,0,0|2,0,0]=4 2353 B10R1.113 N=C(N)c1cccc(N)c1 Amb2694848 [1,1,0,0,0,0|2,0,0]=4 2354 B10R1.113 N=C(N)c1cccc(N)c1 Amb2699171 [1,1,0,0,0,0|2,0,0]=4 2355 B10R1.113 N=C(N)c1cccc(N)c1 Amb30633659 [1,1,0,0,0,0|2,0,0]=4 2356 B10R1.113 N=C(N)c1cccc(O)c1 Amb33552630 [1,1,0,0,0,0|2,0,0]=4 2357 B10R1.113 N=C(N)c1cccc(O)c1 Amb8831695 [1,1,0,0,0,0|2,0,0]=4 2358 B10R1.113 N=C(N)c1ccnc(Cl)c1 Amb19514783 [1,1,0,0,0,0|1,0,0]=3 2359 B10R1.113 N=C(N)c1ccnc(Cl)c1 Amb19889431 [1,1,0,0,0,0|1,0,0]=3 2360 B10R1.113 N=C(N)c1ccnc(Cl)c1 Amb22001400 [1,1,0,0,0,0|1,0,0]=3 2361 B10R1.113 N=C(N)c1ccnc(F)c1 Amb27978529 [1,1,0,0,0,0|1,0,0]=3 2362 B10R1.113 N=C(N)c1ccnc(F)c1 Amb33338934 [1,1,0,0,0,0|1,0,0]=3 2363 B10R1.113 N=C(N)c1cnnc(O)c1 Amb27440367 [1,1,0,0,0,0|2,0,0]=4 2364 B10R1.113 NC(=O)C1=CC(=O)NN=C1 Amb23400499 [1,1,0,0,0,0|1,0,1]=4 2365 B10R1.113 NC(=O)C1=NC(=O)NC=C1 Amb22501031 [1,1,0,0,0,0|1,0,1]=4 2366 B10R1.113 NC(=O)c1c[nH+]cc([O-])c1 Amb616317 [1,1,0,0,0,0|2,0,0]=4 2367 B10R1.113 NC(=O)c1cc(Br)ccn1 Amb2549772 [1,1,0,0,0,0|2,0,0]=4 2368 B10R1.113 NC(=O)c1cc(Cl)ccn1 Amb581610 [1,1,0,0,0,0|2,0,0]=4 2369 B10R1.113 NC(=O)c1cc(Cl)ncn1 Amb28251930 [1,1,0,0,0,0|1,0,0]=3 2370 B10R1.113 NC(=O)c1cc(I)ccn1 Amb27871356 [1,1,0,0,0,0|2,0,0]=4 2371 B10R1.113 NC(=O)c1cc(N)ccn1 Amb33531653 [1,1,0,0,0,0|2,0,0]=4 2372 B10R1.113 NC(=O)c1ccc[n+]([O-])c1 Amb2608961 [1,1,0,0,0,0|2,0,0]=4 2373 B10R1.113 NC(=O)c1cccc(Br)c1 Amb2716206 [1,1,0,0,0,0|1,0,0]=3 2374 B10R1.113 NC(=O)c1cccc(Br)n1 Amb10068098 [1,1,0,0,0,0|2,0,0]=4 2375 B10R1.113 NC(=O)c1cccc(Cl)c1 Amb1218066 [1,1,0,0,0,0|1,0,0]=3 2376 B10R1.113 NC(=O)c1cccc(Cl)n1 Amb4317884 [1,1,0,0,0,0|2,0,0]=4 2377 B10R1.113 NC(=O)c1cccc(F)c1 Amb3886563 [1,1,0,0,0,0|1,0,0]=3 2378 B10R1.113 NC(=O)c1cccc(F)n1 Amb10607167 [1,1,0,0,0,0|2,0,0]=4 2379 B10R1.113 NC(=O)c1cccc(I)c1 Amb3887764 [1,1,0,0,0,0|1,0,0]=3 2380 B10R1.113 NC(=O)c1cccc(N)c1 Amb1106189 [1,1,0,0,0,0|1,0,0]=3 2381 B10R1.113 NC(=O)c1cccc(N)n1 Amb18279842 [1,1,0,0,0,0|2,0,0]=4 2382 B10R1.113 NC(=O)c1cccc(O)c1 Amb3939531 [1,1,0,0,0,0|1,0,0]=3 2383 B10R1.113 NC(=O)c1cccc(O)n1 Amb24182048 [1,1,0,0,0,0|2,0,0]=4 2384 B10R1.113 NC(=O)c1cccc(S)c1 Amb24059371 [1,1,0,0,0,0|1,0,0]=3 2385 B10R1.113 NC(=O)c1ccnc(Br)c1 Amb6565030 [1,1,0,0,0,0|0,0,0]=2 2386 B10R1.113 NC(=O)c1ccnc(Cl)c1 Amb2686144 [1,1,0,0,0,0|0,0,0]=2 2387 B10R1.113 NC(=O)c1ccnc(Cl)n1 Amb10067801 [1,1,0,0,0,0|1,0,0]=3 2388 B10R1.113 NC(=O)c1ccnc(F)c1 Amb13951683 [1,1,0,0,0,0|0,0,0]=2 2389 B10R1.113 NC(=O)c1ccnc(I)c1 Amb10608176 [1,1,0,0,0,0|0,0,0]=2 2390 B10R1.113 NC(=O)c1ccnc(N)c1 Amb2696285 [1,1,0,0,0,0|0,0,0]=2 2391 B10R1.113 NC(=O)c1ccnc(N)n1 Amb22501032 [1,1,0,0,0,0|1,0,0]=3 2392 B10R1.113 NC(=O)c1ccnc(S)n1 Amb24417891 [1,1,0,0,0,0|1,0,0]=3 2393 B10R1.113 NC(=O)c1cncc(Br)c1 Amb2570605 [1,1,0,0,0,0|2,0,0]=4 2394 B10R1.113 NC(=O)c1cncc(Cl)c1 Amb19895235 [1,1,0,0,0,0|2,0,0]=4 2395 B10R1.113 NC(=O)c1cncc(F)c1 Amb21856857 [1,1,0,0,0,0|2,0,0]=4 2396 B10R1.113 NC(=O)c1cncc(N)c1 Amb10602828 [1,1,0,0,0,0|2,0,0]=4 2397 B10R1.113 NC(=O)c1cncc(O)c1 Amb33541953 [1,1,0,0,0,0|2,0,0]=4 2398 B10R1.113 NC(=O)c1cnnc(Cl)c1 Amb23400697 [1,1,0,0,0,0|1,0,0]=3 2399 B10R1.113 NC(=O)c1cnnc(N)c1 Amb24099507 [1,1,0,0,0,0|1,0,0]=3 2400 B10R1.113 NC(=S)c1cccc(Br)c1 Amb1152669 [1,1,0,0,0,0|1,1,0]=4 2401 B10R1.113 NC(=S)c1cccc(Cl)c1 Amb1649396 [1,1,0,0,0,0|1,1,0]=4 2402 B10R1.113 NC(=S)c1cccc(F)c1 Amb1152618 [1,1,0,0,0,0|1,1,0]=4 2403 B10R1.113 NC(=S)c1cccc(I)c1 Amb2688888 [1,1,0,0,0,0|1,1,0]=4 2404 B10R1.113 NC(=S)c1cccc(N)c1 Amb2684535 [1,1,0,0,0,0|1,1,0]=4 2405 B10R1.113 NC(=S)c1cccc(O)c1 Amb2688797 [1,1,0,0,0,0|1,1,0]=4 2406 B10R1.113 NC(=S)c1cccc(S)c1 Amb27451318 [1,1,0,0,0,0|1,1,0]=4 2407 B10R1.113 NC(=S)c1ccnc(Cl)c1 Amb6893126 [1,1,0,0,0,0|0,1,0]=3 2408 B10R1.113 NC(=S)c1ccnc(F)c1 Amb33482641 [1,1,0,0,0,0|0,1,0]=3 2409 B10R1.113 NC(=S)c1ccnc(O)c1 Amb8855284 [1,1,0,0,0,0|0,1,0]=3 2410 B10R1.113 NC(=S)c1cnnc(N)c1 Amb27195345 [1,1,0,0,0,0|1,1,0]=4 2411 B10R1.113 Nc1cc(C(=O)O)ccn1 Amb842470 [1,1,0,0,0,0|1,0,0]=3 2412 B10R1.113 Nc1cc(C(=O)O)ccn1 Amb8503396 [1,1,0,0,0,0|1,0,0]=3 2413 B10R1.113 Nc1cc(C(=O)O)cnn1 Amb23557092 [1,1,0,0,0,0|2,0,0]=4 2414 B10R1.113 Nc1cc(C(=O)O)ncn1 Amb17935623 [1,1,0,0,0,0|2,0,0]=4 2415 B10R1.113 Nc1cc(C(=O)O)ncn1 Amb31289701 [1,1,0,0,0,0|2,0,0]=4 2416 B10R1.113 Nc1cc(C(=O)[O-])ncn1 Amb5606301 [1,1,0,0,0,0|2,0,0]=4 2417 B10R1.113 Nc1cc(N(=O)=O)ccn1 Amb20620330 [1,1,0,0,0,0|2,0,0]=4 2418 B10R1.113 Nc1cc([N+](=O)[O-])ccn1 Amb8630841 [1,1,0,0,0,0|2,0,0]=4 2419 B10R1.113 Nc1cccc(C(=O)O)c1 Amb1935166 [1,1,0,0,0,0|2,0,0]=4 2420 B10R1.113 Nc1nccc(C(=O)O)n1 Amb8630057 [1,1,0,0,0,0|2,0,0]=4 2421 B10R1.113 O=C(Br)c1cccc(Br)c1 Amb27633153 [1,1,0,0,0,0|2,0,0]=4 2422 B10R1.113 O=C(Cl)c1cc(Cl)ncn1 Amb21618944 [1,1,0,0,0,0|2,0,0]=4 2423 B10R1.113 O=C(Cl)c1cccc(Br)c1 Amb2691918 [1,1,0,0,0,0|2,0,0]=4 2424 B10R1.113 O=C(Cl)c1cccc(Cl)c1 Amb3939312 [1,1,0,0,0,0|2,0,0]=4 2425 B10R1.113 O=C(Cl)c1cccc(F)c1 Amb2688033 [1,1,0,0,0,0|2,0,0]=4 2426 B10R1.113 O=C(Cl)c1cccc(I)c1 Amb3939575 [1,1,0,0,0,0|2,0,0]=4 2427 B10R1.113 O=C(Cl)c1ccnc(Cl)c1 Amb2720377 [1,1,0,0,0,0|1,0,0]=3 2428 B10R1.113 O=C(Cl)c1ccnc(F)c1 Amb17621620 [1,1,0,0,0,0|1,0,0]=3 2429 B10R1.113 O=C(Cl)c1cnnc(Cl)c1 Amb27665800 [1,1,0,0,0,0|2,0,0]=4 2430 B10R1.113 O=C(F)c1cccc(Br)c1 Amb28315574 [1,1,0,0,0,0|2,0,0]=4 2431 B10R1.113 O=C(F)c1cccc(Cl)c1 Amb28046129 [1,1,0,0,0,0|2,0,0]=4 2432 B10R1.113 O=C(F)c1ccnc(F)c1 Amb24416828 [1,1,0,0,0,0|1,0,0]=3 2433 B10R1.113 O=C(O)C1=CC(=S)NC=C1 Amb19514542 [1,1,0,0,0,0|1,0,1]=4 2434 B10R1.113 O=C(O)c1cc(Br)ncn1 Amb27205845 [1,1,0,0,0,0|2,0,0]=4 2435 B10R1.113 O=C(O)c1cc(Cl)ncn1 Amb5717806 [1,1,0,0,0,0|2,0,0]=4 2436 B10R1.113 O=C(O)c1cc(F)ncn1 Amb28196478 [1,1,0,0,0,0|2,0,0]=4 2437 B10R1.113 O=C(O)c1cc(O)ncn1 Amb2591546 [1,1,0,0,0,0|2,0,0]=4 2438 B10R1.113 O=C(O)c1cccc(Br)c1 Amb264315 [1,1,0,0,0,0|2,0,0]=4 2439 B10R1.113 O=C(O)c1cccc(Cl)c1 Amb2223069 [1,1,0,0,0,0|2,0,0]=4 2440 B10R1.113 O=C(O)c1cccc(F)c1 Amb2688023 [1,1,0,0,0,0|2,0,0]=4 2441 B10R1.113 O=C(O)c1cccc(F)c1 Amb33513022 [1,1,0,0,0,0|2,0,0]=4 2442 B10R1.113 O=C(O)c1cccc(I)c1 Amb6456607 [1,1,0,0,0,0|2,0,0]=4 2443 B10R1.113 O=C(O)c1cccc(O)c1 Amb1208301 [1,1,0,0,0,0|2,0,0]=4 2444 B10R1.113 O=C(O)c1cccc(S)c1 Amb5721847 [1,1,0,0,0,0|2,0,0]=4 2445 B10R1.113 O=C(O)c1ccnc(Br)c1 Amb1353186 [1,1,0,0,0,0|1,0,0]=3 2446 B10R1.113 O=C(O)c1ccnc(Br)n1 Amb22499757 [1,1,0,0,0,0|2,0,0]=4 2447 B10R1.113 O=C(O)c1ccnc(Cl)c1 Amb1221736 [1,1,0,0,0,0|1,0,0]=3 2448 B10R1.113 O=C(O)c1ccnc(Cl)n1 Amb33544410 [1,1,0,0,0,0|2,0,0]=4 2449 B10R1.113 O=C(O)c1ccnc(F)c1 Amb2447269 [1,1,0,0,0,0|1,0,0]=3 2450 B10R1.113 O=C(O)c1ccnc(F)n1 Amb27488035 [1,1,0,0,0,0|2,0,0]=4 2451 B10R1.113 O=C(O)c1ccnc(I)c1 Amb6565049 [1,1,0,0,0,0|1,0,0]=3 2452 B10R1.113 O=C(O)c1ccnc(O)c1 Amb842469 [1,1,0,0,0,0|1,0,0]=3 2453 B10R1.113 O=C(O)c1ccnc(O)n1 Amb21927951 [1,1,0,0,0,0|2,0,0]=4 2454 B10R1.113 O=C(O)c1ccnc(S)n1 Amb18200233 [1,1,0,0,0,0|2,0,0]=4 2455 B10R1.113 O=C(O)c1cnnc(Br)c1 Amb28246467 [1,1,0,0,0,0|2,0,0]=4 2456 B10R1.113 O=C(O)c1cnnc(Cl)c1 Amb19895270 [1,1,0,0,0,0|2,0,0]=4 2457 B10R1.113 O=C([O-])c1cc(O)ncn1 Amb33038433 [1,1,0,0,0,0|2,0,0]=4 2458 B10R1.113 O=C([O-])c1cccc(F)c1 Amb8397064 [1,1,0,0,0,0|2,0,0]=4 2459 B10R1.113 O=C([O-])c1cccc(O)c1 Amb22277134 [1,1,0,0,0,0|2,0,0]=4 2460 B10R1.113 O=C1C=C(C(=O)O)C=CN1 Amb18124536 [1,1,0,0,0,0|1,0,1]=4 2461 B10R1.113 O=C1CC(C(=O)O)=CC=N1 Amb2783836 [1,1,0,0,0,0|1,0,1]=4 2462 B10R1.113 O=C1N=CC=C(C(=O)O)N1 Amb19957719 [1,1,0,0,0,0|2,0,0]=4 2463 B10R1.113 O=N(=O)c1ccnc(Br)c1 Amb20620574 [1,1,0,0,0,0|2,0,0]=4 2464 B10R1.113 O=N(=O)c1ccnc(Cl)c1 Amb20620823 [1,1,0,0,0,0|2,0,0]=4 2465 B10R1.113 O=N(=O)c1ccnc(F)c1 Amb20621359 [1,1,0,0,0,0|2,0,0]=4 2466 B10R1.113 O=N(=O)c1ccnc(O)c1 Amb20621438 [1,1,0,0,0,0|2,0,0]=4 2467 B10R1.113 O=S(O)c1ccnc(Cl)c1 Amb32753687 [1,1,0,0,0,0|2,0,0]=4 2468 B10R1.113 O=S([O-])c1ccnc(Cl)c1 Amb32755229 [1,1,0,0,0,0|2,0,0]=4 2469 B10R1.113 O=S([O-])c1ccnc(Cl)c1 Amb32992514 [1,1,0,0,0,0|2,0,0]=4 2470 B10R1.113 O=[N+](O)c1ccnc(Cl)c1 Amb3632330 [1,1,0,0,0,0|2,0,0]=4 2471 B10R1.113 O=[N+]([O-])c1ccnc(Cl)c1 Amb1353185 [1,1,0,0,0,0|2,0,0]=4 2472 B10R1.113 O=[N+]([O-])c1ccnc(F)c1 Amb10839397 [1,1,0,0,0,0|2,0,0]=4 2473 B10R1.113 O=[N+]([O-])c1ccnc(I)c1 Amb28206539 [1,1,0,0,0,0|2,0,0]=4 2474 B10R1.113 [NH3+]c1cccc(C(=O)O)c1 Amb6365978 [1,1,0,0,0,0|2,0,0]=4 2475 B10R1.363 CC1(C(N)=O)C=CCC=C1 Amb25873819 [1,1,0,0,0,0|1,0,1]=4 2476 B10R1.1 Cc1ccc(CNN)cc1 Amb1112560 [1,1,0,0,0,0|1,0,1]=4 2477 B10R1.1 Cc1ccc(CNN)cc1 Amb19890079 [1,1,0,0,0,0|1,0,1]=4 2478 B10R1.1 Cc1ccc(CNN)cc1 Amb21954052 [1,1,0,0,0,0|1,0,1]=4 2479 B10R1.1 Cc1ccc(\C=N\N)cc1 Amb9817723 [1,1,0,0,0,0|1,0,1]=4 2480 B10R1.1 NNCc1ccc(Br)cc1 Amb1114984 [1,1,0,0,0,0|1,0,1]=4 2481 B10R1.1 NNCc1ccc(Br)cc1 Amb19893264 [1,1,0,0,0,0|1,0,1]=4 2482 B10R1.1 NNCc1ccc(Br)cc1 Amb23439145 [1,1,0,0,0,0|1,0,1]=4 2483 B10R1.1 NNCc1ccc(Cl)cc1 Amb1121233 [1,1,0,0,0,0|1,0,1]=4 2484 B10R1.1 NNCc1ccc(Cl)cc1 Amb19890158 [1,1,0,0,0,0|1,0,1]=4 2485 B10R1.1 NNCc1ccc(Cl)cc1 Amb20668069 [1,1,0,0,0,0|1,0,1]=4 2486 B10R1.1 NNCc1ccc(Cl)cc1 Amb21954056 [1,1,0,0,0,0|1,0,1]=4 2487 B10R1.1 NNCc1ccc(F)cc1 Amb10841872 [1,1,0,0,0,0|1,0,1]=4 2488 B10R1.1 NNCc1ccc(F)cc1 Amb1112880 [1,1,0,0,0,0|1,0,1]=4 2489 B10R1.1 NNCc1ccc(F)cc1 Amb19893258 [1,1,0,0,0,0|1,0,1]=4 2490 B10R1.1 NNCc1ccc(O)cc1 Amb27814030 [1,1,0,0,0,0|1,0,1]=4 2491 B10R1.1 NNCc1ccc(O)cc1 Amb32655872 [1,1,0,0,0,0|1,0,1]=4 2492 B10R1.1 N\N=C/c1ccc(F)cc1 Amb27834282 [1,1,0,0,0,0|1,0,1]=4 2493 B10R1.1 N\N=C\c1ccc(Cl)cc1 Amb3096519 [1,1,0,0,0,0|1,0,1]=4 2494 B10R1.1 N\N=C\c1ccc(N)cc1 Amb28188656 [1,1,0,0,0,0|1,0,1]=4 2495 B10R1.1 N\N=C\c1ccc(O)cc1 Amb3096562 [1,1,0,0,0,0|1,0,1]=4 2496 B10R1.4 CNCc1ccncc1Br Amb23412258 [1,1,0,0,0,0|1,0,1]=4 2497 B10R1.4 CNCc1ccncc1C Amb10607510 [1,1,0,0,0,0|1,0,1]=4 2498 B10R1.4 CNCc1ccncc1C Amb8503308 [1,1,0,0,0,0|1,0,1]=4 2499 B10R1.4 CNCc1ccncc1Cl Amb27803881 [1,1,0,0,0,0|1,0,1]=4 2500 B10R1.4 CNCc1ccncc1F Amb24398098 [1,1,0,0,0,0|1,0,1]=4 2501 B10R1.4 CN\C=C1\C=CN=CC1=O Amb26391014 [1,1,0,0,0,0|1,0,0]=3 2502 B10R1.4 C\C=C\c1ccncc1Br Amb26051337 [1,1,0,0,0,0|2,0,0]=4 2503 B10R1.4 Cc1ccccc1CNN Amb1118964 [1,1,0,0,0,0|1,0,1]=4 2504 B10R1.4 Cc1ccccc1CNN Amb6892665 [1,1,0,0,0,0|1,0,1]=4 2505 B10R1.4 Cc1cnccc1CCN Amb22059435 [1,1,0,0,0,0|1,0,1]=4 2506 B10R1.4 Cc1cnccc1CNN Amb26516871 [1,1,0,0,0,0|0,0,1]=3 2507 B10R1.4 Cc1cnccc1CNO Amb26925533 [1,1,0,0,0,0|1,0,1]=4 2508 B10R1.4 Cc1cnccc1CON Amb33079980 [1,1,0,0,0,0|1,0,1]=4 2509 B10R1.4 Cc1cnccc1\C=N\O Amb27963736 [1,1,0,0,0,0|1,0,1]=4 2510 B10R1.4 Fc1cnccc1\C=C\Br Amb33135262 [1,1,0,0,0,0|2,0,0]=4 2511 B10R1.4 NCCc1ccncc1Br Amb26565968 [1,1,0,0,0,0|1,0,1]=4 2512 B10R1.4 NCCc1ccncc1Cl Amb23596506 [1,1,0,0,0,0|1,0,1]=4 2513 B10R1.4 NCCc1ccncc1F Amb24383725 [1,1,0,0,0,0|1,0,1]=4 2514 B10R1.4 NCCc1ccncc1N Amb28423471 [1,1,0,0,0,0|1,0,1]=4 2515 B10R1.4 NNCc1ccccc1Br Amb1116234 [1,1,0,0,0,0|1,0,1]=4 2516 B10R1.4 NNCc1ccccc1Br Amb19893262 [1,1,0,0,0,0|1,0,1]=4 2517 B10R1.4 NNCc1ccccc1Cl Amb21959997 [1,1,0,0,0,0|1,0,1]=4 2518 B10R1.4 NNCc1ccccc1Cl Amb4008405 [1,1,0,0,0,0|1,0,1]=4 2519 B10R1.4 NNCc1ccccc1Cl Amb5400451 [1,1,0,0,0,0|1,0,1]=4 2520 B10R1.4 NNCc1ccccc1F Amb19893256 [1,1,0,0,0,0|1,0,1]=4 2521 B10R1.4 NNCc1ccccc1F Amb33553561 [1,1,0,0,0,0|1,0,1]=4 2522 B10R1.4 NNCc1ccccc1F Amb6247906 [1,1,0,0,0,0|1,0,1]=4 2523 B10R1.4 NNCc1ccccc1O Amb24681968 [1,1,0,0,0,0|1,0,1]=4 2524 B10R1.4 NNCc1ccncc1Br Amb25274178 [1,1,0,0,0,0|0,0,1]=3 2525 B10R1.4 NNCc1ccncc1Cl Amb27146995 [1,1,0,0,0,0|0,0,1]=3 2526 B10R1.4 NNCc1ccncc1F Amb27838901 [1,1,0,0,0,0|0,0,1]=3 2527 B10R1.4 NNCc1ncncc1Br Amb28070046 [1,1,0,0,0,0|1,0,1]=4 2528 B10R1.4 NOCc1ccncc1Br Amb33241889 [1,1,0,0,0,0|1,0,1]=4 2529 B10R1.4 NOCc1ccncc1Cl Amb25764086 [1,1,0,0,0,0|1,0,1]=4 2530 B10R1.4 NOCc1ccncc1F Amb26423136 [1,1,0,0,0,0|1,0,1]=4 2531 B10R1.4 N\N=C\c1ccccc1O Amb594479 [1,1,0,0,0,0|1,0,1]=4 2532 B10R1.4 ONCc1ccncc1Br Amb33242569 [1,1,0,0,0,0|1,0,1]=4 2533 B10R1.4 ONCc1ccncc1Cl Amb33052755 [1,1,0,0,0,0|1,0,1]=4 2534 B10R1.4 ONCc1ccncc1F Amb33318031 [1,1,0,0,0,0|1,0,1]=4 2535 B10R1.4 O\N=C\c1ccncc1F Amb27779292 [1,1,0,0,0,0|1,0,1]=4 2536 B10R1.4 O\N=C\c1ccncc1O Amb27462407 [1,1,0,0,0,0|1,0,1]=4 2537 B10R1.10 CNCc1ccnc(C)c1 Amb10607835 [1,1,0,0,0,0|1,0,1]=4 2538 B10R1.10 CNCc1ccnc(Cl)c1 Amb6572114 [1,1,0,0,0,0|1,0,1]=4 2539 B10R1.10 Cc1cc(CCN)ccn1 Amb18203094 [1,1,0,0,0,0|1,0,1]=4 2540 B10R1.10 Cc1cc(CCN)ccn1 Amb33309646 [1,1,0,0,0,0|1,0,1]=4 2541 B10R1.10 Cc1cc(CNN)ccn1 Amb13883480 [1,1,0,0,0,0|0,0,1]=3 2542 B10R1.10 Cc1cc(CNO)ccn1 Amb33449918 [1,1,0,0,0,0|1,0,1]=4 2543 B10R1.10 Cc1cc(CON)ccn1 Amb33172246 [1,1,0,0,0,0|1,0,1]=4 2544 B10R1.10 Cc1cc(\C=C\Br)ccn1 Amb33135327 [1,1,0,0,0,0|2,0,0]=4 2545 B10R1.10 Cc1cc(\C=N\N)ncn1 Amb27216955 [1,1,0,0,0,0|1,0,1]=4 2546 B10R1.10 Cc1cc(\C=N\O)ccn1 Amb22170539 [1,1,0,0,0,0|1,0,1]=4 2547 B10R1.10 Cc1cccc(CNN)c1 Amb1116333 [1,1,0,0,0,0|1,0,1]=4 2548 B10R1.10 Cc1cccc(CNN)c1 Amb19890111 [1,1,0,0,0,0|1,0,1]=4 2549 B10R1.10 Cc1cccc(CNN)c1 Amb33527910 [1,1,0,0,0,0|1,0,1]=4 2550 B10R1.10 Cc1nccc(CNN)n1 Amb23586398 [1,1,0,0,0,0|1,0,1]=4 2551 B10R1.10 NCCc1ccnc(Br)c1 Amb26974330 [1,1,0,0,0,0|1,0,1]=4 2552 B10R1.10 NCCc1ccnc(Cl)c1 Amb26080294 [1,1,0,0,0,0|1,0,1]=4 2553 B10R1.10 NCCc1ccnc(F)c1 Amb25992462 [1,1,0,0,0,0|1,0,1]=4 2554 B10R1.10 NCCc1ccnc(N)c1 Amb28555504 [1,1,0,0,0,0|1,0,1]=4 2555 B10R1.10 NCCc1ccnc(N)c1 Amb33532630 [1,1,0,0,0,0|1,0,1]=4 2556 B10R1.10 NCCc1ccnc(O)c1 Amb32670801 [1,1,0,0,0,0|1,0,1]=4 2557 B10R1.10 NNCc1cccc(Br)c1 Amb1119246 [1,1,0,0,0,0|1,0,1]=4 2558 B10R1.10 NNCc1cccc(Br)c1 Amb19893263 [1,1,0,0,0,0|1,0,1]=4 2559 B10R1.10 NNCc1cccc(Br)c1 Amb33537274 [1,1,0,0,0,0|1,0,1]=4 2560 B10R1.10 NNCc1cccc(Cl)c1 Amb1111798 [1,1,0,0,0,0|1,0,1]=4 2561 B10R1.10 NNCc1cccc(Cl)c1 Amb13949121 [1,1,0,0,0,0|1,0,1]=4 2562 B10R1.10 NNCc1cccc(Cl)c1 Amb33714445 [1,1,0,0,0,0|1,0,1]=4 2563 B10R1.10 NNCc1cccc(F)c1 Amb1121411 [1,1,0,0,0,0|1,0,1]=4 2564 B10R1.10 NNCc1cccc(F)c1 Amb19893257 [1,1,0,0,0,0|1,0,1]=4 2565 B10R1.10 NNCc1cccc(F)c1 Amb20669586 [1,1,0,0,0,0|1,0,1]=4 2566 B10R1.10 NNCc1cccc(N)c1 Amb27810603 [1,1,0,0,0,0|1,0,1]=4 2567 B10R1.10 NNCc1cccc(O)c1 Amb3940160 [1,1,0,0,0,0|1,0,1]=4 2568 B10R1.10 NNCc1cccc(O)c1 Amb6336419 [1,1,0,0,0,0|1,0,1]=4 2569 B10R1.10 NNCc1ccnc(Cl)c1 Amb26370039 [1,1,0,0,0,0|0,0,1]=3 2570 B10R1.10 NNCc1ccnc(N)c1 Amb27650797 [1,1,0,0,0,0|0,0,1]=3 2571 B10R1.10 NOCc1ccnc(Cl)c1 Amb22396234 [1,1,0,0,0,0|1,0,1]=4 2572 B10R1.10 N\N=C\c1cccc(Cl)c1 Amb3096261 [1,1,0,0,0,0|1,0,1]=4 2573 B10R1.10 N\N=C\c1cccc(F)c1 Amb3788106 [1,1,0,0,0,0|1,0,1]=4 2574 B10R1.10 N\N=C\c1cccc(I)c1 Amb27467050 [1,1,0,0,0,0|1,0,1]=4 2575 B10R1.10 N\N=C\c1cccc(O)c1 Amb28049819 [1,1,0,0,0,0|1,0,1]=4 2576 B10R1.10 O\N=C\c1ccnc(Br)c1 Amb27876778 [1,1,0,0,0,0|1,0,1]=4 2577 B10R1.10 O\N=C\c1ccnc(Cl)c1 Amb25322425 [1,1,0,0,0,0|1,0,1]=4 2578 B10R1.10 Oc1cc(\C=C\Br)ccn1 Amb33135314 [1,1,0,0,0,0|2,0,0]=4 2579 B10R1.17 CCNCc1ccncc1 Amb1214646 [1,1,0,0,0,0|1,0,1]=4 2580 B10R1.17 CNCCc1ccncc1 Amb10071184 [1,1,0,0,0,0|1,0,1]=4 2581 B10R1.17 CNCCc1ccncc1 Amb19958269 [1,1,0,0,0,0|1,0,1]=4 2582 B10R1.17 CNCCc1ccncc1 Amb2592519 [1,1,0,0,0,0|1,0,1]=4 2583 B10R1.17 CNNCc1ccccc1 Amb26859422 [1,1,0,0,0,0|1,0,1]=4 2584 B10R1.17 CNNCc1ccccc1 Amb33328543 [1,1,0,0,0,0|1,0,1]=4 2585 B10R1.17 CN\N=C\c1ccccc1 Amb17867553 [1,1,0,0,0,0|1,0,1]=4 2586 B10R1.17 CO\C=C/c1ccncc1 Amb24103279 [1,1,0,0,0,0|2,0,0]=4 2587 B10R1.17 CO\N=C\c1ccncc1 Amb25173617 [1,1,0,0,0,0|1,0,1]=4 2588 B10R1.17 ClC\C=C\c1ccncc1 Amb27392424 [1,1,0,0,0,0|2,0,0]=4 2589 B10R1.17 N#CNCc1ccncc1 Amb28428551 [1,1,0,0,0,0|0,0,2]=4 2590 B10R1.17 N#C\C=C\c1ccncc1 Amb17477821 [1,1,0,0,0,0|1,0,1]=4 2591 B10R1.17 NCCCc1ccncc1 Amb22490382 [1,1,0,0,0,0|1,0,1]=4 2592 B10R1.17 NCCCc1ccncc1 Amb24099592 [1,1,0,0,0,0|1,0,1]=4 2593 B10R1.17 NCCCc1ccncc1 Amb33535434 [1,1,0,0,0,0|1,0,1]=4 2594 B10R1.17 NCCNc1ccncc1 Amb19887545 [1,1,0,0,0,0|1,0,1]=4 2595 B10R1.17 NCCNc1ccncc1 Amb6279124 [1,1,0,0,0,0|1,0,1]=4 2596 B10R1.17 NCCOc1ccncc1 Amb18988858 [1,1,0,0,0,0|1,0,1]=4 2597 B10R1.17 NCCOc1ccncc1 Amb22728098 [1,1,0,0,0,0|1,0,1]=4 2598 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [1,1,0,0,0,0|2,0,0]=4 2599 B10R1.17 NC\C=C/c1ccccc1 Amb6383106 [1,1,0,0,0,0|2,0,0]=4 2600 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [1,1,0,0,0,0|2,0,0]=4 2601 B10R1.17 NC\C=C\c1ccccc1 Amb4019220 [1,1,0,0,0,0|2,0,0]=4 2602 B10R1.17 NC\C=C\c1ccncc1 Amb18062333 [1,1,0,0,0,0|1,0,0]=3 2603 B10R1.17 NC\C=C\c1ccncn1 Amb27617981 [1,1,0,0,0,0|2,0,0]=4 2604 B10R1.17 NNCCc1ccccc1 Amb10608987 [1,1,0,0,0,0|1,0,1]=4 2605 B10R1.17 NNCCc1ccccc1 Amb1117029 [1,1,0,0,0,0|1,0,1]=4 2606 B10R1.17 NNCCc1ccccc1 Amb33552804 [1,1,0,0,0,0|1,0,1]=4 2607 B10R1.17 NNCCc1ccncc1 Amb6248763 [1,1,0,0,0,0|0,0,1]=3 2608 B10R1.17 NOCCc1ccncc1 Amb17231908 [1,1,0,0,0,0|1,0,1]=4 2609 B10R1.17 N\N=C\Nc1ccccc1 Amb27770569 [1,1,0,0,0,0|1,0,1]=4 2610 B10R1.17 O=CNNc1ccncc1 Amb26560692 [1,1,0,0,0,0|2,0,0]=4 2611 B10R1.17 O=C\C=C\c1ccncc1 Amb33249631 [1,1,0,0,0,0|2,0,0]=4 2612 B10R1.17 OC\C=C/c1ccncc1 Amb27617653 [1,1,0,0,0,0|2,0,0]=4 2613 B10R1.17 OC\C=C\c1ccncc1 Amb22749186 [1,1,0,0,0,0|2,0,0]=4 2614 B10R1.17 O\N=C\Cc1ccncc1 Amb28186073 [1,1,0,0,0,0|1,0,1]=4 2615 B10R1.18 BrC(Br)=Cc1ccncc1 Amb26516830 [1,1,0,0,0,0|2,0,0]=4 2616 B10R1.18 CC(C)=Cc1ccncc1 Amb27658833 [1,1,0,0,0,0|2,0,0]=4 2617 B10R1.18 CC(N)Cc1ccncc1 Amb2592094 [1,1,0,0,0,0|1,0,1]=4 2618 B10R1.18 CN(C)Cc1ccncc1 Amb20247602 [1,1,0,0,0,0|1,0,1]=4 2619 B10R1.18 CN(N)Cc1ccccc1 Amb836790 [1,1,0,0,0,0|1,0,1]=4 2620 B10R1.18 CN(N)Cc1ccncc1 Amb27180025 [1,1,0,0,0,0|0,0,1]=3 2621 B10R1.18 CN(O)Cc1ccncc1 Amb33380608 [1,1,0,0,0,0|1,0,1]=4 2622 B10R1.18 C[C@@H](N)Cc1ccncc1 Amb28044876 [1,1,0,0,0,0|1,0,1]=4 2623 B10R1.18 C[C@H](N)Cc1ccncc1 Amb28381274 [1,1,0,0,0,0|1,0,1]=4 2624 B10R1.18 C\[N+]([O-])=C\c1ccncc1 Amb27965296 [1,1,0,0,0,0|1,0,1]=4 2625 B10R1.18 N=C(N)Cc1ccncc1 Amb28555413 [1,1,0,0,0,0|1,0,1]=4 2626 B10R1.18 N=C(N)Cc1ccncc1 Amb33533992 [1,1,0,0,0,0|1,0,1]=4 2627 B10R1.18 N=C(N)Cc1ccncc1 Amb4297103 [1,1,0,0,0,0|1,0,1]=4 2628 B10R1.18 N=C(N)Nc1ccncc1 Amb22752815 [1,1,0,0,0,0|2,0,0]=4 2629 B10R1.18 N=C(N)Sc1ccncc1 Amb27837821 [1,1,0,0,0,0|2,0,0]=4 2630 B10R1.18 NC(=O)Cc1ccncc1 Amb4010849 [1,1,0,0,0,0|1,0,1]=4 2631 B10R1.18 NC(=O)Nc1ccncc1 Amb23581130 [1,1,0,0,0,0|2,0,0]=4 2632 B10R1.18 NC(=S)Cc1ccncc1 Amb6252363 [1,1,0,0,0,0|1,0,1]=4 2633 B10R1.18 NC(=S)Nc1ccncc1 Amb2725753 [1,1,0,0,0,0|2,0,0]=4 2634 B10R1.18 [O-]\[N+](O)=C/c1ccncc1 Amb27813736 [1,1,0,0,0,0|1,0,1]=4 2635 B10R1.6 NNS(=O)(=O)c1cccs1 Amb1628143 [0,1,0,0,1,0|2,0,0]=4 2636 B10R1.9 N\C=C(/C=O)c1ccsc1 Amb28050013 [0,1,0,0,1,0|2,0,0]=4 2637 B10R1.11 CCNC(=O)c1ccoc1 Amb26967525 [0,1,0,0,1,0|2,0,0]=4 2638 B10R1.11 CCNC(=O)c1ccsc1 Amb24451235 [0,1,0,0,1,0|2,0,0]=4 2639 B10R1.11 CCNC(=O)c1cnoc1 Amb28205027 [0,1,0,0,1,0|2,0,0]=4 2640 B10R1.11 CCNC(=O)n1cccc1 Amb27265867 [0,1,0,0,1,0|2,0,0]=4 2641 B10R1.11 CCNC(=O)n1ccnc1 Amb7969955 [0,1,0,0,1,0|2,0,0]=4 2642 B10R1.11 CNCC(=O)c1ccco1 Amb21862170 [0,1,0,0,1,0|2,0,0]=4 2643 B10R1.11 CNCC(=O)c1cccs1 Amb17232156 [0,1,0,0,1,0|2,0,0]=4 2644 B10R1.11 CNCC(=O)c1ccns1 Amb25248493 [0,1,0,0,1,0|2,0,0]=4 2645 B10R1.11 CNCC(=O)c1ccoc1 Amb25369027 [0,1,0,0,1,0|2,0,0]=4 2646 B10R1.11 CNCC(=O)c1ccsc1 Amb24461147 [0,1,0,0,1,0|2,0,0]=4 2647 B10R1.11 CNCC(=O)c1cnco1 Amb33415278 [0,1,0,0,1,0|2,0,0]=4 2648 B10R1.11 CNCC(=O)c1cncs1 Amb30020578 [0,1,0,0,1,0|2,0,0]=4 2649 B10R1.11 CNCC(=O)c1cnsc1 Amb30009636 [0,1,0,0,1,0|2,0,0]=4 2650 B10R1.11 N#CNC(=O)n1ccnc1 Amb27466953 [0,1,0,0,1,0|1,0,1]=4 2651 B10R1.11 NCCC(=O)c1ccco1 Amb18639567 [0,1,0,0,1,0|2,0,0]=4 2652 B10R1.11 NCCC(=O)c1cccs1 Amb17194466 [0,1,0,0,1,0|2,0,0]=4 2653 B10R1.11 NCCC(=O)c1ccns1 Amb27626304 [0,1,0,0,1,0|2,0,0]=4 2654 B10R1.11 NCCC(=O)c1ccoc1 Amb25142291 [0,1,0,0,1,0|2,0,0]=4 2655 B10R1.11 NCCC(=O)c1ccsc1 Amb26893339 [0,1,0,0,1,0|2,0,0]=4 2656 B10R1.11 NCCC(=O)c1cnco1 Amb33415282 [0,1,0,0,1,0|2,0,0]=4 2657 B10R1.11 NCCC(=O)c1cncs1 Amb18830760 [0,1,0,0,1,0|2,0,0]=4 2658 B10R1.11 NCCC(=O)c1cnsc1 Amb30009642 [0,1,0,0,1,0|2,0,0]=4 2659 B10R1.11 O=CNC(=O)c1cccs1 Amb5282864 [0,1,0,0,1,0|2,0,0]=4 2660 B10R1.14 CNC(=O)c1cc(O)no1 Amb24714641 [0,1,0,0,1,0|2,0,0]=4 2661 B10R1.14 CNC(=O)c1ccc(Br)o1 Amb5677 [0,1,0,0,1,0|2,0,0]=4 2662 B10R1.14 CNC(=O)c1ccc(Br)s1 Amb8264840 [0,1,0,0,1,0|2,0,0]=4 2663 B10R1.14 CNC(=O)c1ccc(C)s1 Amb8333493 [0,1,0,0,1,0|2,0,0]=4 2664 B10R1.14 CNC(=O)c1ccc(Cl)s1 Amb20635246 [0,1,0,0,1,0|2,0,0]=4 2665 B10R1.14 CNC(=O)c1ccc(N)o1 Amb18625497 [0,1,0,0,1,0|2,0,0]=4 2666 B10R1.14 CNC(=O)c1cnc(C)s1 Amb13951240 [0,1,0,0,1,0|2,0,0]=4 2667 B10R1.14 CNC(=O)c1cnc(N)s1 Amb17490793 [0,1,0,0,1,0|2,0,0]=4 2668 B10R1.14 CNC(=O)c1coc(Br)c1 Amb8288132 [0,1,0,0,1,0|2,0,0]=4 2669 B10R1.14 CNC(=O)c1csc(Br)c1 Amb9179922 [0,1,0,0,1,0|2,0,0]=4 2670 B10R1.14 CNC(=O)c1csc(C)c1 Amb27260078 [0,1,0,0,1,0|2,0,0]=4 2671 B10R1.14 CNC(=O)c1csc(I)c1 Amb27469303 [0,1,0,0,1,0|2,0,0]=4 2672 B10R1.14 Cc1cc(C(=O)CN)co1 Amb27822884 [0,1,0,0,1,0|2,0,0]=4 2673 B10R1.14 Cc1cc(C(=O)CN)cs1 Amb26392128 [0,1,0,0,1,0|2,0,0]=4 2674 B10R1.14 Cc1cc(C(=O)CN)on1 Amb18202900 [0,1,0,0,1,0|2,0,0]=4 2675 B10R1.14 Cc1cc(C(=O)CN)sn1 Amb27162874 [0,1,0,0,1,0|2,0,0]=4 2676 B10R1.14 Cc1cc(C(=O)NN)cs1 Amb6497955 [0,1,0,0,1,0|1,0,0]=3 2677 B10R1.14 Cc1cc(C(=O)NN)no1 Amb2154725 [0,1,0,0,1,0|2,0,0]=4 2678 B10R1.14 Cc1cc(C(=O)NN)on1 Amb10608513 [0,1,0,0,1,0|1,0,0]=3 2679 B10R1.14 Cc1cc(C(=O)NN)sn1 Amb26641499 [0,1,0,0,1,0|1,0,0]=3 2680 B10R1.14 Cc1cc(C(=O)NO)co1 Amb27170849 [0,1,0,0,1,0|2,0,0]=4 2681 B10R1.14 Cc1cc(C(=O)NO)cs1 Amb28455030 [0,1,0,0,1,0|2,0,0]=4 2682 B10R1.14 Cc1ccc(C(=O)CN)o1 Amb18832120 [0,1,0,0,1,0|2,0,0]=4 2683 B10R1.14 Cc1ccc(C(=O)CN)s1 Amb18644749 [0,1,0,0,1,0|2,0,0]=4 2684 B10R1.14 Cc1ccc(C(=O)NN)o1 Amb843223 [0,1,0,0,1,0|1,0,0]=3 2685 B10R1.14 Cc1ccc(C(=O)NN)s1 Amb6537515 [0,1,0,0,1,0|1,0,0]=3 2686 B10R1.14 Cc1ccc(C(=O)NO)s1 Amb6271284 [0,1,0,0,1,0|2,0,0]=4 2687 B10R1.14 Cc1cnc(C(=O)NN)s1 Amb26612504 [0,1,0,0,1,0|2,0,0]=4 2688 B10R1.14 Cc1coc(C(=O)CN)c1 Amb18832119 [0,1,0,0,1,0|2,0,0]=4 2689 B10R1.14 Cc1coc(C(=O)NN)n1 Amb27642710 [0,1,0,0,1,0|2,0,0]=4 2690 B10R1.14 Cc1csc(C(=O)CN)c1 Amb18200378 [0,1,0,0,1,0|2,0,0]=4 2691 B10R1.14 Cc1csc(C(=O)NN)c1 Amb2738050 [0,1,0,0,1,0|1,0,0]=3 2692 B10R1.14 Cc1csc(C(=O)NO)c1 Amb27185760 [0,1,0,0,1,0|2,0,0]=4 2693 B10R1.14 Cc1nc(C(=O)NN)co1 Amb8483751 [0,1,0,0,1,0|2,0,0]=4 2694 B10R1.14 Cc1nc(C(=O)NN)cs1 Amb2689716 [0,1,0,0,1,0|2,0,0]=4 2695 B10R1.14 Cc1ncc(C(=O)CN)s1 Amb18830754 [0,1,0,0,1,0|2,0,0]=4 2696 B10R1.14 Cc1ncc(C(=O)NN)s1 Amb18255500 [0,1,0,0,1,0|1,0,0]=3 2697 B10R1.14 Cc1noc(C(=O)NN)n1 Amb16187035 [0,1,0,0,1,0|2,0,0]=4 2698 B10R1.14 Cc1nsc(C(=O)NN)n1 Amb22395195 [0,1,0,0,1,0|2,0,0]=4 2699 B10R1.14 Cn1cc(C(=O)CN)cn1 Amb18832076 [0,1,0,0,1,0|2,0,0]=4 2700 B10R1.14 Cn1cc(C(=O)CN)cn1 Amb32683550 [0,1,0,0,1,0|2,0,0]=4 2701 B10R1.14 Cn1cc(C(=O)CN)cn1 Amb32684922 [0,1,0,0,1,0|2,0,0]=4 2702 B10R1.14 Cn1cc(C(=O)NN)cn1 Amb1945631 [0,1,0,0,1,0|1,0,0]=3 2703 B10R1.14 Cn1cc(C(=O)NN)nn1 Amb25782415 [0,1,0,0,1,0|2,0,0]=4 2704 B10R1.14 Cn1cc(C(=O)NO)cn1 Amb6739818 [0,1,0,0,1,0|2,0,0]=4 2705 B10R1.14 Cn1ccc(C(=O)CN)c1 Amb18063871 [0,1,0,0,1,0|1,0,1]=4 2706 B10R1.14 Cn1ccc(C(=O)NN)n1 Amb6395572 [0,1,0,0,1,0|1,0,1]=4 2707 B10R1.14 Cn1ccc(C(=O)NO)c1 Amb27764584 [0,1,0,0,1,0|1,0,1]=4 2708 B10R1.14 Cn1cnc(C(=O)NN)c1 Amb23401037 [0,1,0,0,1,0|1,0,1]=4 2709 B10R1.14 Cn1cnc(C(=O)NN)c1 Amb33329097 [0,1,0,0,1,0|1,0,1]=4 2710 B10R1.14 NCC(=O)c1cc(Br)co1 Amb33332863 [0,1,0,0,1,0|2,0,0]=4 2711 B10R1.14 NCC(=O)c1cc(Br)cs1 Amb18570715 [0,1,0,0,1,0|2,0,0]=4 2712 B10R1.14 NCC(=O)c1cc(Cl)cs1 Amb18191154 [0,1,0,0,1,0|2,0,0]=4 2713 B10R1.14 NCC(=O)c1ccc(Br)o1 Amb26486128 [0,1,0,0,1,0|2,0,0]=4 2714 B10R1.14 NCC(=O)c1ccc(Br)s1 Amb17195356 [0,1,0,0,1,0|2,0,0]=4 2715 B10R1.14 NCC(=O)c1ccc(Cl)o1 Amb28042078 [0,1,0,0,1,0|2,0,0]=4 2716 B10R1.14 NCC(=O)c1ccc(Cl)s1 Amb17194497 [0,1,0,0,1,0|2,0,0]=4 2717 B10R1.14 NCC(=O)c1ccc(Cl)s1 Amb32671393 [0,1,0,0,1,0|2,0,0]=4 2718 B10R1.14 NCC(=O)c1ccc(I)s1 Amb27423599 [0,1,0,0,1,0|2,0,0]=4 2719 B10R1.14 NCC(=O)c1cnc(Cl)s1 Amb33059189 [0,1,0,0,1,0|2,0,0]=4 2720 B10R1.14 NCC(=O)c1csc(Br)c1 Amb27978815 [0,1,0,0,1,0|2,0,0]=4 2721 B10R1.14 NNC(=O)C1=CNC(=O)N1 Amb25877300 [0,1,0,0,1,0|1,0,1]=4 2722 B10R1.14 NNC(=O)c1cc(Br)co1 Amb23595606 [0,1,0,0,1,0|1,0,0]=3 2723 B10R1.14 NNC(=O)c1cc(Br)cs1 Amb1935126 [0,1,0,0,1,0|1,0,0]=3 2724 B10R1.14 NNC(=O)c1cc(Cl)cs1 Amb23441689 [0,1,0,0,1,0|1,0,0]=3 2725 B10R1.14 NNC(=O)c1cc(Cl)on1 Amb24478879 [0,1,0,0,1,0|2,0,0]=4 2726 B10R1.14 NNC(=O)c1cc(N)on1 Amb27790599 [0,1,0,0,1,0|2,0,0]=4 2727 B10R1.14 NNC(=O)c1ccc(Br)o1 Amb6393354 [0,1,0,0,1,0|1,0,0]=3 2728 B10R1.14 NNC(=O)c1ccc(Br)s1 Amb6544983 [0,1,0,0,1,0|1,0,0]=3 2729 B10R1.14 NNC(=O)c1ccc(Cl)s1 Amb6462680 [0,1,0,0,1,0|1,0,0]=3 2730 B10R1.14 NNC(=O)c1ccc(F)s1 Amb24269163 [0,1,0,0,1,0|1,0,0]=3 2731 B10R1.14 NNC(=O)c1coc(Br)n1 Amb27239634 [0,1,0,0,1,0|2,0,0]=4 2732 B10R1.14 NNC(=O)c1csc(N)n1 Amb1987313 [0,1,0,0,1,0|2,0,0]=4 2733 B10R1.14 NNC(=O)c1ncc(I)s1 Amb27494160 [0,1,0,0,1,0|2,0,0]=4 2734 B10R1.14 NNC(=O)c1nnc(N)o1 Amb24480658 [0,1,0,0,1,0|2,0,0]=4 2735 B10R1.14 O=C(NO)c1cc(O)cs1 Amb27762310 [0,1,0,0,1,0|2,0,0]=4 2736 B10R1.14 O=C(NO)c1ccc(Br)o1 Amb6258736 [0,1,0,0,1,0|2,0,0]=4 2737 B10R1.14 O=C(NO)c1ccc(Br)s1 Amb2330556 [0,1,0,0,1,0|2,0,0]=4 2738 B10R1.14 O=C(NO)c1coc(Br)c1 Amb27827001 [0,1,0,0,1,0|2,0,0]=4 2739 B10R1.23 CC(N)C(=O)c1ccco1 Amb16767094 [0,1,0,0,1,0|2,0,0]=4 2740 B10R1.23 CC(N)C(=O)c1cccs1 Amb3482945 [0,1,0,0,1,0|2,0,0]=4 2741 B10R1.23 CC(N)C(=O)c1ccns1 Amb27795974 [0,1,0,0,1,0|2,0,0]=4 2742 B10R1.23 CC(N)C(=O)c1ccoc1 Amb28050498 [0,1,0,0,1,0|2,0,0]=4 2743 B10R1.23 CC(N)C(=O)c1ccsc1 Amb24384735 [0,1,0,0,1,0|2,0,0]=4 2744 B10R1.23 CC(N)C(=O)c1cnco1 Amb33415764 [0,1,0,0,1,0|2,0,0]=4 2745 B10R1.23 CC(N)C(=O)c1cncs1 Amb18830758 [0,1,0,0,1,0|2,0,0]=4 2746 B10R1.23 CC(N)C(=O)c1cnsc1 Amb30009641 [0,1,0,0,1,0|2,0,0]=4 2747 B10R1.23 CN(C)C(=O)c1ccco1 Amb3886564 [0,1,0,0,1,0|2,0,0]=4 2748 B10R1.23 CN(C)C(=O)c1cccs1 Amb3886607 [0,1,0,0,1,0|2,0,0]=4 2749 B10R1.23 CN(C)C(=O)c1ccoc1 Amb28283726 [0,1,0,0,1,0|2,0,0]=4 2750 B10R1.23 CN(C)C(=O)c1ccsc1 Amb8329759 [0,1,0,0,1,0|2,0,0]=4 2751 B10R1.23 CN(C)C(=O)n1ccnc1 Amb2572303 [0,1,0,0,1,0|2,0,0]=4 2752 B10R1.23 CN(O)C(=O)c1ccco1 Amb10572677 [0,1,0,0,1,0|2,0,0]=4 2753 B10R1.23 CN(O)C(=O)c1cccs1 Amb27777687 [0,1,0,0,1,0|2,0,0]=4 2754 B10R1.23 C[C@@H](N)C(=O)c1ccco1 Amb30024127 [0,1,0,0,1,0|2,0,0]=4 2755 B10R1.23 C[C@@H](N)C(=O)c1cccs1 Amb33131686 [0,1,0,0,1,0|2,0,0]=4 2756 B10R1.23 C[C@@H](N)C(=O)c1ccns1 Amb33131723 [0,1,0,0,1,0|2,0,0]=4 2757 B10R1.23 C[C@@H](N)C(=O)c1ccoc1 Amb30023704 [0,1,0,0,1,0|2,0,0]=4 2758 B10R1.23 C[C@@H](N)C(=O)c1ccsc1 Amb33131685 [0,1,0,0,1,0|2,0,0]=4 2759 B10R1.23 C[C@@H](N)C(=O)c1cncs1 Amb33131728 [0,1,0,0,1,0|2,0,0]=4 2760 B10R1.23 C[C@@H](N)C(=O)c1cnsc1 Amb30022782 [0,1,0,0,1,0|2,0,0]=4 2761 B10R1.23 C[C@H](N)C(=O)c1ccco1 Amb33131772 [0,1,0,0,1,0|2,0,0]=4 2762 B10R1.23 C[C@H](N)C(=O)c1cccs1 Amb33131779 [0,1,0,0,1,0|2,0,0]=4 2763 B10R1.23 C[C@H](N)C(=O)c1ccns1 Amb30024755 [0,1,0,0,1,0|2,0,0]=4 2764 B10R1.23 C[C@H](N)C(=O)c1ccoc1 Amb33131771 [0,1,0,0,1,0|2,0,0]=4 2765 B10R1.23 C[C@H](N)C(=O)c1ccsc1 Amb33131778 [0,1,0,0,1,0|2,0,0]=4 2766 B10R1.23 C[C@H](N)C(=O)c1cncs1 Amb33131836 [0,1,0,0,1,0|2,0,0]=4 2767 B10R1.23 C[C@H](N)C(=O)c1cnsc1 Amb30024512 [0,1,0,0,1,0|2,0,0]=4 2768 B10R1.23 NC(=O)C(=O)c1ccco1 Amb9786661 [0,1,0,0,1,0|2,0,0]=4 2769 B10R1.23 NC(=O)C(=O)c1cccs1 Amb28396525 [0,1,0,0,1,0|2,0,0]=4 2770 B10R1.23 NC(=S)C(=O)c1ccco1 Amb27845425 [0,1,0,0,1,0|2,0,0]=4 2771 B10R1.23 NC(=S)C(=O)c1cccs1 Amb28061990 [0,1,0,0,1,0|2,0,0]=4 2772 B10R1.149 CNC(=O)c1cccn1C Amb22001260 [0,1,0,0,1,0|2,0,0]=4 2773 B10R1.149 CNC(=O)c1ccnn1C Amb2106617 [0,1,0,0,1,0|2,0,0]=4 2774 B10R1.149 CNC(=O)c1ccsc1Br Amb29893063 [0,1,0,0,1,0|2,0,0]=4 2775 B10R1.149 CNC(=O)c1ccsc1N Amb8867374 [0,1,0,0,1,0|2,0,0]=4 2776 B10R1.149 CNC(=O)c1cnoc1N Amb13881465 [0,1,0,0,1,0|2,0,0]=4 2777 B10R1.149 CNC(=O)c1conc1C Amb35679418 [0,1,0,0,1,0|2,0,0]=4 2778 B10R1.149 CNC(=O)c1conc1N Amb27399852 [0,1,0,0,1,0|2,0,0]=4 2779 B10R1.149 CNC(=O)c1cscc1C Amb27837757 [0,1,0,0,1,0|2,0,0]=4 2780 B10R1.149 CNC(=O)c1csnc1C Amb27771085 [0,1,0,0,1,0|2,0,0]=4 2781 B10R1.149 CNC(=O)c1sccc1Br Amb11370089 [0,1,0,0,1,0|2,0,0]=4 2782 B10R1.149 CNC(=O)c1sccc1C Amb8336391 [0,1,0,0,1,0|2,0,0]=4 2783 B10R1.149 CNC(=O)c1sccc1Cl Amb27759614 [0,1,0,0,1,0|2,0,0]=4 2784 B10R1.149 CNC(=O)c1sccc1F Amb27456604 [0,1,0,0,1,0|2,0,0]=4 2785 B10R1.149 CNC(=O)c1sccc1N Amb15701298 [0,1,0,0,1,0|2,0,0]=4 2786 B10R1.149 CNC(=O)c1scnc1Cl Amb26027509 [0,1,0,0,1,0|2,0,0]=4 2787 B10R1.149 Cc1ccoc1C(=O)CN Amb24458130 [0,1,0,0,1,0|2,0,0]=4 2788 B10R1.149 Cc1ccoc1C(=O)NO Amb6276413 [0,1,0,0,1,0|2,0,0]=4 2789 B10R1.149 Cc1ccsc1C(=O)CN Amb18251480 [0,1,0,0,1,0|2,0,0]=4 2790 B10R1.149 Cc1ccsc1C(=O)NN Amb1950412 [0,1,0,0,1,0|1,0,0]=3 2791 B10R1.149 Cc1cnsc1C(=O)NN Amb26009809 [0,1,0,0,1,0|1,0,0]=3 2792 B10R1.149 Cc1cocc1C(=O)CN Amb27442836 [0,1,0,0,1,0|2,0,0]=4 2793 B10R1.149 Cc1cocc1C(=O)NN Amb27235036 [0,1,0,0,1,0|1,0,0]=3 2794 B10R1.149 Cc1cscc1C(=O)CN Amb27250844 [0,1,0,0,1,0|2,0,0]=4 2795 B10R1.149 Cc1cscc1C(=O)NN Amb27837758 [0,1,0,0,1,0|1,0,0]=3 2796 B10R1.149 Cc1ncoc1C(=O)NO Amb28049397 [0,1,0,0,1,0|2,0,0]=4 2797 B10R1.149 Cc1ncsc1C(=O)CN Amb18830749 [0,1,0,0,1,0|2,0,0]=4 2798 B10R1.149 Cc1ncsc1C(=O)NN Amb6254701 [0,1,0,0,1,0|1,0,0]=3 2799 B10R1.149 Cc1nnsc1C(=O)NN Amb582963 [0,1,0,0,1,0|2,0,0]=4 2800 B10R1.149 Cc1nocc1C(=O)NN Amb35679619 [0,1,0,0,1,0|1,0,0]=3 2801 B10R1.149 Cc1nocc1C(=O)NO Amb35679621 [0,1,0,0,1,0|2,0,0]=4 2802 B10R1.149 Cc1nonc1C(=O)NN Amb16186714 [0,1,0,0,1,0|2,0,0]=4 2803 B10R1.149 Cc1nonc1C(=O)NN Amb27458699 [0,1,0,0,1,0|2,0,0]=4 2804 B10R1.149 Cc1nscc1C(=O)NN Amb23440912 [0,1,0,0,1,0|1,0,0]=3 2805 B10R1.149 Cc1occc1C(=O)CN Amb27952123 [0,1,0,0,1,0|2,0,0]=4 2806 B10R1.149 Cc1occc1C(=O)NN Amb6355874 [0,1,0,0,1,0|1,0,0]=3 2807 B10R1.149 Cc1ocnc1C(=O)NN Amb17622000 [0,1,0,0,1,0|2,0,0]=4 2808 B10R1.149 Cc1oncc1C(=O)CN Amb18202906 [0,1,0,0,1,0|2,0,0]=4 2809 B10R1.149 Cc1oncc1C(=O)NO Amb6269856 [0,1,0,0,1,0|2,0,0]=4 2810 B10R1.149 Cc1sccc1C(=O)CN Amb27399086 [0,1,0,0,1,0|2,0,0]=4 2811 B10R1.149 Cc1scnc1C(=O)NN Amb22499494 [0,1,0,0,1,0|2,0,0]=4 2812 B10R1.149 Cc1snnc1C(=O)NN Amb25795217 [0,1,0,0,1,0|2,0,0]=4 2813 B10R1.149 Cn1cccc1C(=N)NN Amb24479594 [0,1,0,0,1,0|2,0,0]=4 2814 B10R1.149 Cn1cccc1C(=O)CN Amb18832209 [0,1,0,0,1,0|2,0,0]=4 2815 B10R1.149 Cn1cccc1C(=O)NN Amb1154595 [0,1,0,0,1,0|1,0,0]=3 2816 B10R1.149 Cn1ccnc1C(=O)NN Amb6373955 [0,1,0,0,1,0|2,0,0]=4 2817 B10R1.149 Cn1cncc1C(=O)CN Amb18832068 [0,1,0,0,1,0|2,0,0]=4 2818 B10R1.149 Cn1cncc1C(=O)NN Amb2723361 [0,1,0,0,1,0|1,0,0]=3 2819 B10R1.149 Cn1nccc1C(=O)CN Amb18832077 [0,1,0,0,1,0|2,0,0]=4 2820 B10R1.149 Cn1nccc1C(=O)CN Amb33482997 [0,1,0,0,1,0|2,0,0]=4 2821 B10R1.149 Cn1nccc1C(=O)NN Amb6461417 [0,1,0,0,1,0|1,0,0]=3 2822 B10R1.149 Cn1ncnc1C(=O)NN Amb26874434 [0,1,0,0,1,0|2,0,0]=4 2823 B10R1.149 NCC(=O)c1ccoc1Cl Amb27474450 [0,1,0,0,1,0|2,0,0]=4 2824 B10R1.149 NCC(=O)c1ccsc1Br Amb29891181 [0,1,0,0,1,0|2,0,0]=4 2825 B10R1.149 NCC(=O)c1ccsc1Cl Amb26352243 [0,1,0,0,1,0|2,0,0]=4 2826 B10R1.149 NCC(=O)c1cscc1Br Amb27253758 [0,1,0,0,1,0|2,0,0]=4 2827 B10R1.149 NCC(=O)c1cscc1Cl Amb33307676 [0,1,0,0,1,0|2,0,0]=4 2828 B10R1.149 NCC(=O)c1occc1Br Amb24357342 [0,1,0,0,1,0|2,0,0]=4 2829 B10R1.149 NCC(=O)c1sccc1Br Amb24675888 [0,1,0,0,1,0|2,0,0]=4 2830 B10R1.149 NCC(=O)c1sccc1Cl Amb18822609 [0,1,0,0,1,0|2,0,0]=4 2831 B10R1.149 NCC(=O)c1sccc1N Amb28132869 [0,1,0,0,1,0|2,0,0]=4 2832 B10R1.149 NCC(=O)c1sncc1Br Amb33307989 [0,1,0,0,1,0|2,0,0]=4 2833 B10R1.149 NNC(=O)C1C=NNC1=O Amb5716857 [0,1,0,0,1,0|1,0,1]=4 2834 B10R1.149 NNC(=O)c1ccsc1Br Amb22498153 [0,1,0,0,1,0|1,0,0]=3 2835 B10R1.149 NNC(=O)c1cscc1Br Amb35697813 [0,1,0,0,1,0|1,0,0]=3 2836 B10R1.149 NNC(=O)c1ncsc1Br Amb35599714 [0,1,0,0,1,0|2,0,0]=4 2837 B10R1.149 NNC(=O)c1nonc1N Amb1040669 [0,1,0,0,1,0|2,0,0]=4 2838 B10R1.149 NNC(=O)c1nscc1Br Amb35697812 [0,1,0,0,1,0|2,0,0]=4 2839 B10R1.149 NNC(=O)c1nscc1N Amb1089975 [0,1,0,0,1,0|2,0,0]=4 2840 B10R1.149 NNC(=O)c1nsnc1N Amb25106946 [0,1,0,0,1,0|2,0,0]=4 2841 B10R1.149 NNC(=O)c1occc1Br Amb27802344 [0,1,0,0,1,0|1,0,0]=3 2842 B10R1.149 NNC(=O)c1occc1Br Amb35674832 [0,1,0,0,1,0|1,0,0]=3 2843 B10R1.149 NNC(=O)c1sccc1Br Amb22736361 [0,1,0,0,1,0|1,0,0]=3 2844 B10R1.149 NNC(=O)c1sccc1Cl Amb22432395 [0,1,0,0,1,0|1,0,0]=3 2845 B10R1.149 NNC(=O)c1sccc1N Amb2737574 [0,1,0,0,1,0|1,0,0]=3 2846 B10R1.149 NNC(=O)c1scnc1Br Amb27164046 [0,1,0,0,1,0|1,0,0]=3 2847 B10R1.149 NNC(=O)c1scnc1Cl Amb25070791 [0,1,0,0,1,0|1,0,0]=3 2848 B10R1.149 NNC(=O)c1scnc1Cl Amb27762206 [0,1,0,0,1,0|1,0,0]=3 2849 B10R1.149 O=C(NO)c1ccsc1Br Amb29891214 [0,1,0,0,1,0|2,0,0]=4 2850 B10R1.149 O=C(NO)c1occc1Cl Amb28381933 [0,1,0,0,1,0|2,0,0]=4 2851 B10R1.149 O=C(NO)c1sccc1Cl Amb27193719 [0,1,0,0,1,0|2,0,0]=4 2852 B10R1.149 O=C(NO)c1sccc1O Amb27658871 [0,1,0,0,1,0|2,0,0]=4 2853 B10R1.149 O=C(NO)c1scnc1Cl Amb27980130 [0,1,0,0,1,0|2,0,0]=4 2854 B12R1.32 C#CCC(=O)Cc1ccncc1 Amb18800091 [0,1,0,0,0,1|2,0,0]=4 2855 B12R1.32 C#CCC(=O)Nc1ccncc1 Amb35735614 [0,1,0,0,0,1|2,0,0]=4 2856 B12R1.32 C#CNC(=O)Nc1ccccc1 Amb27973353 [0,1,0,0,0,1|2,0,0]=4 2857 B12R1.32 C=CNC(=O)Cc1ccccc1 Amb27455089 [0,1,0,0,0,1|2,0,0]=4 2858 B12R1.32 CC#CC(=O)Nc1ccncc1 Amb28363993 [0,1,0,0,0,1|2,0,0]=4 2859 B12R1.32 CCCC(=O)Nc1ccncc1 Amb3367511 [0,1,0,0,0,1|2,0,0]=4 2860 B12R1.32 CCNC(=O)Nc1ccccc1 Amb1233665 [0,1,0,0,0,1|2,0,0]=4 2861 B12R1.32 CCNC(=O)Nc1ccncc1 Amb4012419 [0,1,0,0,0,1|1,0,0]=3 2862 B12R1.32 CCNC(=O)Oc1ccccc1 Amb2732291 [0,1,0,0,0,1|2,0,0]=4 2863 B12R1.32 CCOC(=O)Cc1ccncc1 Amb20621993 [0,1,0,0,0,1|2,0,0]=4 2864 B12R1.32 CCOC(=O)Cc1ccncc1 Amb6357492 [0,1,0,0,0,1|2,0,0]=4 2865 B12R1.32 CCOC(=O)Nc1ccncc1 Amb2692772 [0,1,0,0,0,1|2,0,0]=4 2866 B12R1.32 CNCC(=O)Cc1ccccc1 Amb32954289 [0,1,0,0,0,1|2,0,0]=4 2867 B12R1.32 CNCC(=O)Cc1ccccc1 Amb8628392 [0,1,0,0,0,1|2,0,0]=4 2868 B12R1.32 CNCC(=O)Nc1ccccc1 Amb6246115 [0,1,0,0,0,1|2,0,0]=4 2869 B12R1.32 CNCC(=O)Nc1ccccc1 Amb6893116 [0,1,0,0,0,1|2,0,0]=4 2870 B12R1.32 CNNC(=O)Nc1ccccc1 Amb28252417 [0,1,0,0,0,1|1,0,0]=3 2871 B12R1.32 COCC(=O)Nc1ccncc1 Amb1832638 [0,1,0,0,0,1|2,0,0]=4 2872 B12R1.32 CONC(=O)Cc1ccccc1 Amb16969924 [0,1,0,0,0,1|2,0,0]=4 2873 B12R1.32 CONC(=O)Cc1ccncc1 Amb27969875 [0,1,0,0,0,1|1,0,0]=3 2874 B12R1.32 CONC(=O)Nc1ccncc1 Amb28185717 [0,1,0,0,0,1|1,0,0]=3 2875 B12R1.32 CONC(=O)Nc1ccncn1 Amb27487282 [0,1,0,0,0,1|2,0,0]=4 2876 B12R1.32 CSCC(=O)Nc1ccncc1 Amb27255972 [0,1,0,0,0,1|2,0,0]=4 2877 B12R1.32 C\C(=C/c1ccccc1)CNN Amb27769440 [0,1,0,0,0,1|2,0,0]=4 2878 B12R1.32 C\C=C\C(=O)Cc1ccncc1 Amb28063108 [0,1,0,0,0,1|2,0,0]=4 2879 B12R1.32 C\C=C\C(=O)Nc1ccncc1 Amb27858099 [0,1,0,0,0,1|2,0,0]=4 2880 B12R1.32 N#CCC(=O)Nc1ccncc1 Amb2439296 [0,1,0,0,0,1|1,0,1]=4 2881 B12R1.32 N#CNC(=O)Cc1ccncc1 Amb27180120 [0,1,0,0,0,1|0,0,1]=3 2882 B12R1.32 N#CNC(=O)Nc1ccccc1 Amb17939016 [0,1,0,0,0,1|1,0,1]=4 2883 B12R1.32 N#CNC(=O)Oc1ccccc1 Amb27215212 [0,1,0,0,0,1|1,0,1]=4 2884 B12R1.32 NCCC(=O)Cc1ccccc1 Amb32954715 [0,1,0,0,0,1|2,0,0]=4 2885 B12R1.32 NCCC(=O)Nc1ccccc1 Amb1125528 [0,1,0,0,0,1|2,0,0]=4 2886 B12R1.32 NCCC(=O)Nc1ccccc1 Amb15740909 [0,1,0,0,0,1|2,0,0]=4 2887 B12R1.32 NCCC(=O)Nc1ccncc1 Amb1126146 [0,1,0,0,0,1|1,0,0]=3 2888 B12R1.32 NCCC(=O)Nc1ccncc1 Amb13952138 [0,1,0,0,0,1|1,0,0]=3 2889 B12R1.32 NCCC(=O)Nc1ccncc1 Amb13952153 [0,1,0,0,0,1|1,0,0]=3 2890 B12R1.32 NCCC(=O)Oc1ccccc1 Amb17334633 [0,1,0,0,0,1|2,0,0]=4 2891 B12R1.32 NCOC(=O)Nc1ccccc1 Amb27407731 [0,1,0,0,0,1|2,0,0]=4 2892 B12R1.32 NNCC(=O)Nc1ccccc1 Amb26632802 [0,1,0,0,0,1|1,0,0]=3 2893 B12R1.32 NOCC(=O)Oc1ccccc1 Amb24096859 [0,1,0,0,0,1|2,0,0]=4 2894 B12R1.32 O=C(CCCl)Nc1ccncc1 Amb1128057 [0,1,0,0,0,1|2,0,0]=4 2895 B12R1.32 O=C(Cc1ccccc1)NCO Amb2720941 [0,1,0,0,0,1|2,0,0]=4 2896 B12R1.32 O=C(Cc1ccncc1)N=C=S Amb27218266 [0,1,0,0,0,1|1,0,1]=4 2897 B12R1.32 O=C(Nc1ccncc1)OCCl Amb35645063 [0,1,0,0,0,1|2,0,0]=4 2898 B12R1.32 O=C=NC(=O)Cc1ccncc1 Amb26346710 [0,1,0,0,0,1|1,0,1]=4 2899 B12R1.32 O=CNC(=O)Cc1ccccc1 Amb6360720 [0,1,0,0,0,1|2,0,0]=4 2900 B12R1.34 C#CC(=O)N(C)c1ccncc1 Amb35712458 [0,1,0,0,0,1|2,0,0]=4 2901 B12R1.34 CC(C(=O)CN)c1ccccc1 Amb24535411 [0,1,0,0,0,1|2,0,0]=4 2902 B12R1.34 CC(C(=O)NN)c1ccccc1 Amb28120718 [0,1,0,0,0,1|1,0,0]=3 2903 B12R1.34 CCC(=O)C(=O)c1ccncc1 Amb25245097 [0,1,0,0,0,1|2,0,0]=4 2904 B12R1.34 CN(C(=O)CBr)c1ccncc1 Amb27429129 [0,1,0,0,0,1|2,0,0]=4 2905 B12R1.34 CN(C(=O)CCl)c1ccncc1 Amb27229325 [0,1,0,0,0,1|2,0,0]=4 2906 B12R1.34 CN(C(=O)CN)c1ccccc1 Amb5783073 [0,1,0,0,0,1|2,0,0]=4 2907 B12R1.34 CN(C(=O)CN)c1ccncc1 Amb25800986 [0,1,0,0,0,1|1,0,0]=3 2908 B12R1.34 CN(C(=O)NO)c1ccccc1 Amb26639375 [0,1,0,0,0,1|2,0,0]=4 2909 B12R1.34 CN(C(=S)NN)c1ccccc1 Amb18564176 [0,1,0,0,0,1|1,1,0]=4 2910 B12R1.34 CNC(=O)C(=O)c1ccccc1 Amb17334577 [0,1,0,0,0,1|2,0,0]=4 2911 B12R1.34 CNC(=O)C(Br)c1ccccc1 Amb8631535 [0,1,0,0,0,1|2,0,0]=4 2912 B12R1.34 CNC(=O)C(C)c1ccccc1 Amb28325026 [0,1,0,0,0,1|2,0,0]=4 2913 B12R1.34 CNC(=O)C(Cl)c1ccccc1 Amb9209230 [0,1,0,0,0,1|2,0,0]=4 2914 B12R1.34 CNC(=O)C(F)c1ccccc1 Amb27660594 [0,1,0,0,0,1|2,0,0]=4 2915 B12R1.34 CNC(=O)C(N)c1ccccc1 Amb33549035 [0,1,0,0,0,1|2,0,0]=4 2916 B12R1.34 CNC(=O)C(N)c1ccccc1 Amb9726565 [0,1,0,0,0,1|2,0,0]=4 2917 B12R1.34 CNC(=O)C(N)c1ccncc1 Amb24396250 [0,1,0,0,0,1|1,0,0]=3 2918 B12R1.34 CNC(=O)C(O)c1ccccc1 Amb17400179 [0,1,0,0,0,1|2,0,0]=4 2919 B12R1.34 CNC(=O)C(O)c1ccncc1 Amb24497547 [0,1,0,0,0,1|1,0,0]=3 2920 B12R1.34 CNC(=O)N(O)c1ccccc1 Amb4136448 [0,1,0,0,0,1|2,0,0]=4 2921 B12R1.34 CNC(=O)[C@@H](N)c1ccccc1 Amb17232478 [0,1,0,0,0,1|2,0,0]=4 2922 B12R1.34 CNC(=O)[C@@H](O)c1ccccc1 Amb28398484 [0,1,0,0,0,1|2,0,0]=4 2923 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb24678684 [0,1,0,0,0,1|2,0,0]=4 2924 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb32686954 [0,1,0,0,0,1|2,0,0]=4 2925 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 Amb25792321 [0,1,0,0,0,1|2,0,0]=4 2926 B12R1.34 COC(=O)C(Br)c1ccncc1 Amb31193091 [0,1,0,0,0,1|2,0,0]=4 2927 B12R1.34 COC(=O)C(C)c1ccncc1 Amb19374810 [0,1,0,0,0,1|2,0,0]=4 2928 B12R1.34 COC(=O)C(Cl)c1ccncc1 Amb24497439 [0,1,0,0,0,1|2,0,0]=4 2929 B12R1.34 COC(=O)C(N)c1ccncc1 Amb23400053 [0,1,0,0,0,1|2,0,0]=4 2930 B12R1.34 COC(=O)C(N)c1ccncc1 Amb23401700 [0,1,0,0,0,1|2,0,0]=4 2931 B12R1.34 COC(=O)C(O)c1ccncc1 Amb23580591 [0,1,0,0,0,1|2,0,0]=4 2932 B12R1.34 NC(C(=O)NO)c1ccccc1 Amb2430893 [0,1,0,0,0,1|2,0,0]=4 2933 B12R1.34 NCC(=O)N(N)c1ccccc1 Amb34915865 [0,1,0,0,0,1|2,0,0]=4 2934 B12R1.34 NNC(=O)C(Cl)c1ccccc1 Amb27760517 [0,1,0,0,0,1|1,0,0]=3 2935 B12R1.34 NNC(=O)C(N)c1ccccc1 Amb18061964 [0,1,0,0,0,1|1,0,0]=3 2936 B12R1.34 NNC(=O)C(O)c1ccccc1 Amb9758540 [0,1,0,0,0,1|1,0,0]=3 2937 B12R1.34 NNC(=O)[C@@H](O)c1ccccc1 Amb22587557 [0,1,0,0,0,1|1,0,0]=3 2938 B12R1.34 NNC(=O)[C@H](N)c1ccccc1 Amb28458191 [0,1,0,0,0,1|1,0,0]=3 2939 B12R1.34 NNC(=O)[C@H](O)c1ccccc1 Amb25121730 [0,1,0,0,0,1|1,0,0]=3 2940 B12R1.34 N[C@H](C(=O)NO)c1ccccc1 Amb27236809 [0,1,0,0,0,1|2,0,0]=4 2941 B12R1.34 O=C(CBr)C(Br)c1ccncc1 Amb28244342 [0,1,0,0,0,1|2,0,0]=4 2942 B12R1.34 O=C(NCl)C(Cl)c1ccccc1 Amb27799831 [0,1,0,0,0,1|2,0,0]=4 2943 B12R1.43 C=C(C)C(=O)Cc1ccncc1 Amb28369377 [0,1,0,0,0,1|2,0,0]=4 2944 B12R1.43 C=C(C)C(=O)Nc1ccncc1 Amb2613139 [0,1,0,0,0,1|2,0,0]=4 2945 B12R1.43 CC(=O)C(=O)Cc1ccncc1 Amb24555440 [0,1,0,0,0,1|2,0,0]=4 2946 B12R1.43 CC(Br)C(=O)Nc1ccncc1 Amb27587589 [0,1,0,0,0,1|2,0,0]=4 2947 B12R1.43 CC(C)C(=O)Nc1ccncc1 Amb3357894 [0,1,0,0,0,1|2,0,0]=4 2948 B12R1.43 CC(Cl)C(=O)Cc1ccncc1 Amb27626826 [0,1,0,0,0,1|2,0,0]=4 2949 B12R1.43 CC(Cl)C(=O)Nc1ccncc1 Amb1140684 [0,1,0,0,0,1|2,0,0]=4 2950 B12R1.43 CC(N)C(=O)Cc1ccccc1 Amb18829240 [0,1,0,0,0,1|2,0,0]=4 2951 B12R1.43 CC(N)C(=O)Cc1ccccc1 Amb28653053 [0,1,0,0,0,1|2,0,0]=4 2952 B12R1.43 CC(N)C(=O)Cc1ccncc1 Amb27976866 [0,1,0,0,0,1|1,0,0]=3 2953 B12R1.43 CC(N)C(=O)Nc1ccccc1 Amb19419695 [0,1,0,0,0,1|2,0,0]=4 2954 B12R1.43 CC(N)C(=O)Nc1ccccc1 Amb6270579 [0,1,0,0,0,1|2,0,0]=4 2955 B12R1.43 CC(N)C(=O)Nc1ccncc1 Amb18951602 [0,1,0,0,0,1|1,0,0]=3 2956 B12R1.43 CC(N)C(=O)Oc1ccccc1 Amb17334632 [0,1,0,0,0,1|2,0,0]=4 2957 B12R1.43 CC(O)C(=O)Cc1ccncc1 Amb28313084 [0,1,0,0,0,1|2,0,0]=4 2958 B12R1.43 CN(C)C(=O)Cc1ccccc1 Amb1803686 [0,1,0,0,0,1|2,0,0]=4 2959 B12R1.43 CN(C)C(=O)Nc1ccccc1 Amb1221366 [0,1,0,0,0,1|2,0,0]=4 2960 B12R1.43 CN(C)C(=O)Nc1ccncn1 Amb27178795 [0,1,0,0,0,1|2,0,0]=4 2961 B12R1.43 CN(C)C(=O)Oc1ccccc1 Amb4017572 [0,1,0,0,0,1|2,0,0]=4 2962 B12R1.43 CN(N)C(=O)Nc1ccccc1 Amb363918 [0,1,0,0,0,1|1,0,0]=3 2963 B12R1.43 CN(N)C(=S)Nc1ccccc1 Amb1149646 [0,1,0,0,0,1|1,1,0]=4 2964 B12R1.43 CN(O)C(=O)Cc1ccccc1 Amb27622562 [0,1,0,0,0,1|2,0,0]=4 2965 B12R1.43 CN(O)C(=O)Nc1ccccc1 Amb2691797 [0,1,0,0,0,1|2,0,0]=4 2966 B12R1.43 CN(O)C(=O)Oc1ccccc1 Amb28125844 [0,1,0,0,0,1|2,0,0]=4 2967 B12R1.43 C[C@@H](N)C(=O)Cc1ccccc1 Amb35618020 [0,1,0,0,0,1|2,0,0]=4 2968 B12R1.43 C[C@@H](N)C(=O)Cc1ccncc1 Amb35618025 [0,1,0,0,0,1|1,0,0]=3 2969 B12R1.43 C[C@@H](N)C(=O)Nc1ccccc1 Amb18527911 [0,1,0,0,0,1|2,0,0]=4 2970 B12R1.43 C[C@H](N)C(=O)Cc1ccncc1 Amb30024510 [0,1,0,0,0,1|1,0,0]=3 2971 B12R1.43 C[C@H](N)C(=O)Nc1ccccc1 Amb5783242 [0,1,0,0,0,1|2,0,0]=4 2972 B12R1.43 C[C@H](N)C(=O)Oc1ccccc1 Amb28118920 [0,1,0,0,0,1|2,0,0]=4 2973 B12R1.43 N=C(N)C(=O)Cc1ccccc1 Amb27257229 [0,1,0,0,0,1|2,0,0]=4 2974 B12R1.43 NC(=O)C(=O)Cc1ccccc1 Amb28119010 [0,1,0,0,0,1|2,0,0]=4 2975 B12R1.43 NC(=O)C(=O)Nc1ccccc1 Amb1859924 [0,1,0,0,0,1|2,0,0]=4 2976 B12R1.43 NC(=O)C(=O)Oc1ccccc1 Amb26619370 [0,1,0,0,0,1|2,0,0]=4 2977 B12R1.43 O=C(O)C(=O)Cc1ccncc1 Amb17477816 [0,1,0,0,0,1|2,0,0]=4 2978 B12R1.43 O=C(O)C(=O)Nc1ccncc1 Amb9303811 [0,1,0,0,0,1|2,0,0]=4 2979 B12R1.49 CNC(=O)Cc1ccc(Br)cc1 Amb2631901 [0,1,0,0,0,1|2,0,0]=4 2980 B12R1.49 CNC(=O)Cc1ccc(C)cc1 Amb1795465 [0,1,0,0,0,1|2,0,0]=4 2981 B12R1.49 CNC(=O)Cc1ccc(Cl)cc1 Amb3886814 [0,1,0,0,0,1|2,0,0]=4 2982 B12R1.49 CNC(=O)Cc1ccc(N)cc1 Amb1117771 [0,1,0,0,0,1|2,0,0]=4 2983 B12R1.49 CNC(=O)Cc1ccc(N)cc1 Amb15740907 [0,1,0,0,0,1|2,0,0]=4 2984 B12R1.49 CNC(=O)Cc1ccc(O)cc1 Amb18646280 [0,1,0,0,0,1|2,0,0]=4 2985 B12R1.49 CNC(=O)Nc1ccc(C)cc1 Amb3100985 [0,1,0,0,0,1|2,0,0]=4 2986 B12R1.49 CNC(=O)Nc1ccc(I)cc1 Amb27656299 [0,1,0,0,0,1|2,0,0]=4 2987 B12R1.49 CNC(=O)Nc1ccc(N)cc1 Amb7969385 [0,1,0,0,0,1|2,0,0]=4 2988 B12R1.49 CNC(=O)Oc1ccc(Br)cc1 Amb4035803 [0,1,0,0,0,1|2,0,0]=4 2989 B12R1.49 CNC(=O)Oc1ccc(F)cc1 Amb4034483 [0,1,0,0,0,1|2,0,0]=4 2990 B12R1.49 CNC(=O)Oc1ccc(N)cc1 Amb28138056 [0,1,0,0,0,1|2,0,0]=4 2991 B12R1.49 CNC(=O)Oc1ccc(O)cc1 Amb35609765 [0,1,0,0,0,1|2,0,0]=4 2992 B12R1.49 CNC(=O)Oc1ccc(S)cc1 Amb28243833 [0,1,0,0,0,1|2,0,0]=4 2993 B12R1.49 CNC(=O)Sc1ccc(Cl)cc1 Amb4035562 [0,1,0,0,0,1|2,0,0]=4 2994 B12R1.49 CNC(=O)Sc1ccc(F)cc1 Amb27607772 [0,1,0,0,0,1|2,0,0]=4 2995 B12R1.49 CNC(=O)Sc1ccc(O)cc1 Amb27815118 [0,1,0,0,0,1|2,0,0]=4 2996 B12R1.49 Cc1ccc(CC(=O)CN)cc1 Amb18829243 [0,1,0,0,0,1|2,0,0]=4 2997 B12R1.49 Cc1ccc(CC(=O)NN)cc1 Amb1921793 [0,1,0,0,0,1|1,0,0]=3 2998 B12R1.49 Cc1ccc(CC(=O)NN)cn1 Amb28244388 [0,1,0,0,0,1|2,0,0]=4 2999 B12R1.49 Cc1ccc(CC(=O)NO)cc1 Amb8841271 [0,1,0,0,0,1|2,0,0]=4 3000 B12R1.49 Cc1ccc(NC(=O)CN)cc1 Amb5559087 [0,1,0,0,0,1|2,0,0]=4 3001 B12R1.49 Cc1ccc(NC(=O)NN)cc1 Amb9214800 [0,1,0,0,0,1|1,0,0]=3 3002 B12R1.49 Cc1ccc(NC(=O)NN)nc1 Amb35712484 [0,1,0,0,0,1|2,0,0]=4 3003 B12R1.49 Cc1ccc(NC(=S)NN)cc1 Amb1488424 [0,1,0,0,0,1|1,1,0]=4 3004 B12R1.49 Cc1ccc(OC(=N)NN)cc1 Amb28382236 [0,1,0,0,0,1|2,0,0]=4 3005 B12R1.49 Cc1ccc(OC(=O)CN)cc1 Amb17334636 [0,1,0,0,0,1|2,0,0]=4 3006 B12R1.49 Cc1ccc(OC(=O)CN)cc1 Amb19115308 [0,1,0,0,0,1|2,0,0]=4 3007 B12R1.49 Cc1ccc(OC(=O)NN)cc1 Amb28185923 [0,1,0,0,0,1|1,0,0]=3 3008 B12R1.49 Cc1ccc(SC(=O)NN)cc1 Amb27246239 [0,1,0,0,0,1|1,0,0]=3 3009 B12R1.49 N=C(NN)Oc1ccc(Cl)cc1 Amb27769046 [0,1,0,0,0,1|2,0,0]=4 3010 B12R1.49 N=C(NN)Sc1ccc(N)cc1 Amb27440465 [0,1,0,0,0,1|2,0,0]=4 3011 B12R1.49 NCC(=O)Cc1ccc(Br)cc1 Amb18160380 [0,1,0,0,0,1|2,0,0]=4 3012 B12R1.49 NCC(=O)Cc1ccc(Br)cc1 Amb33172776 [0,1,0,0,0,1|2,0,0]=4 3013 B12R1.49 NCC(=O)Cc1ccc(Cl)cc1 Amb18823029 [0,1,0,0,0,1|2,0,0]=4 3014 B12R1.49 NCC(=O)Cc1ccc(F)cc1 Amb18827238 [0,1,0,0,0,1|2,0,0]=4 3015 B12R1.49 NCC(=O)Cc1ccc(F)cc1 Amb28653051 [0,1,0,0,0,1|2,0,0]=4 3016 B12R1.49 NCC(=O)Cc1ccc(I)cc1 Amb27251885 [0,1,0,0,0,1|2,0,0]=4 3017 B12R1.49 NCC(=O)Nc1ccc(Br)cc1 Amb1289627 [0,1,0,0,0,1|2,0,0]=4 3018 B12R1.49 NCC(=O)Nc1ccc(Br)cc1 Amb33550193 [0,1,0,0,0,1|2,0,0]=4 3019 B12R1.49 NCC(=O)Nc1ccc(Cl)cc1 Amb10609916 [0,1,0,0,0,1|2,0,0]=4 3020 B12R1.49 NCC(=O)Nc1ccc(Cl)cc1 Amb6336828 [0,1,0,0,0,1|2,0,0]=4 3021 B12R1.49 NCC(=O)Nc1ccc(F)cc1 Amb21959093 [0,1,0,0,0,1|2,0,0]=4 3022 B12R1.49 NCC(=O)Nc1ccc(F)cc1 Amb6336799 [0,1,0,0,0,1|2,0,0]=4 3023 B12R1.49 NCC(=O)Nc1ccc(I)cc1 Amb30986821 [0,1,0,0,0,1|2,0,0]=4 3024 B12R1.49 NCC(=O)Nc1ccc(I)cc1 Amb7755182 [0,1,0,0,0,1|2,0,0]=4 3025 B12R1.49 NCC(=O)Nc1ccc(N)cc1 Amb33096752 [0,1,0,0,0,1|2,0,0]=4 3026 B12R1.49 NCC(=O)Nc1ccc(N)cc1 Amb33096753 [0,1,0,0,0,1|2,0,0]=4 3027 B12R1.49 NCC(=O)Nc1ccc(O)cc1 Amb13951460 [0,1,0,0,0,1|2,0,0]=4 3028 B12R1.49 NCC(=O)Nc1ccc(O)cc1 Amb9231179 [0,1,0,0,0,1|2,0,0]=4 3029 B12R1.49 NCC(=O)Oc1ccc(Br)cc1 Amb17344448 [0,1,0,0,0,1|2,0,0]=4 3030 B12R1.49 NCC(=O)Oc1ccc(Cl)cc1 Amb17335805 [0,1,0,0,0,1|2,0,0]=4 3031 B12R1.49 NCC(=O)Oc1ccc(F)cc1 Amb17334754 [0,1,0,0,0,1|2,0,0]=4 3032 B12R1.49 NCC(=O)Oc1ccc(O)cc1 Amb27758610 [0,1,0,0,0,1|2,0,0]=4 3033 B12R1.49 NNC(=O)Cc1ccc(Br)cc1 Amb6399224 [0,1,0,0,0,1|1,0,0]=3 3034 B12R1.49 NNC(=O)Cc1ccc(Cl)cc1 Amb6393968 [0,1,0,0,0,1|1,0,0]=3 3035 B12R1.49 NNC(=O)Cc1ccc(Cl)nc1 Amb22898935 [0,1,0,0,0,1|2,0,0]=4 3036 B12R1.49 NNC(=O)Cc1ccc(F)cc1 Amb30594307 [0,1,0,0,0,1|1,0,0]=3 3037 B12R1.49 NNC(=O)Cc1ccc(F)cc1 Amb434069 [0,1,0,0,0,1|1,0,0]=3 3038 B12R1.49 NNC(=O)Cc1ccc(O)cc1 Amb6491716 [0,1,0,0,0,1|1,0,0]=3 3039 B12R1.49 NNC(=O)Nc1ccc(Br)cc1 Amb8854081 [0,1,0,0,0,1|1,0,0]=3 3040 B12R1.49 NNC(=O)Nc1ccc(Cl)cc1 Amb2411255 [0,1,0,0,0,1|1,0,0]=3 3041 B12R1.49 NNC(=O)Nc1ccc(F)cc1 Amb10839092 [0,1,0,0,0,1|1,0,0]=3 3042 B12R1.49 NNC(=O)Nc1ccc(F)cc1 Amb8841740 [0,1,0,0,0,1|1,0,0]=3 3043 B12R1.49 NNC(=S)Cc1ccc(F)cc1 Amb26504016 [0,1,0,0,0,1|1,1,0]=4 3044 B12R1.49 NNC(=S)Nc1ccc(Br)cc1 Amb6550486 [0,1,0,0,0,1|1,1,0]=4 3045 B12R1.49 NNC(=S)Nc1ccc(Cl)cc1 Amb6364734 [0,1,0,0,0,1|1,1,0]=4 3046 B12R1.49 NNC(=S)Nc1ccc(F)cc1 Amb1149110 [0,1,0,0,0,1|1,1,0]=4 3047 B12R1.49 NNC(=S)Nc1ccc(I)cc1 Amb2688879 [0,1,0,0,0,1|1,1,0]=4 3048 B12R1.49 NNC(=S)Nc1ccc(O)cc1 Amb2575284 [0,1,0,0,0,1|1,1,0]=4 3049 B12R1.49 NOC(=O)Nc1ccc(Cl)cc1 Amb27446553 [0,1,0,0,0,1|2,0,0]=4 3050 B12R1.49 O=C(Cc1ccc(Br)cc1)NO Amb6279987 [0,1,0,0,0,1|2,0,0]=4 3051 B12R1.49 O=C(Cc1ccc(Cl)cc1)NO Amb6269355 [0,1,0,0,0,1|2,0,0]=4 3052 B12R1.49 O=C(Cc1ccc(F)cc1)NO Amb6264203 [0,1,0,0,0,1|2,0,0]=4 3053 B12R1.49 O=C(NO)Nc1ccc(Cl)cc1 Amb4018015 [0,1,0,0,0,1|2,0,0]=4 3054 B12R1.49 O=C(NO)Nc1ccc(F)cc1 Amb27615400 [0,1,0,0,0,1|2,0,0]=4 3055 B12R1.49 O=C(NO)Oc1ccc(Cl)cc1 Amb27756205 [0,1,0,0,0,1|2,0,0]=4 3056 B12R1.50 C#CC(=O)Nc1ccnc(C)c1 Amb27484540 [0,1,0,0,0,1|2,0,0]=4 3057 B12R1.50 C#CC(=O)Nc1ccnc(N)c1 Amb35713239 [0,1,0,0,0,1|2,0,0]=4 3058 B12R1.50 C=CC(=O)Nc1ccnc(C)c1 Amb27597153 [0,1,0,0,0,1|2,0,0]=4 3059 B12R1.50 C=CC(=O)Nc1ccnc(N)c1 Amb35713240 [0,1,0,0,0,1|2,0,0]=4 3060 B12R1.50 CC(Cc1ccnc(N)c1)NN Amb27960285 [0,1,0,0,0,1|1,0,1]=4 3061 B12R1.50 CCC(=O)Nc1ccnc(Br)c1 Amb27795417 [0,1,0,0,0,1|2,0,0]=4 3062 B12R1.50 CCC(=O)Nc1ccnc(Cl)c1 Amb27175908 [0,1,0,0,0,1|2,0,0]=4 3063 B12R1.50 CCC(=O)Nc1ccnc(N)c1 Amb35713241 [0,1,0,0,0,1|2,0,0]=4 3064 B12R1.50 CNC(=O)Cc1cccc(N)c1 Amb8426826 [0,1,0,0,0,1|2,0,0]=4 3065 B12R1.50 CNC(=O)Cc1cccc(O)c1 Amb18788342 [0,1,0,0,0,1|2,0,0]=4 3066 B12R1.50 CNC(=O)Nc1cccc(Br)c1 Amb4016617 [0,1,0,0,0,1|2,0,0]=4 3067 B12R1.50 CNC(=O)Nc1cccc(C)c1 Amb4020805 [0,1,0,0,0,1|2,0,0]=4 3068 B12R1.50 CNC(=O)Nc1cccc(Cl)c1 Amb3099668 [0,1,0,0,0,1|2,0,0]=4 3069 B12R1.50 CNC(=O)Nc1cccc(F)c1 Amb22435126 [0,1,0,0,0,1|2,0,0]=4 3070 B12R1.50 CNC(=O)Nc1cccc(I)c1 Amb11258974 [0,1,0,0,0,1|2,0,0]=4 3071 B12R1.50 CNC(=O)Nc1cccc(N)c1 Amb33545775 [0,1,0,0,0,1|2,0,0]=4 3072 B12R1.50 CNC(=O)Nc1ccnc(C)c1 Amb28316275 [0,1,0,0,0,1|1,0,0]=3 3073 B12R1.50 CNC(=O)Nc1ccnc(C)n1 Amb28316276 [0,1,0,0,0,1|2,0,0]=4 3074 B12R1.50 CNC(=O)Nc1ccnc(N)c1 Amb35678014 [0,1,0,0,0,1|1,0,0]=3 3075 B12R1.50 CNC(=O)Oc1cccc(C)c1 Amb2732296 [0,1,0,0,0,1|2,0,0]=4 3076 B12R1.50 CNC(=O)Oc1cccc(Cl)c1 Amb24309165 [0,1,0,0,0,1|2,0,0]=4 3077 B12R1.50 CNC(=O)Oc1cccc(F)c1 Amb25674242 [0,1,0,0,0,1|2,0,0]=4 3078 B12R1.50 CNC(=O)Oc1cccc(N)c1 Amb27454823 [0,1,0,0,0,1|2,0,0]=4 3079 B12R1.50 CNC(=O)Oc1cccc(O)c1 Amb24063537 [0,1,0,0,0,1|2,0,0]=4 3080 B12R1.50 COC(=O)Cc1ccnc(Br)c1 Amb24483854 [0,1,0,0,0,1|2,0,0]=4 3081 B12R1.50 COC(=O)Cc1ccnc(C)c1 Amb23441228 [0,1,0,0,0,1|2,0,0]=4 3082 B12R1.50 COC(=O)Cc1ccnc(Cl)c1 Amb6308554 [0,1,0,0,0,1|2,0,0]=4 3083 B12R1.50 COC(=O)Cc1ccnc(F)c1 Amb25106259 [0,1,0,0,0,1|2,0,0]=4 3084 B12R1.50 COC(=O)Cc1ccnc(N)c1 Amb25299195 [0,1,0,0,0,1|2,0,0]=4 3085 B12R1.50 COC(=O)Nc1ccnc(N)c1 Amb35678016 [0,1,0,0,0,1|2,0,0]=4 3086 B12R1.50 Cc1cc(NC(=O)CN)ccn1 Amb5783163 [0,1,0,0,0,1|1,0,0]=3 3087 B12R1.50 Cc1cccc(CC(=O)CN)c1 Amb18829247 [0,1,0,0,0,1|2,0,0]=4 3088 B12R1.50 Cc1cccc(CC(=O)NN)c1 Amb10075484 [0,1,0,0,0,1|1,0,0]=3 3089 B12R1.50 Cc1cccc(NC(=O)CN)c1 Amb6336829 [0,1,0,0,0,1|2,0,0]=4 3090 B12R1.50 Cc1cccc(NC(=O)NN)n1 Amb35684760 [0,1,0,0,0,1|2,0,0]=4 3091 B12R1.50 Cc1cccc(NC(=S)NN)c1 Amb1637371 [0,1,0,0,0,1|1,1,0]=4 3092 B12R1.50 Cc1cccc(OC(=O)CN)c1 Amb17334635 [0,1,0,0,0,1|2,0,0]=4 3093 B12R1.50 Cc1cccc(OC(=O)CN)c1 Amb19115307 [0,1,0,0,0,1|2,0,0]=4 3094 B12R1.50 Cc1ccnc(NC(=O)NN)c1 Amb35611282 [0,1,0,0,0,1|2,0,0]=4 3095 B12R1.50 N=C(Cc1cccc(Br)c1)NN Amb32751320 [0,1,0,0,0,1|2,0,0]=4 3096 B12R1.50 NCC(=O)Cc1cccc(Br)c1 Amb18160371 [0,1,0,0,0,1|2,0,0]=4 3097 B12R1.50 NCC(=O)Cc1cccc(Br)c1 Amb28963316 [0,1,0,0,0,1|2,0,0]=4 3098 B12R1.50 NCC(=O)Cc1cccc(Cl)c1 Amb18823030 [0,1,0,0,0,1|2,0,0]=4 3099 B12R1.50 NCC(=O)Cc1cccc(F)c1 Amb18199528 [0,1,0,0,0,1|2,0,0]=4 3100 B12R1.50 NCC(=O)Cc1cccc(O)c1 Amb18251724 [0,1,0,0,0,1|2,0,0]=4 3101 B12R1.50 NCC(=O)Nc1cccc(Br)c1 Amb5783150 [0,1,0,0,0,1|2,0,0]=4 3102 B12R1.50 NCC(=O)Nc1cccc(Cl)c1 Amb15740916 [0,1,0,0,0,1|2,0,0]=4 3103 B12R1.50 NCC(=O)Nc1cccc(Cl)c1 Amb5783082 [0,1,0,0,0,1|2,0,0]=4 3104 B12R1.50 NCC(=O)Nc1cccc(F)c1 Amb5783149 [0,1,0,0,0,1|2,0,0]=4 3105 B12R1.50 NCC(=O)Nc1cccc(I)c1 Amb7755186 [0,1,0,0,0,1|2,0,0]=4 3106 B12R1.50 NCC(=O)Nc1ccnc(Br)c1 Amb28430342 [0,1,0,0,0,1|1,0,0]=3 3107 B12R1.50 NCC(=O)Oc1cccc(Br)c1 Amb17344447 [0,1,0,0,0,1|2,0,0]=4 3108 B12R1.50 NCC(=O)Oc1cccc(Cl)c1 Amb17335804 [0,1,0,0,0,1|2,0,0]=4 3109 B12R1.50 NCC(=O)Oc1cccc(F)c1 Amb17334753 [0,1,0,0,0,1|2,0,0]=4 3110 B12R1.50 NNC(=O)CC1=CC(=O)NC=N1 Amb28243933 [0,1,0,0,0,1|1,0,1]=4 3111 B12R1.50 NNC(=O)Cc1cccc(Br)c1 Amb26537227 [0,1,0,0,0,1|1,0,0]=3 3112 B12R1.50 NNC(=O)Cc1cccc(Cl)c1 Amb6545801 [0,1,0,0,0,1|1,0,0]=3 3113 B12R1.50 NNC(=O)Cc1cccc(F)c1 Amb6242176 [0,1,0,0,0,1|1,0,0]=3 3114 B12R1.50 NNC(=O)Cc1cccc(N)c1 Amb27478936 [0,1,0,0,0,1|1,0,0]=3 3115 B12R1.50 NNC(=O)Cc1cccc(O)c1 Amb18788433 [0,1,0,0,0,1|1,0,0]=3 3116 B12R1.50 NNC(=O)Nc1cccc(Br)c1 Amb8854082 [0,1,0,0,0,1|1,0,0]=3 3117 B12R1.50 NNC(=O)Nc1cccc(Cl)c1 Amb8854078 [0,1,0,0,0,1|1,0,0]=3 3118 B12R1.50 NNC(=O)Nc1cccc(I)c1 Amb9214790 [0,1,0,0,0,1|1,0,0]=3 3119 B12R1.50 NNC(=O)Nc1cncc(Cl)c1 Amb29857824 [0,1,0,0,0,1|2,0,0]=4 3120 B12R1.50 NNC(=O)Oc1cccc(O)c1 Amb27260470 [0,1,0,0,0,1|1,0,0]=3 3121 B12R1.50 NNC(=S)Nc1cccc(Br)c1 Amb446877 [0,1,0,0,0,1|1,1,0]=4 3122 B12R1.50 NNC(=S)Nc1cccc(Cl)c1 Amb1150068 [0,1,0,0,0,1|1,1,0]=4 3123 B12R1.50 NNC(=S)Nc1cccc(F)c1 Amb2688396 [0,1,0,0,0,1|1,1,0]=4 3124 B12R1.50 NNC(=S)Nc1cccc(I)c1 Amb7785502 [0,1,0,0,0,1|1,1,0]=4 3125 B12R1.50 NNC(=S)Nc1cccc(O)c1 Amb2469590 [0,1,0,0,0,1|1,1,0]=4 3126 B12R1.50 Nc1cccc(CC(=O)NO)c1 Amb27219898 [0,1,0,0,0,1|2,0,0]=4 3127 B12R1.50 O=C(CS)Nc1ccnc(Cl)c1 Amb28289641 [0,1,0,0,0,1|2,0,0]=4 3128 B12R1.50 O=C(Cc1cccc(F)c1)NO Amb6278242 [0,1,0,0,0,1|2,0,0]=4 3129 B12R1.50 O=C(Cc1cccc(I)c1)NO Amb28283419 [0,1,0,0,0,1|2,0,0]=4 3130 B12R1.50 O=C(NO)Nc1cccc(Cl)c1 Amb4001058 [0,1,0,0,0,1|2,0,0]=4 3131 B12R1.50 O=C(NO)Nc1cccc(F)c1 Amb27850565 [0,1,0,0,0,1|2,0,0]=4 3132 B12R1.118 CC\C(C=O)=C/c1ccncc1 Amb17334525 [0,1,0,0,0,1|2,0,0]=4 3133 B12R1.118 CS\C(=N\c1ccccc1)NN Amb27878880 [0,1,0,0,0,1|1,1,0]=4 3134 B12R1.118 C\N=C(/NN)Nc1ccccc1 Amb32712055 [0,1,0,0,0,1|2,0,0]=4 3135 B12R1.194 CNS(=O)(=O)Cc1ccncc1 Amb22301454 [0,1,0,0,0,1|2,0,0]=4 3136 B12R1.194 NNS(=O)(=O)Cc1ccccc1 Amb6249689 [0,1,0,0,0,1|2,0,0]=4 3137 B12R1.371 C#CC(=O)Nc1ccncc1C Amb27260155 [0,1,0,0,0,1|2,0,0]=4 3138 B12R1.371 C#CC(=O)Nc1ccncc1F Amb35702212 [0,1,0,0,0,1|2,0,0]=4 3139 B12R1.371 C=CC(=O)Nc1ccncc1F Amb27803592 [0,1,0,0,0,1|2,0,0]=4 3140 B12R1.371 CCC(=O)Cc1ccncc1Cl Amb27175735 [0,1,0,0,0,1|2,0,0]=4 3141 B12R1.371 CCC(=O)Nc1ccncc1Cl Amb27833580 [0,1,0,0,0,1|2,0,0]=4 3142 B12R1.371 CNC(=O)Cc1ccccc1Br Amb22001453 [0,1,0,0,0,1|2,0,0]=4 3143 B12R1.371 CNC(=O)Cc1ccccc1C Amb2106609 [0,1,0,0,0,1|2,0,0]=4 3144 B12R1.371 CNC(=O)Cc1ccccc1Cl Amb23014080 [0,1,0,0,0,1|2,0,0]=4 3145 B12R1.371 CNC(=O)Cc1ccccc1F Amb23014294 [0,1,0,0,0,1|2,0,0]=4 3146 B12R1.371 CNC(=O)Cc1ccccc1N Amb1114729 [0,1,0,0,0,1|2,0,0]=4 3147 B12R1.371 CNC(=O)Nc1ccccc1Br Amb11316867 [0,1,0,0,0,1|2,0,0]=4 3148 B12R1.371 CNC(=O)Nc1ccccc1Cl Amb4010921 [0,1,0,0,0,1|2,0,0]=4 3149 B12R1.371 CNC(=O)Nc1ccccc1F Amb2444100 [0,1,0,0,0,1|2,0,0]=4 3150 B12R1.371 CNC(=O)Nc1ccccc1I Amb14010753 [0,1,0,0,0,1|2,0,0]=4 3151 B12R1.371 CNC(=O)Oc1ccccc1O Amb18646674 [0,1,0,0,0,1|2,0,0]=4 3152 B12R1.371 COC(=O)Cc1ccncc1Br Amb22586456 [0,1,0,0,0,1|2,0,0]=4 3153 B12R1.371 COC(=O)Cc1ccncc1Cl Amb28251565 [0,1,0,0,0,1|2,0,0]=4 3154 B12R1.371 COC(=O)Cc1ccncc1N Amb22371407 [0,1,0,0,0,1|2,0,0]=4 3155 B12R1.371 COC(=O)Nc1ccncc1C Amb27260103 [0,1,0,0,0,1|2,0,0]=4 3156 B12R1.371 COC(=O)Nc1ccncc1F Amb27841855 [0,1,0,0,0,1|2,0,0]=4 3157 B12R1.371 COC(=O)Nc1ccncc1N Amb18967350 [0,1,0,0,0,1|2,0,0]=4 3158 B12R1.371 Cc1ccccc1CC(=O)CN Amb18829246 [0,1,0,0,0,1|2,0,0]=4 3159 B12R1.371 Cc1ccccc1CC(=O)NN Amb6249209 [0,1,0,0,0,1|1,0,0]=3 3160 B12R1.371 Cc1ccccc1CC(=O)NO Amb6257569 [0,1,0,0,0,1|2,0,0]=4 3161 B12R1.371 Cc1ccccc1NC(=O)CN Amb6336812 [0,1,0,0,0,1|2,0,0]=4 3162 B12R1.371 Cc1ccccc1NC(=O)NN Amb7969607 [0,1,0,0,0,1|1,0,0]=3 3163 B12R1.371 Cc1ccccc1NC(=O)NO Amb27614514 [0,1,0,0,0,1|2,0,0]=4 3164 B12R1.371 Cc1ccccc1NC(=S)NN Amb1634626 [0,1,0,0,0,1|1,1,0]=4 3165 B12R1.371 Cc1ccccc1OC(=O)CN Amb17334634 [0,1,0,0,0,1|2,0,0]=4 3166 B12R1.371 Cc1ccccc1OC(=O)CN Amb19115306 [0,1,0,0,0,1|2,0,0]=4 3167 B12R1.371 Cc1ccccc1OC(=O)NN Amb28369799 [0,1,0,0,0,1|1,0,0]=3 3168 B12R1.371 Cc1cccnc1CC(=O)NN Amb27956117 [0,1,0,0,0,1|2,0,0]=4 3169 B12R1.371 Cc1cnccc1NC(=O)CBr Amb27392834 [0,1,0,0,0,1|2,0,0]=4 3170 B12R1.371 Cc1cnccc1NC(=O)CCl Amb27831234 [0,1,0,0,0,1|2,0,0]=4 3171 B12R1.371 Cc1cnccc1NC(=O)CN Amb27791613 [0,1,0,0,0,1|1,0,0]=3 3172 B12R1.371 NCC(=O)Cc1ccccc1Br Amb25667280 [0,1,0,0,0,1|2,0,0]=4 3173 B12R1.371 NCC(=O)Cc1ccccc1Cl Amb31203815 [0,1,0,0,0,1|2,0,0]=4 3174 B12R1.371 NCC(=O)Cc1ccccc1F Amb18827239 [0,1,0,0,0,1|2,0,0]=4 3175 B12R1.371 NCC(=O)Cc1ccncc1Cl Amb28313586 [0,1,0,0,0,1|1,0,0]=3 3176 B12R1.371 NCC(=O)Nc1ccccc1Br Amb1105100 [0,1,0,0,0,1|2,0,0]=4 3177 B12R1.371 NCC(=O)Nc1ccccc1Br Amb2277974 [0,1,0,0,0,1|2,0,0]=4 3178 B12R1.371 NCC(=O)Nc1ccccc1Cl Amb15740955 [0,1,0,0,0,1|2,0,0]=4 3179 B12R1.371 NCC(=O)Nc1ccccc1Cl Amb6336820 [0,1,0,0,0,1|2,0,0]=4 3180 B12R1.371 NCC(=O)Nc1ccccc1F Amb5783081 [0,1,0,0,0,1|2,0,0]=4 3181 B12R1.371 NCC(=O)Nc1ccncc1Br Amb28254729 [0,1,0,0,0,1|1,0,0]=3 3182 B12R1.371 NCC(=O)Oc1ccccc1Br Amb17344446 [0,1,0,0,0,1|2,0,0]=4 3183 B12R1.371 NCC(=O)Oc1ccccc1Cl Amb17335803 [0,1,0,0,0,1|2,0,0]=4 3184 B12R1.371 NCC(=O)Oc1ccccc1F Amb17334752 [0,1,0,0,0,1|2,0,0]=4 3185 B12R1.371 NNC(=O)CN1C=CC=CC1=O Amb18028594 [0,1,0,0,0,1|2,0,0]=4 3186 B12R1.371 NNC(=O)Cc1ccccc1Br Amb22484618 [0,1,0,0,0,1|1,0,0]=3 3187 B12R1.371 NNC(=O)Cc1ccccc1Cl Amb6573008 [0,1,0,0,0,1|1,0,0]=3 3188 B12R1.371 NNC(=O)Cc1ccccc1F Amb1126168 [0,1,0,0,0,1|1,0,0]=3 3189 B12R1.371 NNC(=O)Cc1ccccc1O Amb32667213 [0,1,0,0,0,1|1,0,0]=3 3190 B12R1.371 NNC(=O)Cc1ccccc1O Amb3988948 [0,1,0,0,0,1|1,0,0]=3 3191 B12R1.371 NNC(=O)Cc1ncccc1Cl Amb27864324 [0,1,0,0,0,1|2,0,0]=4 3192 B12R1.371 NNC(=O)Nc1ccccc1Cl Amb3427773 [0,1,0,0,0,1|1,0,0]=3 3193 B12R1.371 NNC(=O)Nc1ccccc1O Amb6889257 [0,1,0,0,0,1|1,0,0]=3 3194 B12R1.371 NNC(=S)Nc1ccccc1Br Amb7771619 [0,1,0,0,0,1|1,1,0]=4 3195 B12R1.371 NNC(=S)Nc1ccccc1Cl Amb1149109 [0,1,0,0,0,1|1,1,0]=4 3196 B12R1.371 NNC(=S)Nc1ccccc1F Amb1150488 [0,1,0,0,0,1|1,1,0]=4 3197 B12R1.371 NNC(=S)Nc1ccccc1S Amb1766287 [0,1,0,0,0,1|1,1,0]=4 3198 B12R1.371 O=C(CBr)Nc1ccncc1F Amb27471694 [0,1,0,0,0,1|2,0,0]=4 3199 B12R1.371 O=C(CCl)Nc1ccncc1Br Amb7172738 [0,1,0,0,0,1|2,0,0]=4 3200 B12R1.371 O=C(CCl)Nc1ccncc1O Amb27955177 [0,1,0,0,0,1|2,0,0]=4 3201 B12R1.371 O=C(Cc1ccccc1Cl)NO Amb6273362 [0,1,0,0,0,1|2,0,0]=4 3202 B12R1.371 O=C(Cc1ccccc1I)NO Amb28184737 [0,1,0,0,0,1|2,0,0]=4 3203 B12R1.371 O=C(NO)Nc1ccccc1Cl Amb4013619 [0,1,0,0,0,1|2,0,0]=4 3204 B12R1.371 O=C(NO)Nc1ccccc1F Amb28040914 [0,1,0,0,0,1|2,0,0]=4 3205 B12R1.2197 CN(C)C(=O)C1=CC=C=NC=C1 Amb26631730 [0,1,0,0,0,1|1,0,0]=3 3206 B12R1.9 Cc1ccc(S(=O)(=O)NN)cc1 Amb2609961 [0,2,0,0,0,0|2,0,0]=4 3207 B12R1.9 NNS(=O)(=O)c1ccc(Br)cc1 Amb6465736 [0,2,0,0,0,0|2,0,0]=4 3208 B12R1.9 NNS(=O)(=O)c1ccc(Cl)cc1 Amb6468410 [0,2,0,0,0,0|2,0,0]=4 3209 B12R1.9 NNS(=O)(=O)c1ccc(F)cc1 Amb2727295 [0,2,0,0,0,0|2,0,0]=4 3210 B12R1.9 NNS(=O)(=O)c1ccc(I)cc1 Amb4014562 [0,2,0,0,0,0|2,0,0]=4 3211 B12R1.9 NNS(=O)(=O)c1ccc(N)cc1 Amb18649604 [0,2,0,0,0,0|2,0,0]=4 3212 B12R1.10 Cc1cccc(S(=O)(=O)NN)c1 Amb6248063 [0,2,0,0,0,0|2,0,0]=4 3213 B12R1.10 NNS(=O)(=O)c1cccc(Br)c1 Amb9207860 [0,2,0,0,0,0|2,0,0]=4 3214 B12R1.10 NNS(=O)(=O)c1cccc(Cl)c1 Amb9206649 [0,2,0,0,0,0|2,0,0]=4 3215 B12R1.10 NNS(=O)(=O)c1cccc(N)c1 Amb18649603 [0,2,0,0,0,0|2,0,0]=4 3216 B12R1.39 NCCS(=O)(=O)c1ccncc1 Amb27958811 [0,2,0,0,0,0|2,0,0]=4 3217 B12R1.39 NCNS(=O)(=O)c1ccccc1 Amb27442498 [0,2,0,0,0,0|2,0,0]=4 3218 B12R1.195 Cc1ccccc1S(=O)(=O)NN Amb4458297 [0,2,0,0,0,0|2,0,0]=4 3219 B12R1.195 NNS(=O)(=O)c1ccccc1Br Amb9207884 [0,2,0,0,0,0|2,0,0]=4 3220 B12R1.195 NNS(=O)(=O)c1ccccc1Cl Amb9207702 [0,2,0,0,0,0|2,0,0]=4 3221 B12R1.195 NNS(=O)(=O)c1ccccc1F Amb6245222 [0,2,0,0,0,0|2,0,0]=4 3222 B12R1.195 NNS(=O)(=O)c1ccccc1O Amb18649830 [0,2,0,0,0,0|2,0,0]=4 3223 B12R1.253 CN(N)S(=O)(=O)c1ccccc1 Amb27751651 [0,2,0,0,0,0|2,0,0]=4 3224 B12R1.3 CN\C(=C/C=O)c1ccccc1 Amb28458550 [0,2,0,0,0,0|2,0,0]=4 3225 B12R1.3 NNC\C(=C/F)c1ccccc1 Amb8391753 [0,2,0,0,0,0|2,0,0]=4 3226 B12R1.3 O=C\C(=C/NO)c1ccccc1 Amb17777667 [0,2,0,0,0,0|2,0,0]=4 3227 B12R1.13 C=CC(NN)c1ccnc(Cl)c1 Amb27882505 [0,2,0,0,0,0|1,0,1]=4 3228 B12R1.13 CCC(NN)c1ccnc(Cl)c1 Amb28314507 [0,2,0,0,0,0|1,0,1]=4 3229 B12R1.243 C#CC(NN)c1ccncc1Cl Amb27770777 [0,2,0,0,0,0|1,0,1]=4 3230 B12R1.243 C#CC(NN)c1ccncc1F Amb27951252 [0,2,0,0,0,0|1,0,1]=4 3231 B12R1.243 C=CC(NN)c1ccncc1F Amb27587661 [0,2,0,0,0,0|1,0,1]=4 3232 B12R1.243 CCC(NN)c1ccncc1C Amb28314497 [0,2,0,0,0,0|1,0,1]=4 3233 B12R1.243 CCC(NN)c1ccncc1F Amb27969714 [0,2,0,0,0,0|1,0,1]=4 3234 B12R1.243 CN\C(=N\N)c1ccncc1F Amb27857347 [0,2,0,0,0,0|1,0,1]=4 3235 B12R1.478 CC(=O)\C(=C/N)c1ccccc1 Amb17777807 [0,2,0,0,0,0|2,0,0]=4 3236 B12R1.478 CC(=O)\C(=C\N)c1ccccc1 Amb25238332 [0,2,0,0,0,0|2,0,0]=4 3237 B12R1.478 CNC(C(N)=O)c1ccncc1 Amb17334640 [0,2,0,0,0,0|1,0,1]=4 3238 B12R1.478 NCC(C(=O)O)c1ccncc1 Amb17400195 [0,2,0,0,0,0|1,0,1]=4 3239 B12R1.478 NNC(C(=O)O)c1ccccc1 Amb17400196 [0,2,0,0,0,0|1,0,1]=4 3240 B12R1.478 NNC(C(=O)O)c1ccncc1 Amb17400233 [0,2,0,0,0,0|0,0,1]=3 3241 B12R1.478 N\N=C(/C(=O)O)c1ccccc1 Amb24068345 [0,2,0,0,0,0|1,0,1]=4 3242 B12R1.478 N\N=C(\C(=O)O)c1ccccc1 Amb25701762 [0,2,0,0,0,0|1,0,1]=4 3243 B12R1.478 O=C(O)\C(=N\O)c1ccncc1 Amb28397194 [0,2,0,0,0,0|1,0,1]=4 3244 B12R1.16 CCNC(=O)c1cc[n+]([O-])cc1 Amb27804732 [0,2,0,0,0,0|1,0,1]=4 3245 B12R1.16 CCNC(=O)c1ccc(Br)cc1 Amb6264373 [0,2,0,0,0,0|2,0,0]=4 3246 B12R1.16 CCNC(=O)c1ccc(F)cc1 Amb17775265 [0,2,0,0,0,0|2,0,0]=4 3247 B12R1.16 CCNC(=O)c1ccc(I)cc1 Amb6436078 [0,2,0,0,0,0|2,0,0]=4 3248 B12R1.16 CCNC(=O)c1ccc(N)cc1 Amb6369720 [0,2,0,0,0,0|2,0,0]=4 3249 B12R1.16 CCNC(=O)c1ccc(O)cc1 Amb6671675 [0,2,0,0,0,0|2,0,0]=4 3250 B12R1.16 CNCC(=O)c1ccc(Br)cc1 Amb17248090 [0,2,0,0,0,0|2,0,0]=4 3251 B12R1.16 CNCC(=O)c1ccc(C)cc1 Amb17232427 [0,2,0,0,0,0|2,0,0]=4 3252 B12R1.16 CNCC(=O)c1ccc(Cl)cc1 Amb2777315 [0,2,0,0,0,0|2,0,0]=4 3253 B12R1.16 CNCC(=O)c1ccc(F)cc1 Amb17232631 [0,2,0,0,0,0|2,0,0]=4 3254 B12R1.16 CNCC(=O)c1ccc(F)cc1 Amb24121219 [0,2,0,0,0,0|2,0,0]=4 3255 B12R1.16 CNCC(=O)c1ccc(N)cc1 Amb18550919 [0,2,0,0,0,0|2,0,0]=4 3256 B12R1.16 CNCC(=O)c1ccc(O)cc1 Amb1075808 [0,2,0,0,0,0|2,0,0]=4 3257 B12R1.16 CNCC(=O)c1ccc(O)cc1 Amb6859390 [0,2,0,0,0,0|2,0,0]=4 3258 B12R1.16 CONC(=O)c1cc[n+]([O-])cc1 Amb28256662 [0,2,0,0,0,0|1,0,1]=4 3259 B12R1.16 CONC(=O)c1ccc(C)cc1 Amb16980459 [0,2,0,0,0,0|2,0,0]=4 3260 B12R1.16 CONC(=O)c1ccc(O)cc1 Amb25124655 [0,2,0,0,0,0|2,0,0]=4 3261 B12R1.16 Cc1ccc(C(=O)CCN)cc1 Amb17194471 [0,2,0,0,0,0|2,0,0]=4 3262 B12R1.16 Cc1ccc(C(=O)NCCl)cc1 Amb7807821 [0,2,0,0,0,0|2,0,0]=4 3263 B12R1.16 Cc1ccc(C(=O)NCO)cc1 Amb2793597 [0,2,0,0,0,0|2,0,0]=4 3264 B12R1.16 NCCC(=O)c1ccc(Br)cc1 Amb17195655 [0,2,0,0,0,0|2,0,0]=4 3265 B12R1.16 NCCC(=O)c1ccc(Cl)cc1 Amb17194559 [0,2,0,0,0,0|2,0,0]=4 3266 B12R1.16 NCCC(=O)c1ccc(F)cc1 Amb17108934 [0,2,0,0,0,0|2,0,0]=4 3267 B12R1.16 NCCC(=O)c1ccc(O)cc1 Amb27266111 [0,2,0,0,0,0|2,0,0]=4 3268 B12R1.16 NOCC(=O)c1ccc(F)cc1 Amb27398410 [0,2,0,0,0,0|2,0,0]=4 3269 B12R1.16 N\C=C\C(=O)c1ccc(Cl)cc1 Amb27614726 [0,2,0,0,0,0|2,0,0]=4 3270 B12R1.16 N\N=C\C(=O)c1ccc(Br)cc1 Amb9824987 [0,2,0,0,0,0|1,0,1]=4 3271 B12R1.16 N\N=C\C(=O)c1ccc(Cl)cc1 Amb9824986 [0,2,0,0,0,0|1,0,1]=4 3272 B12R1.16 O=C(NCCl)c1ccc(F)cc1 Amb7807822 [0,2,0,0,0,0|2,0,0]=4 3273 B12R1.16 O=C(NCO)c1ccc(Cl)cc1 Amb2793594 [0,2,0,0,0,0|2,0,0]=4 3274 B12R1.16 O=C(NCO)c1ccc(F)cc1 Amb2793598 [0,2,0,0,0,0|2,0,0]=4 3275 B12R1.16 O=CNC(=O)c1ccc(Br)cc1 Amb28251420 [0,2,0,0,0,0|2,0,0]=4 3276 B12R1.16 O=CNC(=O)c1ccc(Cl)cc1 Amb27849669 [0,2,0,0,0,0|2,0,0]=4 3277 B12R1.17 C#CCC(=O)c1ccnc(C)c1 Amb27217818 [0,2,0,0,0,0|2,0,0]=4 3278 B12R1.17 C=C(CCN)c1ccnc(C)c1 Amb32732809 [0,2,0,0,0,0|2,0,0]=4 3279 B12R1.17 C=CCC(=O)c1ccnc(Cl)c1 Amb27173935 [0,2,0,0,0,0|2,0,0]=4 3280 B12R1.17 CCCC(=O)c1ccnc(Cl)c1 Amb6301674 [0,2,0,0,0,0|2,0,0]=4 3281 B12R1.17 CCNC(=O)C1=CC(=O)NC=C1 Amb26024473 [0,2,0,0,0,0|1,0,1]=4 3282 B12R1.17 CCNC(=O)C1=CC=NC(=O)N1 Amb32419039 [0,2,0,0,0,0|2,0,0]=4 3283 B12R1.17 CCNC(=O)c1cc(C)ncn1 Amb27456278 [0,2,0,0,0,0|2,0,0]=4 3284 B12R1.17 CCNC(=O)c1cccc(Br)c1 Amb3367312 [0,2,0,0,0,0|2,0,0]=4 3285 B12R1.17 CCNC(=O)c1cccc(C)c1 Amb3361463 [0,2,0,0,0,0|2,0,0]=4 3286 B12R1.17 CCNC(=O)c1cccc(Cl)c1 Amb3357855 [0,2,0,0,0,0|2,0,0]=4 3287 B12R1.17 CCNC(=O)c1cccc(F)c1 Amb3373688 [0,2,0,0,0,0|2,0,0]=4 3288 B12R1.17 CCNC(=O)c1cccc(I)c1 Amb3888523 [0,2,0,0,0,0|2,0,0]=4 3289 B12R1.17 CCNC(=O)c1cccc(N)c1 Amb2193629 [0,2,0,0,0,0|2,0,0]=4 3290 B12R1.17 CCNC(=O)c1cccc(O)c1 Amb6671664 [0,2,0,0,0,0|2,0,0]=4 3291 B12R1.17 CCNC(=O)c1cccc(S)c1 Amb27784878 [0,2,0,0,0,0|2,0,0]=4 3292 B12R1.17 CCNC(=O)c1ccnc(Br)c1 Amb19959849 [0,2,0,0,0,0|1,0,0]=3 3293 B12R1.17 CCNC(=O)c1ccnc(C)c1 Amb27808423 [0,2,0,0,0,0|1,0,0]=3 3294 B12R1.17 CCNC(=O)c1ccnc(C)n1 Amb27853426 [0,2,0,0,0,0|2,0,0]=4 3295 B12R1.17 CCNC(=O)c1ccnc(Cl)c1 Amb6667939 [0,2,0,0,0,0|1,0,0]=3 3296 B12R1.17 CCNC(=O)c1ccnc(Cl)n1 Amb27662786 [0,2,0,0,0,0|2,0,0]=4 3297 B12R1.17 CCOC(=O)c1ccnc(Br)c1 Amb10600785 [0,2,0,0,0,0|2,0,0]=4 3298 B12R1.17 CCOC(=O)c1ccnc(C)c1 Amb19944347 [0,2,0,0,0,0|2,0,0]=4 3299 B12R1.17 CCOC(=O)c1ccnc(C)c1 Amb21856459 [0,2,0,0,0,0|2,0,0]=4 3300 B12R1.17 CCOC(=O)c1ccnc(Cl)c1 Amb6301684 [0,2,0,0,0,0|2,0,0]=4 3301 B12R1.17 CCOC(=O)c1ccnc(F)c1 Amb25034597 [0,2,0,0,0,0|2,0,0]=4 3302 B12R1.17 CCOC(=O)c1ccnc(N)c1 Amb2697293 [0,2,0,0,0,0|2,0,0]=4 3303 B12R1.17 CNCC(=O)c1cccc(Br)c1 Amb17315041 [0,2,0,0,0,0|2,0,0]=4 3304 B12R1.17 CNCC(=O)c1cccc(C)c1 Amb18862586 [0,2,0,0,0,0|2,0,0]=4 3305 B12R1.17 CNCC(=O)c1cccc(Cl)c1 Amb18863066 [0,2,0,0,0,0|2,0,0]=4 3306 B12R1.17 CNCC(=O)c1cccc(F)c1 Amb18862706 [0,2,0,0,0,0|2,0,0]=4 3307 B12R1.17 CNCC(=O)c1cccc(N)c1 Amb18051532 [0,2,0,0,0,0|2,0,0]=4 3308 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb16231895 [0,2,0,0,0,0|2,0,0]=4 3309 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb17619313 [0,2,0,0,0,0|2,0,0]=4 3310 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb18646278 [0,2,0,0,0,0|2,0,0]=4 3311 B12R1.17 CNCC(=O)c1ccnc(C)c1 Amb33268226 [0,2,0,0,0,0|1,0,0]=3 3312 B12R1.17 CNNC(=O)c1cccc(Cl)n1 Amb27465586 [0,2,0,0,0,0|2,0,0]=4 3313 B12R1.17 CNNC(=O)c1ccnc(Cl)n1 Amb27449669 [0,2,0,0,0,0|1,0,0]=3 3314 B12R1.17 CONC(=O)c1cccc(C)c1 Amb16980458 [0,2,0,0,0,0|2,0,0]=4 3315 B12R1.17 CONC(=O)c1cccc(Cl)c1 Amb16969942 [0,2,0,0,0,0|2,0,0]=4 3316 B12R1.17 CONC(=O)c1cccc(I)c1 Amb8283933 [0,2,0,0,0,0|2,0,0]=4 3317 B12R1.17 CONC(=O)c1cccc(N)c1 Amb27658442 [0,2,0,0,0,0|2,0,0]=4 3318 B12R1.17 Cc1cc(C(=O)CC#N)ccn1 Amb28253977 [0,2,0,0,0,0|1,0,1]=4 3319 B12R1.17 Cc1cc(C(=O)CC=O)ccn1 Amb24655807 [0,2,0,0,0,0|2,0,0]=4 3320 B12R1.17 Cc1cc(C(=O)CCN)ccn1 Amb33268545 [0,2,0,0,0,0|1,0,0]=3 3321 B12R1.17 Cc1cc(C(=O)\C=C\Cl)ccn1 Amb35628820 [0,2,0,0,0,0|2,0,0]=4 3322 B12R1.17 Cc1cccc(C(=O)CCN)c1 Amb24700399 [0,2,0,0,0,0|2,0,0]=4 3323 B12R1.17 Cc1cccc(C(=O)NC#N)c1 Amb27616988 [0,2,0,0,0,0|1,0,1]=4 3324 B12R1.17 Cc1cccc(C(=O)NCO)c1 Amb27616730 [0,2,0,0,0,0|2,0,0]=4 3325 B12R1.17 N#CCC(=O)c1ccnc(Cl)c1 Amb27842089 [0,2,0,0,0,0|1,0,1]=4 3326 B12R1.17 N#CNC(=O)c1cccc(Br)c1 Amb27489244 [0,2,0,0,0,0|1,0,1]=4 3327 B12R1.17 N#CNC(=O)c1cccc(I)c1 Amb27950822 [0,2,0,0,0,0|1,0,1]=4 3328 B12R1.17 N#CNC(=O)c1cccc(O)c1 Amb27656887 [0,2,0,0,0,0|1,0,1]=4 3329 B12R1.17 NCCC(=O)c1cccc(Br)c1 Amb18121501 [0,2,0,0,0,0|2,0,0]=4 3330 B12R1.17 NCCC(=O)c1cccc(Cl)c1 Amb26318502 [0,2,0,0,0,0|2,0,0]=4 3331 B12R1.17 NCCC(=O)c1cccc(F)c1 Amb27416316 [0,2,0,0,0,0|2,0,0]=4 3332 B12R1.17 NCCC(=O)c1cccc(O)c1 Amb27479943 [0,2,0,0,0,0|2,0,0]=4 3333 B12R1.17 N\C=C\C(=O)c1cccc(Cl)c1 Amb27190737 [0,2,0,0,0,0|2,0,0]=4 3334 B12R1.17 O=CCC(=O)c1ccnc(Cl)c1 Amb28189551 [0,2,0,0,0,0|2,0,0]=4 3335 B12R1.17 [N-]=[N+]=NC(=O)c1ccnc(Br)c1 Amb26855353 [0,2,0,0,0,0|0,0,2]=4 3336 B12R1.17 [N-]=[N+]=NC(=O)c1ccnc(Cl)c1 Amb24558695 [0,2,0,0,0,0|0,0,2]=4 3337 B12R1.30 C#CCNC(=O)c1ccccc1 Amb4406905 [0,2,0,0,0,0|2,0,0]=4 3338 B12R1.30 C#CCOC(=O)c1ccncc1 Amb27809226 [0,2,0,0,0,0|2,0,0]=4 3339 B12R1.30 C=CCNC(=O)c1ccccc1 Amb3098985 [0,2,0,0,0,0|2,0,0]=4 3340 B12R1.30 C=CCOC(=O)c1ccncc1 Amb22730922 [0,2,0,0,0,0|2,0,0]=4 3341 B12R1.30 CCCCC(=O)c1ccncc1 Amb10573758 [0,2,0,0,0,0|2,0,0]=4 3342 B12R1.30 CCCNC(=O)c1ccncn1 Amb27857474 [0,2,0,0,0,0|2,0,0]=4 3343 B12R1.30 CCONC(=O)c1ccccc1 Amb10572541 [0,2,0,0,0,0|2,0,0]=4 3344 B12R1.30 CCONC(=O)c1ccncc1 Amb27769987 [0,2,0,0,0,0|1,0,0]=3 3345 B12R1.30 CNCCC(=O)c1ccccc1 Amb11032366 [0,2,0,0,0,0|2,0,0]=4 3346 B12R1.30 CNCCC(=O)c1ccccc1 Amb8390832 [0,2,0,0,0,0|2,0,0]=4 3347 B12R1.30 CNCNC(=O)c1ccccc1 Amb27402677 [0,2,0,0,0,0|1,0,0]=3 3348 B12R1.30 CNC\C=C(/C)c1ccncc1 Amb31161606 [0,2,0,0,0,0|2,0,0]=4 3349 B12R1.30 CN\C=C/C(=O)c1ccccc1 Amb2386631 [0,2,0,0,0,0|2,0,0]=4 3350 B12R1.30 COCNC(=O)c1ccncc1 Amb28239521 [0,2,0,0,0,0|1,0,0]=3 3351 B12R1.30 CSCNC(=O)c1ccccc1 Amb28208358 [0,2,0,0,0,0|2,0,0]=4 3352 B12R1.30 C\C(=C/CCN)c1ccncc1 Amb31161609 [0,2,0,0,0,0|2,0,0]=4 3353 B12R1.30 C\C(=C\CNN)c1ccccc1 Amb28429635 [0,2,0,0,0,0|2,0,0]=4 3354 B12R1.30 C\C=C\NC(=O)c1ccccc1 Amb27800283 [0,2,0,0,0,0|2,0,0]=4 3355 B12R1.30 C\C=N/NC(=O)c1ccccc1 Amb24072878 [0,2,0,0,0,0|1,0,1]=4 3356 B12R1.30 C\C=N\NC(=O)c1ccccc1 Amb4431611 [0,2,0,0,0,0|1,0,1]=4 3357 B12R1.30 N#CCCC(=O)c1ccncc1 Amb9472177 [0,2,0,0,0,0|1,0,1]=4 3358 B12R1.30 N#CCNC(=O)c1ccccc1 Amb6346069 [0,2,0,0,0,0|1,0,1]=4 3359 B12R1.30 N#CCNC(=O)c1ccncc1 Amb18180002 [0,2,0,0,0,0|0,0,1]=3 3360 B12R1.30 N#CCNC(=O)c1ccnnc1 Amb27243399 [0,2,0,0,0,0|1,0,1]=4 3361 B12R1.30 N#CCOC(=O)c1ccncc1 Amb27406543 [0,2,0,0,0,0|1,0,1]=4 3362 B12R1.30 N=CNNC(=O)c1ccccc1 Amb27179869 [0,2,0,0,0,0|1,0,0]=3 3363 B12R1.30 NCCCC(=O)c1ccccc1 Amb18623671 [0,2,0,0,0,0|2,0,0]=4 3364 B12R1.30 NCCNC(=O)c1ccccc1 Amb302802 [0,2,0,0,0,0|1,0,0]=3 3365 B12R1.30 NCCNC(=O)c1ccccc1 Amb6662646 [0,2,0,0,0,0|1,0,0]=3 3366 B12R1.30 NCCNC(=O)c1ccccn1 Amb1124326 [0,2,0,0,0,0|2,0,0]=4 3367 B12R1.30 NCCNC(=O)c1ccccn1 Amb21953271 [0,2,0,0,0,0|2,0,0]=4 3368 B12R1.30 NCCNC(=O)c1cccnc1 Amb21953968 [0,2,0,0,0,0|2,0,0]=4 3369 B12R1.30 NCCNC(=O)c1cccnc1 Amb32410116 [0,2,0,0,0,0|2,0,0]=4 3370 B12R1.30 NCCNC(=O)c1cccnc1 Amb33543179 [0,2,0,0,0,0|2,0,0]=4 3371 B12R1.30 NCCNC(=O)c1ccncc1 Amb1136215 [0,2,0,0,0,0|0,0,0]=2 3372 B12R1.30 NCCNC(=O)c1ccncc1 Amb21955218 [0,2,0,0,0,0|0,0,0]=2 3373 B12R1.30 NCCNC(=O)c1ccncc1 Amb8468630 [0,2,0,0,0,0|0,0,0]=2 3374 B12R1.30 NCCOC(=O)c1ccccc1 Amb10807731 [0,2,0,0,0,0|2,0,0]=4 3375 B12R1.30 NCCSC(=O)c1ccccc1 Amb3987898 [0,2,0,0,0,0|2,0,0]=4 3376 B12R1.30 N\N=C\NC(=O)c1ccncc1 Amb26590765 [0,2,0,0,0,0|0,0,0]=2 3377 B12R1.30 O=C(NCCBr)c1ccnnc1 Amb28322461 [0,2,0,0,0,0|2,0,0]=4 3378 B12R1.30 O=C(NCCCl)c1ccccc1 Amb2414312 [0,2,0,0,0,0|2,0,0]=4 3379 B12R1.30 O=C(NCCCl)c1ccnnc1 Amb27249157 [0,2,0,0,0,0|2,0,0]=4 3380 B12R1.30 O=C(NCCI)c1ccccc1 Amb22753771 [0,2,0,0,0,0|2,0,0]=4 3381 B12R1.30 O=C(NCCO)c1ccccc1 Amb4318140 [0,2,0,0,0,0|2,0,0]=4 3382 B12R1.30 O=C(NCCO)c1ccncc1 Amb3939184 [0,2,0,0,0,0|1,0,0]=3 3383 B12R1.30 O=C(NCCS)c1ccccc1 Amb26616512 [0,2,0,0,0,0|2,0,0]=4 3384 B12R1.30 O=CCNC(=O)c1ccccc1 Amb17102065 [0,2,0,0,0,0|2,0,0]=4 3385 B12R1.30 O=CNCC(=O)c1ccccc1 Amb20075907 [0,2,0,0,0,0|2,0,0]=4 3386 B12R1.30 O=CNNC(=O)c1ccccc1 Amb27406610 [0,2,0,0,0,0|1,0,0]=3 3387 B12R1.107 C=C(C)CC(=O)c1ccncc1 Amb18563517 [0,2,0,0,0,0|2,0,0]=4 3388 B12R1.107 CC(=O)CC(=O)c1ccncc1 Amb9204940 [0,2,0,0,0,0|2,0,0]=4 3389 B12R1.107 CC(C)CC(=O)c1ccncc1 Amb17334579 [0,2,0,0,0,0|2,0,0]=4 3390 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb20668879 [0,2,0,0,0,0|2,0,0]=4 3391 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb22059727 [0,2,0,0,0,0|2,0,0]=4 3392 B12R1.107 CC(N)NC(=O)c1ccccc1 Amb27792210 [0,2,0,0,0,0|1,0,0]=3 3393 B12R1.107 CC(NC(=N)N)c1ccncc1 Amb18798328 [0,2,0,0,0,0|1,0,1]=4 3394 B12R1.107 CN(C)CC(=O)c1ccccc1 Amb22264767 [0,2,0,0,0,0|2,0,0]=4 3395 B12R1.107 CN(C)CC(=O)c1ccccc1 Amb9217331 [0,2,0,0,0,0|2,0,0]=4 3396 B12R1.107 CN(C)NC(=O)c1ccccc1 Amb10574824 [0,2,0,0,0,0|1,0,0]=3 3397 B12R1.107 CN(C)NC(=O)c1ccccn1 Amb28400620 [0,2,0,0,0,0|2,0,0]=4 3398 B12R1.107 CN(C)NC(=O)c1cccnc1 Amb26017998 [0,2,0,0,0,0|2,0,0]=4 3399 B12R1.107 C[C@H](NC(=N)N)c1ccncc1 Amb27416857 [0,2,0,0,0,0|1,0,1]=4 3400 B12R1.107 C\C(N)=C/C(=O)c1ccccc1 Amb27666841 [0,2,0,0,0,0|2,0,0]=4 3401 B12R1.107 C\C(N)=C\C(=O)c1ccccc1 Amb2386640 [0,2,0,0,0,0|2,0,0]=4 3402 B12R1.107 C\C(N)=C\C(=O)c1ccncc1 Amb26338235 [0,2,0,0,0,0|1,0,0]=3 3403 B12R1.107 N=C(N)CC(=O)c1ccccc1 Amb26371399 [0,2,0,0,0,0|2,0,0]=4 3404 B12R1.107 N=C(N)NC(=O)c1ccccc1 Amb25703047 [0,2,0,0,0,0|1,0,0]=3 3405 B12R1.107 N=C(N)NC(=O)c1ccncc1 Amb24184121 [0,2,0,0,0,0|0,0,0]=2 3406 B12R1.107 N=C(N)SC(=O)c1ccccc1 Amb21955775 [0,2,0,0,0,0|2,0,0]=4 3407 B12R1.107 N=C(N)SC(=O)c1ccccc1 Amb9901863 [0,2,0,0,0,0|2,0,0]=4 3408 B12R1.107 NC(=O)CC(=O)c1ccccc1 Amb2734576 [0,2,0,0,0,0|2,0,0]=4 3409 B12R1.107 NC(=O)NC(=O)c1ccccc1 Amb3989198 [0,2,0,0,0,0|1,0,0]=3 3410 B12R1.107 NC(=O)NC(=O)c1ccccn1 Amb27866159 [0,2,0,0,0,0|2,0,0]=4 3411 B12R1.107 NC(=O)\C=C(\O)c1ccncc1 Amb27165220 [0,2,0,0,0,0|1,0,1]=4 3412 B12R1.107 NC(=S)CC(=O)c1ccccc1 Amb26430207 [0,2,0,0,0,0|2,0,0]=4 3413 B12R1.107 NC(=S)NC(=O)c1ccccc1 Amb2684614 [0,2,0,0,0,0|1,0,0]=3 3414 B12R1.107 NC(N)=CC(=O)c1ccccc1 Amb25108111 [0,2,0,0,0,0|2,0,0]=4 3415 B12R1.308 C#CCC(=O)c1ccncc1C Amb27177822 [0,2,0,0,0,0|2,0,0]=4 3416 B12R1.308 C=C(CCN)c1ccncc1Br Amb33388673 [0,2,0,0,0,0|2,0,0]=4 3417 B12R1.308 C=C(CCN)c1ccncc1C Amb33426418 [0,2,0,0,0,0|2,0,0]=4 3418 B12R1.308 C=C(CCN)c1ccncc1Cl Amb33413791 [0,2,0,0,0,0|2,0,0]=4 3419 B12R1.308 C=C(CCN)c1ccncc1F Amb33316808 [0,2,0,0,0,0|2,0,0]=4 3420 B12R1.308 C=CCC(=O)c1ccncc1C Amb27494313 [0,2,0,0,0,0|2,0,0]=4 3421 B12R1.308 CCNC(=N)c1ccncc1C Amb28118370 [0,2,0,0,0,0|2,0,0]=4 3422 B12R1.308 CCNC(=O)c1ccccc1Br Amb3373826 [0,2,0,0,0,0|2,0,0]=4 3423 B12R1.308 CCNC(=O)c1ccccc1I Amb3709919 [0,2,0,0,0,0|2,0,0]=4 3424 B12R1.308 CCNC(=O)c1ccccc1N Amb1120573 [0,2,0,0,0,0|2,0,0]=4 3425 B12R1.308 CCNC(=O)c1ccccc1O Amb2137048 [0,2,0,0,0,0|2,0,0]=4 3426 B12R1.308 CCNC(=O)c1ccncc1I Amb28293912 [0,2,0,0,0,0|1,0,0]=3 3427 B12R1.308 CCNC(=O)c1ccncc1N Amb23571475 [0,2,0,0,0,0|1,0,0]=3 3428 B12R1.308 CCNC(=O)c1ncncc1Cl Amb28064744 [0,2,0,0,0,0|2,0,0]=4 3429 B12R1.308 CCOC(=O)c1ccncc1Br Amb10606115 [0,2,0,0,0,0|2,0,0]=4 3430 B12R1.308 CCOC(=O)c1ccncc1Cl Amb22730548 [0,2,0,0,0,0|2,0,0]=4 3431 B12R1.308 CCOC(=O)c1ccncc1F Amb13887029 [0,2,0,0,0,0|2,0,0]=4 3432 B12R1.308 CCOC(=O)c1ccncc1I Amb24350555 [0,2,0,0,0,0|2,0,0]=4 3433 B12R1.308 CCOC(=O)c1ccncc1N Amb2697350 [0,2,0,0,0,0|2,0,0]=4 3434 B12R1.308 CCOC(=O)c1ccncc1N Amb8388414 [0,2,0,0,0,0|2,0,0]=4 3435 B12R1.308 CCOC(=O)c1ccncc1O Amb8630472 [0,2,0,0,0,0|2,0,0]=4 3436 B12R1.308 CNCC(=O)c1ccccc1Br Amb18160384 [0,2,0,0,0,0|2,0,0]=4 3437 B12R1.308 CNCC(=O)c1ccccc1C Amb18862585 [0,2,0,0,0,0|2,0,0]=4 3438 B12R1.308 CNCC(=O)c1ccccc1Cl Amb18863065 [0,2,0,0,0,0|2,0,0]=4 3439 B12R1.308 CNCC(=O)c1ccccc1Cl Amb32679864 [0,2,0,0,0,0|2,0,0]=4 3440 B12R1.308 CNCC(=O)c1ccccc1F Amb18862705 [0,2,0,0,0,0|2,0,0]=4 3441 B12R1.308 CNCC(=O)c1ccccc1O Amb26392452 [0,2,0,0,0,0|2,0,0]=4 3442 B12R1.308 CNCC(=O)c1ccncc1Br Amb33388473 [0,2,0,0,0,0|1,0,0]=3 3443 B12R1.308 CNCC(=O)c1ccncc1C Amb33414506 [0,2,0,0,0,0|1,0,0]=3 3444 B12R1.308 CNCC(=O)c1ccncc1Cl Amb33413520 [0,2,0,0,0,0|1,0,0]=3 3445 B12R1.308 CNCC(=O)c1ccncc1F Amb25076936 [0,2,0,0,0,0|1,0,0]=3 3446 B12R1.308 CNNC(=O)c1ccccc1N Amb18646316 [0,2,0,0,0,0|1,0,0]=3 3447 B12R1.308 CNNC(=O)c1ccccc1O Amb25910765 [0,2,0,0,0,0|1,0,0]=3 3448 B12R1.308 CNOC(=O)c1ccccc1O Amb28381144 [0,2,0,0,0,0|2,0,0]=4 3449 B12R1.308 COCC(=O)c1ccncc1C Amb27656417 [0,2,0,0,0,0|2,0,0]=4 3450 B12R1.308 COCC(=O)c1ccncc1F Amb28133312 [0,2,0,0,0,0|2,0,0]=4 3451 B12R1.308 CONC(=O)c1ccccc1C Amb16969914 [0,2,0,0,0,0|2,0,0]=4 3452 B12R1.308 CONC(=O)c1ccccc1Cl Amb16980468 [0,2,0,0,0,0|2,0,0]=4 3453 B12R1.308 CONC(=O)c1ccccc1N Amb28119695 [0,2,0,0,0,0|2,0,0]=4 3454 B12R1.308 CONC(=O)c1ccccc1O Amb27668743 [0,2,0,0,0,0|2,0,0]=4 3455 B12R1.308 CONC(=O)c1ccncc1O Amb27475613 [0,2,0,0,0,0|1,0,0]=3 3456 B12R1.308 Cc1ccccc1C(=O)CCN Amb25062867 [0,2,0,0,0,0|2,0,0]=4 3457 B12R1.308 Cc1cnccc1C(=O)CCN Amb33415544 [0,2,0,0,0,0|1,0,0]=3 3458 B12R1.308 Cc1cnccc1C(=O)NC#N Amb28369309 [0,2,0,0,0,0|0,0,1]=3 3459 B12R1.308 Cc1cnccc1C(=O)\C=C\Cl Amb35628816 [0,2,0,0,0,0|2,0,0]=4 3460 B12R1.308 N#CNC(=O)c1ccccc1Cl Amb26937226 [0,2,0,0,0,0|1,0,1]=4 3461 B12R1.308 N#CNC(=O)c1ccccc1N Amb27848178 [0,2,0,0,0,0|1,0,1]=4 3462 B12R1.308 N#CNC(=O)c1ccncc1Br Amb27781885 [0,2,0,0,0,0|0,0,1]=3 3463 B12R1.308 N#CNC(=O)c1ccncc1O Amb27649416 [0,2,0,0,0,0|0,0,1]=3 3464 B12R1.308 NCCC(=O)c1ccccc1Br Amb33389465 [0,2,0,0,0,0|2,0,0]=4 3465 B12R1.308 NCCC(=O)c1ccccc1Cl Amb25709180 [0,2,0,0,0,0|2,0,0]=4 3466 B12R1.308 NCCC(=O)c1ccccc1Cl Amb32674762 [0,2,0,0,0,0|2,0,0]=4 3467 B12R1.308 NCCC(=O)c1ccccc1F Amb27881481 [0,2,0,0,0,0|2,0,0]=4 3468 B12R1.308 NCCC(=O)c1ccccc1N Amb21855941 [0,2,0,0,0,0|2,0,0]=4 3469 B12R1.308 NCCC(=O)c1ccccc1N Amb28555772 [0,2,0,0,0,0|2,0,0]=4 3470 B12R1.308 NCCC(=O)c1ccccc1N Amb32652605 [0,2,0,0,0,0|2,0,0]=4 3471 B12R1.308 NCCC(=O)c1ccccc1O Amb24346596 [0,2,0,0,0,0|2,0,0]=4 3472 B12R1.308 NCCC(=O)c1ccncc1Br Amb33388472 [0,2,0,0,0,0|1,0,0]=3 3473 B12R1.308 NCCC(=O)c1ccncc1Cl Amb33413510 [0,2,0,0,0,0|1,0,0]=3 3474 B12R1.308 NCCC(=O)c1ccncc1F Amb24550937 [0,2,0,0,0,0|1,0,0]=3 3475 B12R1.308 NCOC(=O)c1ccccc1O Amb28343097 [0,2,0,0,0,0|2,0,0]=4 3476 B12R1.308 Nc1cnccc1C(=O)CC=O Amb24460251 [0,2,0,0,0,0|2,0,0]=4 3477 B12R1.308 O=C(N=C=S)c1ccncc1Cl Amb28070222 [0,2,0,0,0,0|1,0,1]=4 3478 B12R1.308 O=C(NCCl)c1ccccc1Cl Amb7807833 [0,2,0,0,0,0|2,0,0]=4 3479 B12R1.308 O=C(NCCl)c1ccccc1F Amb7807832 [0,2,0,0,0,0|2,0,0]=4 3480 B12R1.308 O=C(NCO)c1ccccc1F Amb2793599 [0,2,0,0,0,0|2,0,0]=4 3481 B12R1.308 O=C(NCO)c1ccccc1O Amb6358947 [0,2,0,0,0,0|2,0,0]=4 3482 B12R1.308 O=C(\C=C\Cl)c1ccncc1Br Amb35628798 [0,2,0,0,0,0|2,0,0]=4 3483 B12R1.308 O=C(\C=C\Cl)c1ccncc1Cl Amb35628605 [0,2,0,0,0,0|2,0,0]=4 3484 B12R1.308 O=C(\C=C\Cl)c1ccncc1F Amb35628651 [0,2,0,0,0,0|2,0,0]=4 3485 B12R1.308 O=C(\C=C\Cl)c1ccncc1O Amb35628819 [0,2,0,0,0,0|2,0,0]=4 3486 B12R1.308 O=C=NC(=O)c1ccncc1Cl Amb27445350 [0,2,0,0,0,0|1,0,1]=4 3487 B12R1.308 O=C=NC(=O)c1ccncc1F Amb28290247 [0,2,0,0,0,0|1,0,1]=4 3488 B12R1.308 O=CCC(=O)c1ccncc1F Amb25149834 [0,2,0,0,0,0|2,0,0]=4 3489 B12R1.308 O=CNC(=O)c1ccccc1O Amb17621622 [0,2,0,0,0,0|2,0,0]=4 3490 B12R1.308 [N-]=[N+]=NC(=O)c1ccncc1Cl Amb28282219 [0,2,0,0,0,0|0,0,2]=4 3491 B12R1.308 [N-]=[N+]=NC(=O)c1ccncc1N Amb27793322 [0,2,0,0,0,0|0,0,2]=4 3492 B12R1.5 C#Cc1ccc(C(=O)CN)cc1 Amb32877951 [0,2,0,0,0,0|2,0,0]=4 3493 B12R1.5 C#Cc1ccc(C(=O)NC)cc1 Amb24091580 [0,2,0,0,0,0|2,0,0]=4 3494 B12R1.5 C=Cc1ccc(C(=O)NC)cc1 Amb24056361 [0,2,0,0,0,0|2,0,0]=4 3495 B12R1.5 CCc1ccc(C(=O)CN)cc1 Amb5739531 [0,2,0,0,0,0|2,0,0]=4 3496 B12R1.5 CCc1ccc(C(=O)NN)cc1 Amb1208582 [0,2,0,0,0,0|1,0,0]=3 3497 B12R1.5 CCc1ccc(C(=O)NN)cn1 Amb28208735 [0,2,0,0,0,0|2,0,0]=4 3498 B12R1.5 CCc1ccc(C(=O)NN)nc1 Amb24071328 [0,2,0,0,0,0|2,0,0]=4 3499 B12R1.5 CCc1ccc(C(=O)NO)cc1 Amb6257701 [0,2,0,0,0,0|2,0,0]=4 3500 B12R1.5 CNC(=O)c1ccc(C#N)cc1 Amb6663675 [0,2,0,0,0,0|2,0,0]=4 3501 B12R1.5 CNC(=O)c1ccc(C=O)cc1 Amb33532194 [0,2,0,0,0,0|2,0,0]=4 3502 B12R1.5 CNC(=O)c1ccc(CBr)cc1 Amb17326736 [0,2,0,0,0,0|2,0,0]=4 3503 B12R1.5 CNC(=O)c1ccc(CCl)cc1 Amb8846425 [0,2,0,0,0,0|2,0,0]=4 3504 B12R1.5 CNC(=O)c1ccc(CF)cc1 Amb25930871 [0,2,0,0,0,0|2,0,0]=4 3505 B12R1.5 CNC(=O)c1ccc(CN)cc1 Amb10609836 [0,2,0,0,0,0|2,0,0]=4 3506 B12R1.5 CNC(=O)c1ccc(CN)cc1 Amb1119850 [0,2,0,0,0,0|2,0,0]=4 3507 B12R1.5 CNC(=O)c1ccc(CO)cc1 Amb10608257 [0,2,0,0,0,0|2,0,0]=4 3508 B12R1.5 CNC(=O)c1ccc(CS)cc1 Amb32788775 [0,2,0,0,0,0|2,0,0]=4 3509 B12R1.5 CNC(=O)c1ccc(NN)cc1 Amb18800909 [0,2,0,0,0,0|2,0,0]=4 3510 B12R1.5 CNC(=O)c1ccc(NN)cc1 Amb33309534 [0,2,0,0,0,0|2,0,0]=4 3511 B12R1.5 CNC(=O)c1ccc(OC)cc1 Amb2613118 [0,2,0,0,0,0|2,0,0]=4 3512 B12R1.5 CNc1ccc(C(=O)CN)cc1 Amb28286953 [0,2,0,0,0,0|2,0,0]=4 3513 B12R1.5 CNc1ccc(C(=O)NN)cc1 Amb28365807 [0,2,0,0,0,0|1,0,0]=3 3514 B12R1.5 CNc1ccc(C(=O)NN)cn1 Amb27263071 [0,2,0,0,0,0|2,0,0]=4 3515 B12R1.5 COc1ccc(C(=O)CN)cc1 Amb1200635 [0,2,0,0,0,0|2,0,0]=4 3516 B12R1.5 COc1ccc(C(=O)CN)cc1 Amb20668082 [0,2,0,0,0,0|2,0,0]=4 3517 B12R1.5 COc1ccc(C(=O)CN)cc1 Amb2502479 [0,2,0,0,0,0|2,0,0]=4 3518 B12R1.5 COc1ccc(C(=O)NN)cc1 Amb6355882 [0,2,0,0,0,0|1,0,0]=3 3519 B12R1.5 COc1ccc(C(=O)NO)cc1 Amb1907124 [0,2,0,0,0,0|2,0,0]=4 3520 B12R1.5 COc1ccc(C(=O)ON)cc1 Amb10606698 [0,2,0,0,0,0|2,0,0]=4 3521 B12R1.5 COc1ccc(C(=O)ON)cc1 Amb27864427 [0,2,0,0,0,0|2,0,0]=4 3522 B12R1.5 CSc1ccc(C(=O)CN)cc1 Amb18893672 [0,2,0,0,0,0|2,0,0]=4 3523 B12R1.5 CSc1ccc(C(=O)CN)cc1 Amb29082935 [0,2,0,0,0,0|2,0,0]=4 3524 B12R1.5 CSc1ccc(C(=O)NN)cc1 Amb2689722 [0,2,0,0,0,0|1,0,0]=3 3525 B12R1.5 CSc1ccc(C(=O)NO)cc1 Amb27228633 [0,2,0,0,0,0|2,0,0]=4 3526 B12R1.5 CSc1ccc(C(=S)NN)cc1 Amb28067730 [0,2,0,0,0,0|1,1,0]=4 3527 B12R1.5 N#Cc1ccc(C(=O)CN)cc1 Amb18951216 [0,2,0,0,0,0|2,0,0]=4 3528 B12R1.5 N#Cc1ccc(C(=O)CN)cc1 Amb32644449 [0,2,0,0,0,0|2,0,0]=4 3529 B12R1.5 N#Cc1ccc(C(=O)NN)cc1 Amb26592497 [0,2,0,0,0,0|1,0,0]=3 3530 B12R1.5 N#Cc1ccc(C(=O)NN)cc1 Amb9173747 [0,2,0,0,0,0|1,0,0]=3 3531 B12R1.5 N#Cc1ccc(C(=O)NN)cn1 Amb27398569 [0,2,0,0,0,0|2,0,0]=4 3532 B12R1.5 N#[N+]c1ccc(C(=O)NN)cc1 Amb27173870 [0,2,0,0,0,0|1,0,0]=3 3533 B12R1.5 NCC(=O)c1ccc(CO)cc1 Amb27587421 [0,2,0,0,0,0|2,0,0]=4 3534 B12R1.5 NCc1ccc(C(=O)NN)cc1 Amb1104472 [0,2,0,0,0,0|1,0,0]=3 3535 B12R1.5 NCc1ccc(C(=O)NN)cc1 Amb33334622 [0,2,0,0,0,0|1,0,0]=3 3536 B12R1.5 NCc1ccc(C(=O)NO)cc1 Amb26840991 [0,2,0,0,0,0|2,0,0]=4 3537 B12R1.5 NCc1ccc(C(=O)NO)cc1 Amb28555752 [0,2,0,0,0,0|2,0,0]=4 3538 B12R1.5 NNC(=O)c1ccc(CO)cc1 Amb33309601 [0,2,0,0,0,0|1,0,0]=3 3539 B12R1.5 NNC(=O)c1ccc(CO)cc1 Amb8998356 [0,2,0,0,0,0|1,0,0]=3 3540 B12R1.5 NNC(=O)c1ccc(CS)cc1 Amb26558929 [0,2,0,0,0,0|1,0,0]=3 3541 B12R1.5 NNC(=O)c1ccc(NN)cc1 Amb1104499 [0,2,0,0,0,0|1,0,0]=3 3542 B12R1.5 NNC(=O)c1ccc(NN)nc1 Amb1209430 [0,2,0,0,0,0|2,0,0]=4 3543 B12R1.5 O=C(NO)c1ccc(CCl)cc1 Amb27983417 [0,2,0,0,0,0|2,0,0]=4 3544 B12R1.20 CC(N)C(=O)c1ccc(Br)cc1 Amb32757690 [0,2,0,0,0,0|2,0,0]=4 3545 B12R1.20 CC(N)C(=O)c1ccc(Br)cc1 Amb5739554 [0,2,0,0,0,0|2,0,0]=4 3546 B12R1.20 CC(N)C(=O)c1ccc(Cl)cc1 Amb31156686 [0,2,0,0,0,0|2,0,0]=4 3547 B12R1.20 CC(N)C(=O)c1ccc(Cl)cc1 Amb5739553 [0,2,0,0,0,0|2,0,0]=4 3548 B12R1.20 CC(N)C(=O)c1ccc(F)cc1 Amb5739552 [0,2,0,0,0,0|2,0,0]=4 3549 B12R1.20 CC(N)C(=O)c1ccc(N)cc1 Amb26632977 [0,2,0,0,0,0|2,0,0]=4 3550 B12R1.20 CC(N)C(=O)c1ccc(O)cc1 Amb18828423 [0,2,0,0,0,0|2,0,0]=4 3551 B12R1.20 CN(C)C(=O)c1ccc(Br)cc1 Amb3887429 [0,2,0,0,0,0|2,0,0]=4 3552 B12R1.20 CN(C)C(=O)c1ccc(Cl)cc1 Amb594241 [0,2,0,0,0,0|2,0,0]=4 3553 B12R1.20 CN(C)C(=O)c1ccc(F)cc1 Amb3886679 [0,2,0,0,0,0|2,0,0]=4 3554 B12R1.20 CN(C)C(=O)c1ccc(I)cc1 Amb6435915 [0,2,0,0,0,0|2,0,0]=4 3555 B12R1.20 CN(C)C(=O)c1ccc(N)cc1 Amb6352617 [0,2,0,0,0,0|2,0,0]=4 3556 B12R1.20 CN(C)C(=O)c1ccc(O)cc1 Amb1485384 [0,2,0,0,0,0|2,0,0]=4 3557 B12R1.20 CN(C)C(=O)c1ccc(S)cc1 Amb24386667 [0,2,0,0,0,0|2,0,0]=4 3558 B12R1.20 CN(N)C(=O)c1ccc(F)cc1 Amb10841043 [0,2,0,0,0,0|1,0,0]=3 3559 B12R1.20 CN(O)C(=O)c1ccc(Cl)cc1 Amb22441605 [0,2,0,0,0,0|2,0,0]=4 3560 B12R1.20 CN(O)C(=O)c1ccc(F)cc1 Amb27871773 [0,2,0,0,0,0|2,0,0]=4 3561 B12R1.20 C[C@@H](N)C(=O)c1ccc(Br)cc1 Amb35737912 [0,2,0,0,0,0|2,0,0]=4 3562 B12R1.20 C[C@@H](N)C(=O)c1ccc(Cl)cc1 Amb35738375 [0,2,0,0,0,0|2,0,0]=4 3563 B12R1.20 C[C@@H](N)C(=O)c1ccc(F)cc1 Amb35618031 [0,2,0,0,0,0|2,0,0]=4 3564 B12R1.20 C[C@H](N)C(=O)c1ccc(Br)cc1 Amb30024289 [0,2,0,0,0,0|2,0,0]=4 3565 B12R1.20 C[C@H](N)C(=O)c1ccc(Cl)cc1 Amb35588870 [0,2,0,0,0,0|2,0,0]=4 3566 B12R1.20 Cc1ccc(C(=O)C(C)N)cc1 Amb24081001 [0,2,0,0,0,0|2,0,0]=4 3567 B12R1.20 Cc1ccc(C(=O)C(C)N)cc1 Amb5739545 [0,2,0,0,0,0|2,0,0]=4 3568 B12R1.20 Cc1ccc(C(=O)C(N)=S)cc1 Amb28119832 [0,2,0,0,0,0|2,0,0]=4 3569 B12R1.20 Cc1ccc(C(=O)N(C)N)cc1 Amb27221068 [0,2,0,0,0,0|1,0,0]=3 3570 B12R1.20 NC(=O)C(=O)c1ccc(Cl)cc1 Amb26371609 [0,2,0,0,0,0|2,0,0]=4 3571 B12R1.367 CN1C=C(C(=O)NN)C=CC1=O Amb20031323 [0,2,0,0,0,0|2,0,0]=4 3572 B12R1.367 CN1C=CC(C(=O)NO)=CC1=O Amb27218312 [0,2,0,0,0,0|1,0,1]=4 3573 B12R1.367 CNC(=O)C1=CC(=O)N(C)C=C1 Amb27249597 [0,2,0,0,0,0|1,0,1]=4 3574 B12R1.367 CNC(=O)c1ccc(Br)c(Cl)c1 Amb25854074 [0,2,0,0,0,0|2,0,0]=4 3575 B12R1.367 CNC(=O)c1ccc(Br)c(F)c1 Amb11570869 [0,2,0,0,0,0|2,0,0]=4 3576 B12R1.367 CNC(=O)c1ccc(Br)c(N)c1 Amb17142519 [0,2,0,0,0,0|2,0,0]=4 3577 B12R1.367 CNC(=O)c1ccc(Br)c(O)c1 Amb27239792 [0,2,0,0,0,0|2,0,0]=4 3578 B12R1.367 CNC(=O)c1ccc(C)c(Br)c1 Amb25112263 [0,2,0,0,0,0|2,0,0]=4 3579 B12R1.367 CNC(=O)c1ccc(C)c(F)c1 Amb8331520 [0,2,0,0,0,0|2,0,0]=4 3580 B12R1.367 CNC(=O)c1ccc(C)c(I)c1 Amb20642290 [0,2,0,0,0,0|2,0,0]=4 3581 B12R1.367 CNC(=O)c1ccc(C)c(N)c1 Amb1114867 [0,2,0,0,0,0|2,0,0]=4 3582 B12R1.367 CNC(=O)c1ccc(Cl)c(Br)c1 Amb26583648 [0,2,0,0,0,0|2,0,0]=4 3583 B12R1.367 CNC(=O)c1ccc(Cl)c(C)c1 Amb28453622 [0,2,0,0,0,0|2,0,0]=4 3584 B12R1.367 CNC(=O)c1ccc(Cl)c(F)c1 Amb27398970 [0,2,0,0,0,0|2,0,0]=4 3585 B12R1.367 CNC(=O)c1ccc(Cl)c(N)c1 Amb1113061 [0,2,0,0,0,0|2,0,0]=4 3586 B12R1.367 CNC(=O)c1ccc(Cl)c(O)c1 Amb24379528 [0,2,0,0,0,0|2,0,0]=4 3587 B12R1.367 CNC(=O)c1ccc(F)c(Br)c1 Amb21856756 [0,2,0,0,0,0|2,0,0]=4 3588 B12R1.367 CNC(=O)c1ccc(F)c(C)c1 Amb27467406 [0,2,0,0,0,0|2,0,0]=4 3589 B12R1.367 CNC(=O)c1ccc(F)c(F)c1 Amb930992 [0,2,0,0,0,0|2,0,0]=4 3590 B12R1.367 CNC(=O)c1ccc(F)c(N)c1 Amb9295347 [0,2,0,0,0,0|2,0,0]=4 3591 B12R1.367 CNC(=O)c1ccc(F)c(O)c1 Amb26978100 [0,2,0,0,0,0|2,0,0]=4 3592 B12R1.367 CNC(=O)c1ccc(I)c(C)c1 Amb20642441 [0,2,0,0,0,0|2,0,0]=4 3593 B12R1.367 CNC(=O)c1ccc(I)c(F)c1 Amb20642584 [0,2,0,0,0,0|2,0,0]=4 3594 B12R1.367 CNC(=O)c1ccc(N)c(C)c1 Amb1113210 [0,2,0,0,0,0|2,0,0]=4 3595 B12R1.367 CNC(=O)c1ccc(N)c(C)c1 Amb17622089 [0,2,0,0,0,0|2,0,0]=4 3596 B12R1.367 CNC(=O)c1ccc(N)c(Cl)c1 Amb22059423 [0,2,0,0,0,0|2,0,0]=4 3597 B12R1.367 CNC(=O)c1ccc(N)c(F)c1 Amb18280407 [0,2,0,0,0,0|2,0,0]=4 3598 B12R1.367 CNC(=O)c1ccc(N)c(O)c1 Amb25739952 [0,2,0,0,0,0|2,0,0]=4 3599 B12R1.367 CNC(=O)c1ccc(O)c(I)c1 Amb27412429 [0,2,0,0,0,0|2,0,0]=4 3600 B12R1.367 CNC(=O)c1ccc(O)c(N)c1 Amb24725166 [0,2,0,0,0,0|2,0,0]=4 3601 B12R1.367 Cc1cc(C(=O)CN)ccc1Br Amb18227511 [0,2,0,0,0,0|2,0,0]=4 3602 B12R1.367 Cc1cc(C(=O)CN)ccc1Cl Amb18623705 [0,2,0,0,0,0|2,0,0]=4 3603 B12R1.367 Cc1cc(C(=O)CN)ccc1F Amb10606574 [0,2,0,0,0,0|2,0,0]=4 3604 B12R1.367 Cc1cc(C(=O)CN)ccc1F Amb5739538 [0,2,0,0,0,0|2,0,0]=4 3605 B12R1.367 Cc1cc(C(=O)CN)ccc1O Amb24532789 [0,2,0,0,0,0|2,0,0]=4 3606 B12R1.367 Cc1cc(C(=O)NN)ccc1Br Amb21959359 [0,2,0,0,0,0|1,0,0]=3 3607 B12R1.367 Cc1cc(C(=O)NN)ccc1Cl Amb10789224 [0,2,0,0,0,0|1,0,0]=3 3608 B12R1.367 Cc1cc(C(=O)NN)ccc1I Amb21959370 [0,2,0,0,0,0|1,0,0]=3 3609 B12R1.367 Cc1cc(C(=O)NN)ccc1O Amb27791672 [0,2,0,0,0,0|1,0,0]=3 3610 B12R1.367 Cc1cc(C(=O)NO)ccc1F Amb24369658 [0,2,0,0,0,0|2,0,0]=4 3611 B12R1.367 Cc1ccc(C(=O)CN)cc1Br Amb18866572 [0,2,0,0,0,0|2,0,0]=4 3612 B12R1.367 Cc1ccc(C(=O)CN)cc1Br Amb35789178 [0,2,0,0,0,0|2,0,0]=4 3613 B12R1.367 Cc1ccc(C(=O)CN)cc1C Amb22963507 [0,2,0,0,0,0|2,0,0]=4 3614 B12R1.367 Cc1ccc(C(=O)CN)cc1C Amb5739534 [0,2,0,0,0,0|2,0,0]=4 3615 B12R1.367 Cc1ccc(C(=O)CN)cc1Cl Amb18863070 [0,2,0,0,0,0|2,0,0]=4 3616 B12R1.367 Cc1ccc(C(=O)CN)cc1F Amb26983699 [0,2,0,0,0,0|2,0,0]=4 3617 B12R1.367 Cc1ccc(C(=O)CN)cc1O Amb24497405 [0,2,0,0,0,0|2,0,0]=4 3618 B12R1.367 Cc1ccc(C(=O)NN)cc1Br Amb6538557 [0,2,0,0,0,0|1,0,0]=3 3619 B12R1.367 Cc1ccc(C(=O)NN)cc1C Amb6559294 [0,2,0,0,0,0|1,0,0]=3 3620 B12R1.367 Cc1ccc(C(=O)NN)cc1Cl Amb4335682 [0,2,0,0,0,0|1,0,0]=3 3621 B12R1.367 Cc1ccc(C(=O)NN)cc1F Amb1126365 [0,2,0,0,0,0|1,0,0]=3 3622 B12R1.367 Cc1ccc(C(=O)NN)cc1F Amb33292433 [0,2,0,0,0,0|1,0,0]=3 3623 B12R1.367 Cc1ccc(C(=O)NN)cc1I Amb23491840 [0,2,0,0,0,0|1,0,0]=3 3624 B12R1.367 Cc1ccc(C(=O)NN)cc1N Amb6384247 [0,2,0,0,0,0|1,0,0]=3 3625 B12R1.367 Cc1ccc(C(=O)NN)cc1O Amb1124189 [0,2,0,0,0,0|1,0,0]=3 3626 B12R1.367 Cc1ccc(C(=O)NN)nc1Br Amb22495272 [0,2,0,0,0,0|2,0,0]=4 3627 B12R1.367 Cc1ccc(C(=O)NO)cc1C Amb6272713 [0,2,0,0,0,0|2,0,0]=4 3628 B12R1.367 Cc1ccc(C(=O)NO)cc1Cl Amb23551857 [0,2,0,0,0,0|2,0,0]=4 3629 B12R1.367 Cc1ccc(C(=O)NO)cc1N Amb28342921 [0,2,0,0,0,0|2,0,0]=4 3630 B12R1.367 Cc1ccc(C(=O)NO)cc1O Amb6267652 [0,2,0,0,0,0|2,0,0]=4 3631 B12R1.367 Cc1cnc(C(=O)NN)cc1Br Amb22495276 [0,2,0,0,0,0|2,0,0]=4 3632 B12R1.367 Cc1ncc(C(=O)NN)cc1Cl Amb28324731 [0,2,0,0,0,0|2,0,0]=4 3633 B12R1.367 N=C(NN)c1ccc(Cl)c(Cl)c1 Amb19374802 [0,2,0,0,0,0|2,0,0]=4 3634 B12R1.367 NCC(=O)c1ccc(Br)c(Cl)c1 Amb26021974 [0,2,0,0,0,0|2,0,0]=4 3635 B12R1.367 NCC(=O)c1ccc(Br)c(F)c1 Amb21964202 [0,2,0,0,0,0|2,0,0]=4 3636 B12R1.367 NCC(=O)c1ccc(Br)c(F)c1 Amb25314969 [0,2,0,0,0,0|2,0,0]=4 3637 B12R1.367 NCC(=O)c1ccc(Br)c(N)c1 Amb27636195 [0,2,0,0,0,0|2,0,0]=4 3638 B12R1.367 NCC(=O)c1ccc(Br)c(O)c1 Amb27466199 [0,2,0,0,0,0|2,0,0]=4 3639 B12R1.367 NCC(=O)c1ccc(Cl)c(Br)c1 Amb27143825 [0,2,0,0,0,0|2,0,0]=4 3640 B12R1.367 NCC(=O)c1ccc(Cl)c(Cl)c1 Amb4164414 [0,2,0,0,0,0|2,0,0]=4 3641 B12R1.367 NCC(=O)c1ccc(Cl)c(Cl)c1 Amb5739544 [0,2,0,0,0,0|2,0,0]=4 3642 B12R1.367 NCC(=O)c1ccc(Cl)c(F)c1 Amb18821289 [0,2,0,0,0,0|2,0,0]=4 3643 B12R1.367 NCC(=O)c1ccc(Cl)c(O)c1 Amb27450732 [0,2,0,0,0,0|2,0,0]=4 3644 B12R1.367 NCC(=O)c1ccc(F)c(Br)c1 Amb18287824 [0,2,0,0,0,0|2,0,0]=4 3645 B12R1.367 NCC(=O)c1ccc(F)c(Cl)c1 Amb18951214 [0,2,0,0,0,0|2,0,0]=4 3646 B12R1.367 NCC(=O)c1ccc(F)c(F)c1 Amb10840242 [0,2,0,0,0,0|2,0,0]=4 3647 B12R1.367 NCC(=O)c1ccc(F)c(F)c1 Amb17194484 [0,2,0,0,0,0|2,0,0]=4 3648 B12R1.367 NCC(=O)c1ccc(F)c(O)c1 Amb24497555 [0,2,0,0,0,0|2,0,0]=4 3649 B12R1.367 NCC(=O)c1ccc(I)c(Br)c1 Amb27447297 [0,2,0,0,0,0|2,0,0]=4 3650 B12R1.367 NCC(=O)c1ccc(O)c(Br)c1 Amb26376222 [0,2,0,0,0,0|2,0,0]=4 3651 B12R1.367 NCC(=O)c1ccc(O)c(Cl)c1 Amb25123985 [0,2,0,0,0,0|2,0,0]=4 3652 B12R1.367 NCC(=O)c1ccc(O)c(F)c1 Amb25801020 [0,2,0,0,0,0|2,0,0]=4 3653 B12R1.367 NCC(=O)c1ccc(O)c(O)c1 Amb17594163 [0,2,0,0,0,0|2,0,0]=4 3654 B12R1.367 NNC(=O)C1=CNC(=O)C(Cl)=C1 Amb28247897 [0,2,0,0,0,0|2,0,0]=4 3655 B12R1.367 NNC(=O)c1cc(O)c(O)cn1 Amb25772430 [0,2,0,0,0,0|2,0,0]=4 3656 B12R1.367 NNC(=O)c1ccc(Br)c(Cl)c1 Amb2684992 [0,2,0,0,0,0|1,0,0]=3 3657 B12R1.367 NNC(=O)c1ccc(Br)c(F)c1 Amb24710929 [0,2,0,0,0,0|1,0,0]=3 3658 B12R1.367 NNC(=O)c1ccc(Br)c(I)c1 Amb27242745 [0,2,0,0,0,0|1,0,0]=3 3659 B12R1.367 NNC(=O)c1ccc(Br)c(O)c1 Amb27950412 [0,2,0,0,0,0|1,0,0]=3 3660 B12R1.367 NNC(=O)c1ccc(Cl)c(Br)c1 Amb2684990 [0,2,0,0,0,0|1,0,0]=3 3661 B12R1.367 NNC(=O)c1ccc(Cl)c(Cl)c1 Amb1137206 [0,2,0,0,0,0|1,0,0]=3 3662 B12R1.367 NNC(=O)c1ccc(Cl)c(F)c1 Amb21988068 [0,2,0,0,0,0|1,0,0]=3 3663 B12R1.367 NNC(=O)c1ccc(Cl)c(I)c1 Amb21959363 [0,2,0,0,0,0|1,0,0]=3 3664 B12R1.367 NNC(=O)c1ccc(Cl)c(N)c1 Amb27669545 [0,2,0,0,0,0|1,0,0]=3 3665 B12R1.367 NNC(=O)c1ccc(Cl)c(O)c1 Amb27168718 [0,2,0,0,0,0|1,0,0]=3 3666 B12R1.367 NNC(=O)c1ccc(F)c(Br)c1 Amb27876528 [0,2,0,0,0,0|1,0,0]=3 3667 B12R1.367 NNC(=O)c1ccc(F)c(Cl)c1 Amb22737816 [0,2,0,0,0,0|1,0,0]=3 3668 B12R1.367 NNC(=O)c1ccc(F)c(F)c1 Amb2687072 [0,2,0,0,0,0|1,0,0]=3 3669 B12R1.367 NNC(=O)c1ccc(I)c(O)c1 Amb27947830 [0,2,0,0,0,0|1,0,0]=3 3670 B12R1.367 NNC(=O)c1ccc(N)c(I)c1 Amb27409965 [0,2,0,0,0,0|1,0,0]=3 3671 B12R1.367 NNC(=O)c1ccc(N)c(N)c1 Amb9173758 [0,2,0,0,0,0|1,0,0]=3 3672 B12R1.367 NNC(=O)c1ccc(O)c(Cl)c1 Amb6247968 [0,2,0,0,0,0|1,0,0]=3 3673 B12R1.367 NNC(=O)c1ccc(O)c(I)c1 Amb26868987 [0,2,0,0,0,0|1,0,0]=3 3674 B12R1.367 NNC(=O)c1ccc(O)c(O)c1 Amb2687305 [0,2,0,0,0,0|1,0,0]=3 3675 B12R1.367 NNC(=O)c1ccc(S)c(Br)c1 Amb27869206 [0,2,0,0,0,0|1,0,0]=3 3676 B12R1.367 NNC(=O)c1cnc(Cl)c(N)c1 Amb28249704 [0,2,0,0,0,0|2,0,0]=4 3677 B12R1.367 Nc1cc(C(=O)NO)ccc1Cl Amb27407469 [0,2,0,0,0,0|2,0,0]=4 3678 B12R1.367 Nc1ccc(C(=O)NO)cc1Cl Amb27952703 [0,2,0,0,0,0|2,0,0]=4 3679 B12R1.367 O=C(NO)c1ccc(Br)c(Cl)c1 Amb27615411 [0,2,0,0,0,0|2,0,0]=4 3680 B12R1.367 O=C(NO)c1ccc(Br)c(F)c1 Amb27875679 [0,2,0,0,0,0|2,0,0]=4 3681 B12R1.367 O=C(NO)c1ccc(Cl)c(Cl)c1 Amb6259484 [0,2,0,0,0,0|2,0,0]=4 3682 B12R1.367 O=C(NO)c1ccc(F)c(F)c1 Amb6276803 [0,2,0,0,0,0|2,0,0]=4 3683 B12R1.367 O=C(NO)c1ccc(I)c(Br)c1 Amb27977375 [0,2,0,0,0,0|2,0,0]=4 3684 B12R1.367 O=C(NO)c1ccc(O)c(F)c1 Amb27163822 [0,2,0,0,0,0|2,0,0]=4 3685 B12R1.367 O=C(NO)c1ccc(O)c(O)c1 Amb27216660 [0,2,0,0,0,0|2,0,0]=4 3686 B12R1.1703 CC1=CC=C(C(=O)NN)C(=O)N1 Amb18262522 [0,2,0,0,0,0|2,0,0]=4 3687 B12R1.1703 CNC(=O)c1ccc(Br)cc1C Amb33545177 [0,2,0,0,0,0|2,0,0]=4 3688 B12R1.1703 CNC(=O)c1ccc(Br)cc1Cl Amb22001372 [0,2,0,0,0,0|2,0,0]=4 3689 B12R1.1703 CNC(=O)c1ccc(Br)cc1F Amb6261766 [0,2,0,0,0,0|2,0,0]=4 3690 B12R1.1703 CNC(=O)c1ccc(Br)cc1O Amb11584904 [0,2,0,0,0,0|2,0,0]=4 3691 B12R1.1703 CNC(=O)c1ccc(Br)cc1S Amb28349932 [0,2,0,0,0,0|2,0,0]=4 3692 B12R1.1703 CNC(=O)c1ccc(C)cc1Br Amb27752500 [0,2,0,0,0,0|2,0,0]=4 3693 B12R1.1703 CNC(=O)c1ccc(C)cc1F Amb26571103 [0,2,0,0,0,0|2,0,0]=4 3694 B12R1.1703 CNC(=O)c1ccc(C)cc1N Amb27231384 [0,2,0,0,0,0|2,0,0]=4 3695 B12R1.1703 CNC(=O)c1ccc(C)cc1O Amb6671649 [0,2,0,0,0,0|2,0,0]=4 3696 B12R1.1703 CNC(=O)c1ccc(Cl)cc1Br Amb26882756 [0,2,0,0,0,0|2,0,0]=4 3697 B12R1.1703 CNC(=O)c1ccc(Cl)cc1Cl Amb3887079 [0,2,0,0,0,0|2,0,0]=4 3698 B12R1.1703 CNC(=O)c1ccc(Cl)cc1F Amb19557750 [0,2,0,0,0,0|2,0,0]=4 3699 B12R1.1703 CNC(=O)c1ccc(Cl)cc1N Amb1115130 [0,2,0,0,0,0|2,0,0]=4 3700 B12R1.1703 CNC(=O)c1ccc(Cl)cc1O Amb6671644 [0,2,0,0,0,0|2,0,0]=4 3701 B12R1.1703 CNC(=O)c1ccc(F)cc1Br Amb165974 [0,2,0,0,0,0|2,0,0]=4 3702 B12R1.1703 CNC(=O)c1ccc(F)cc1F Amb931353 [0,2,0,0,0,0|2,0,0]=4 3703 B12R1.1703 CNC(=O)c1ccc(F)cc1I Amb27247068 [0,2,0,0,0,0|2,0,0]=4 3704 B12R1.1703 CNC(=O)c1ccc(I)cc1Cl Amb20642289 [0,2,0,0,0,0|2,0,0]=4 3705 B12R1.1703 CNC(=O)c1ccc(I)cc1F Amb24385296 [0,2,0,0,0,0|2,0,0]=4 3706 B12R1.1703 CNC(=O)c1ccc(N)cc1C Amb18279466 [0,2,0,0,0,0|2,0,0]=4 3707 B12R1.1703 CNC(=O)c1ccc(N)cc1Cl Amb1117480 [0,2,0,0,0,0|2,0,0]=4 3708 B12R1.1703 CNC(=O)c1ccc(N)cc1F Amb18946078 [0,2,0,0,0,0|2,0,0]=4 3709 B12R1.1703 CNC(=O)c1ccc(N)cc1N Amb18278477 [0,2,0,0,0,0|2,0,0]=4 3710 B12R1.1703 CNC(=O)c1ccc(N)cc1O Amb27169601 [0,2,0,0,0,0|2,0,0]=4 3711 B12R1.1703 CNC(=O)c1ccc(O)cc1C Amb25999661 [0,2,0,0,0,0|2,0,0]=4 3712 B12R1.1703 CNC(=O)c1ccc(O)cc1Cl Amb24484165 [0,2,0,0,0,0|2,0,0]=4 3713 B12R1.1703 CNC(=O)c1ccc(O)cc1F Amb25119384 [0,2,0,0,0,0|2,0,0]=4 3714 B12R1.1703 CNC(=O)c1ccc(O)cc1I Amb28129771 [0,2,0,0,0,0|2,0,0]=4 3715 B12R1.1703 Cc1cc(Br)ccc1C(=O)CN Amb18227524 [0,2,0,0,0,0|2,0,0]=4 3716 B12R1.1703 Cc1cc(Br)ccc1C(=O)NN Amb9494269 [0,2,0,0,0,0|1,0,0]=3 3717 B12R1.1703 Cc1cc(Cl)ccc1C(=O)CN Amb18863069 [0,2,0,0,0,0|2,0,0]=4 3718 B12R1.1703 Cc1cc(Cl)ccc1C(=O)NN Amb10789223 [0,2,0,0,0,0|1,0,0]=3 3719 B12R1.1703 Cc1cc(F)ccc1C(=O)CN Amb25315959 [0,2,0,0,0,0|2,0,0]=4 3720 B12R1.1703 Cc1ccc(C(=O)CN)c(Br)c1 Amb26494546 [0,2,0,0,0,0|2,0,0]=4 3721 B12R1.1703 Cc1ccc(C(=O)CN)c(C)c1 Amb17194472 [0,2,0,0,0,0|2,0,0]=4 3722 B12R1.1703 Cc1ccc(C(=O)CN)c(Cl)c1 Amb24732404 [0,2,0,0,0,0|2,0,0]=4 3723 B12R1.1703 Cc1ccc(C(=O)CN)c(F)c1 Amb25225075 [0,2,0,0,0,0|2,0,0]=4 3724 B12R1.1703 Cc1ccc(C(=O)CN)c(O)c1 Amb27242644 [0,2,0,0,0,0|2,0,0]=4 3725 B12R1.1703 Cc1ccc(C(=O)NN)c(C)c1 Amb1215289 [0,2,0,0,0,0|1,0,0]=3 3726 B12R1.1703 Cc1ccc(C(=O)NN)c(C)n1 Amb18792645 [0,2,0,0,0,0|2,0,0]=4 3727 B12R1.1703 Cc1ccc(C(=O)NN)c(Cl)c1 Amb1891956 [0,2,0,0,0,0|1,0,0]=3 3728 B12R1.1703 Cc1ccc(C(=O)NN)c(O)c1 Amb6278765 [0,2,0,0,0,0|1,0,0]=3 3729 B12R1.1703 Cc1ccc(C(=O)NO)c(C)c1 Amb6261486 [0,2,0,0,0,0|2,0,0]=4 3730 B12R1.1703 Cc1ccc(C(=O)NO)c(O)c1 Amb6274066 [0,2,0,0,0,0|2,0,0]=4 3731 B12R1.1703 NCC(=O)c1ccc(Br)cc1Cl Amb26879882 [0,2,0,0,0,0|2,0,0]=4 3732 B12R1.1703 NCC(=O)c1ccc(Br)cc1F Amb27770187 [0,2,0,0,0,0|2,0,0]=4 3733 B12R1.1703 NCC(=O)c1ccc(Br)cc1O Amb25351014 [0,2,0,0,0,0|2,0,0]=4 3734 B12R1.1703 NCC(=O)c1ccc(Cl)cc1Br Amb25699573 [0,2,0,0,0,0|2,0,0]=4 3735 B12R1.1703 NCC(=O)c1ccc(Cl)cc1Cl Amb2693530 [0,2,0,0,0,0|2,0,0]=4 3736 B12R1.1703 NCC(=O)c1ccc(Cl)cc1Cl Amb8383854 [0,2,0,0,0,0|2,0,0]=4 3737 B12R1.1703 NCC(=O)c1ccc(Cl)cc1F Amb25751391 [0,2,0,0,0,0|2,0,0]=4 3738 B12R1.1703 NCC(=O)c1ccc(Cl)cc1F Amb28653046 [0,2,0,0,0,0|2,0,0]=4 3739 B12R1.1703 NCC(=O)c1ccc(Cl)cc1O Amb27971279 [0,2,0,0,0,0|2,0,0]=4 3740 B12R1.1703 NCC(=O)c1ccc(F)cc1Br Amb25685767 [0,2,0,0,0,0|2,0,0]=4 3741 B12R1.1703 NCC(=O)c1ccc(F)cc1Cl Amb27409681 [0,2,0,0,0,0|2,0,0]=4 3742 B12R1.1703 NCC(=O)c1ccc(F)cc1Cl Amb30584928 [0,2,0,0,0,0|2,0,0]=4 3743 B12R1.1703 NCC(=O)c1ccc(F)cc1F Amb6296500 [0,2,0,0,0,0|2,0,0]=4 3744 B12R1.1703 NCC(=O)c1ccc(F)cc1F Amb6296558 [0,2,0,0,0,0|2,0,0]=4 3745 B12R1.1703 NCC(=O)c1ccc(N)cc1O Amb27423925 [0,2,0,0,0,0|2,0,0]=4 3746 B12R1.1703 NCC(=O)c1ccc(O)cc1Cl Amb27953752 [0,2,0,0,0,0|2,0,0]=4 3747 B12R1.1703 NCC(=O)c1ccc(O)cc1Cl Amb32679370 [0,2,0,0,0,0|2,0,0]=4 3748 B12R1.1703 NCC(=O)c1ccc(O)cc1F Amb24704452 [0,2,0,0,0,0|2,0,0]=4 3749 B12R1.1703 NCC(=O)c1ccc(O)cc1O Amb27592161 [0,2,0,0,0,0|2,0,0]=4 3750 B12R1.1703 NNC(=O)c1ccc(Br)cc1Br Amb23527374 [0,2,0,0,0,0|1,0,0]=3 3751 B12R1.1703 NNC(=O)c1ccc(Br)cc1Cl Amb2684991 [0,2,0,0,0,0|1,0,0]=3 3752 B12R1.1703 NNC(=O)c1ccc(Br)cc1F Amb23527439 [0,2,0,0,0,0|1,0,0]=3 3753 B12R1.1703 NNC(=O)c1ccc(Br)cc1N Amb27592794 [0,2,0,0,0,0|1,0,0]=3 3754 B12R1.1703 NNC(=O)c1ccc(Br)nc1Br Amb22500967 [0,2,0,0,0,0|2,0,0]=4 3755 B12R1.1703 NNC(=O)c1ccc(Cl)cc1Br Amb21959353 [0,2,0,0,0,0|1,0,0]=3 3756 B12R1.1703 NNC(=O)c1ccc(Cl)cc1Cl Amb1016562 [0,2,0,0,0,0|1,0,0]=3 3757 B12R1.1703 NNC(=O)c1ccc(Cl)cc1F Amb6244504 [0,2,0,0,0,0|1,0,0]=3 3758 B12R1.1703 NNC(=O)c1ccc(Cl)cc1O Amb2154719 [0,2,0,0,0,0|1,0,0]=3 3759 B12R1.1703 NNC(=O)c1ccc(F)cc1Br Amb1124105 [0,2,0,0,0,0|1,0,0]=3 3760 B12R1.1703 NNC(=O)c1ccc(F)cc1Cl Amb1132454 [0,2,0,0,0,0|1,0,0]=3 3761 B12R1.1703 NNC(=O)c1ccc(F)cc1F Amb1128428 [0,2,0,0,0,0|1,0,0]=3 3762 B12R1.1703 NNC(=O)c1ccc(F)cc1O Amb25992399 [0,2,0,0,0,0|1,0,0]=3 3763 B12R1.1703 NNC(=O)c1ccc(I)cc1Cl Amb23491831 [0,2,0,0,0,0|1,0,0]=3 3764 B12R1.1703 NNC(=O)c1ccc(N)cc1Cl Amb27407776 [0,2,0,0,0,0|1,0,0]=3 3765 B12R1.1703 NNC(=O)c1ccc(N)cc1F Amb27834246 [0,2,0,0,0,0|1,0,0]=3 3766 B12R1.1703 NNC(=O)c1ccc(N)cc1O Amb2413889 [0,2,0,0,0,0|1,0,0]=3 3767 B12R1.1703 NNC(=O)c1ccc(O)cc1O Amb6355832 [0,2,0,0,0,0|1,0,0]=3 3768 B12R1.1703 NNC(=O)c1ccc(S)cc1O Amb28243947 [0,2,0,0,0,0|1,0,0]=3 3769 B12R1.1703 NNC(=O)c1cnc(N)cc1N Amb27190902 [0,2,0,0,0,0|2,0,0]=4 3770 B12R1.1703 NNC(=O)c1cnc(O)cc1O Amb16231230 [0,2,0,0,0,0|2,0,0]=4 3771 B12R1.1703 O=C(NO)c1ccc(Br)cc1Br Amb27770930 [0,2,0,0,0,0|2,0,0]=4 3772 B12R1.1703 O=C(NO)c1ccc(Br)cc1O Amb10975704 [0,2,0,0,0,0|2,0,0]=4 3773 B12R1.1703 O=C(NO)c1ccc(Cl)cc1Cl Amb6271502 [0,2,0,0,0,0|2,0,0]=4 3774 B12R1.1703 O=C(NO)c1ccc(Cl)cc1O Amb2725154 [0,2,0,0,0,0|2,0,0]=4 3775 B12R1.1703 O=C(NO)c1ccc(I)cc1O Amb26437398 [0,2,0,0,0,0|2,0,0]=4 3776 B12R1.24 CN1C=CC=C(C(=O)NN)C1=O Amb27615696 [0,2,0,0,0,0|2,0,0]=4 3777 B12R1.24 CN1C=CC=C(C(=O)NN)C1=S Amb21927554 [0,2,0,0,0,0|2,0,0]=4 3778 B12R1.24 CNC(=O)c1cccc(Br)c1C Amb26489567 [0,2,0,0,0,0|2,0,0]=4 3779 B12R1.24 CNC(=O)c1cccc(Br)c1F Amb25077028 [0,2,0,0,0,0|2,0,0]=4 3780 B12R1.24 CNC(=O)c1cccc(Br)c1I Amb28194465 [0,2,0,0,0,0|2,0,0]=4 3781 B12R1.24 CNC(=O)c1cccc(Br)c1N Amb18273764 [0,2,0,0,0,0|2,0,0]=4 3782 B12R1.24 CNC(=O)c1cccc(Br)c1O Amb25364965 [0,2,0,0,0,0|2,0,0]=4 3783 B12R1.24 CNC(=O)c1cccc(C)c1Cl Amb27456916 [0,2,0,0,0,0|2,0,0]=4 3784 B12R1.24 CNC(=O)c1cccc(C)c1N Amb1112027 [0,2,0,0,0,0|2,0,0]=4 3785 B12R1.24 CNC(=O)c1cccc(C)c1O Amb6671648 [0,2,0,0,0,0|2,0,0]=4 3786 B12R1.24 CNC(=O)c1cccc(Cl)c1Cl Amb248673 [0,2,0,0,0,0|2,0,0]=4 3787 B12R1.24 CNC(=O)c1cccc(Cl)c1F Amb26482307 [0,2,0,0,0,0|2,0,0]=4 3788 B12R1.24 CNC(=O)c1cccc(Cl)c1N Amb18273849 [0,2,0,0,0,0|2,0,0]=4 3789 B12R1.24 CNC(=O)c1cccc(F)c1Cl Amb27255719 [0,2,0,0,0,0|2,0,0]=4 3790 B12R1.24 CNC(=O)c1cccc(F)c1F Amb18802173 [0,2,0,0,0,0|2,0,0]=4 3791 B12R1.24 CNC(=O)c1cccc(F)c1N Amb8631383 [0,2,0,0,0,0|2,0,0]=4 3792 B12R1.24 CNC(=O)c1cccc(N)c1Br Amb27154113 [0,2,0,0,0,0|2,0,0]=4 3793 B12R1.24 CNC(=O)c1cccc(N)c1C Amb1115069 [0,2,0,0,0,0|2,0,0]=4 3794 B12R1.24 CNC(=O)c1cccc(N)c1Cl Amb24656887 [0,2,0,0,0,0|2,0,0]=4 3795 B12R1.24 CNC(=O)c1cccc(N)c1F Amb25722163 [0,2,0,0,0,0|2,0,0]=4 3796 B12R1.24 CNC(=O)c1cccc(O)c1F Amb28455692 [0,2,0,0,0,0|2,0,0]=4 3797 B12R1.24 CNC(=O)c1cccc(O)c1O Amb27238539 [0,2,0,0,0,0|2,0,0]=4 3798 B12R1.24 CNC(=O)c1ccnc(Cl)c1C Amb26443995 [0,2,0,0,0,0|1,0,0]=3 3799 B12R1.24 CNC(=O)c1ccnc(Cl)c1Cl Amb22731251 [0,2,0,0,0,0|1,0,0]=3 3800 B12R1.24 CNC(=O)c1ccnc(O)c1Br Amb28198432 [0,2,0,0,0,0|1,0,0]=3 3801 B12R1.24 COC(=O)c1ccnc(Br)c1Br Amb24319868 [0,2,0,0,0,0|2,0,0]=4 3802 B12R1.24 COC(=O)c1ccnc(Br)c1C Amb26484647 [0,2,0,0,0,0|2,0,0]=4 3803 B12R1.24 COC(=O)c1ccnc(Br)c1F Amb28312921 [0,2,0,0,0,0|2,0,0]=4 3804 B12R1.24 COC(=O)c1ccnc(Br)c1N Amb22292232 [0,2,0,0,0,0|2,0,0]=4 3805 B12R1.24 COC(=O)c1ccnc(Br)c1O Amb27605950 [0,2,0,0,0,0|2,0,0]=4 3806 B12R1.24 COC(=O)c1ccnc(C)c1Br Amb24578849 [0,2,0,0,0,0|2,0,0]=4 3807 B12R1.24 COC(=O)c1ccnc(C)c1C Amb22749135 [0,2,0,0,0,0|2,0,0]=4 3808 B12R1.24 COC(=O)c1ccnc(C)c1F Amb26493198 [0,2,0,0,0,0|2,0,0]=4 3809 B12R1.24 COC(=O)c1ccnc(C)c1N Amb24183393 [0,2,0,0,0,0|2,0,0]=4 3810 B12R1.24 COC(=O)c1ccnc(C)c1O Amb25689786 [0,2,0,0,0,0|2,0,0]=4 3811 B12R1.24 COC(=O)c1ccnc(Cl)c1Br Amb27616802 [0,2,0,0,0,0|2,0,0]=4 3812 B12R1.24 COC(=O)c1ccnc(Cl)c1C Amb21856126 [0,2,0,0,0,0|2,0,0]=4 3813 B12R1.24 COC(=O)c1ccnc(Cl)c1Cl Amb10975387 [0,2,0,0,0,0|2,0,0]=4 3814 B12R1.24 COC(=O)c1ccnc(Cl)c1F Amb16231983 [0,2,0,0,0,0|2,0,0]=4 3815 B12R1.24 COC(=O)c1ccnc(Cl)c1N Amb2697484 [0,2,0,0,0,0|2,0,0]=4 3816 B12R1.24 COC(=O)c1ccnc(Cl)c1O Amb22499702 [0,2,0,0,0,0|2,0,0]=4 3817 B12R1.24 COC(=O)c1ccnc(F)c1Br Amb27753687 [0,2,0,0,0,0|2,0,0]=4 3818 B12R1.24 COC(=O)c1ccnc(F)c1Cl Amb25335312 [0,2,0,0,0,0|2,0,0]=4 3819 B12R1.24 COC(=O)c1ccnc(F)c1F Amb22496380 [0,2,0,0,0,0|2,0,0]=4 3820 B12R1.24 COC(=O)c1ccnc(F)c1N Amb27876911 [0,2,0,0,0,0|2,0,0]=4 3821 B12R1.24 COC(=O)c1ccnc(F)c1O Amb24417124 [0,2,0,0,0,0|2,0,0]=4 3822 B12R1.24 COC(=O)c1ccnc(I)c1F Amb4560983 [0,2,0,0,0,0|2,0,0]=4 3823 B12R1.24 COC(=O)c1ccnc(N)c1C Amb28434516 [0,2,0,0,0,0|2,0,0]=4 3824 B12R1.24 COC(=O)c1ccnc(N)c1Cl Amb25723100 [0,2,0,0,0,0|2,0,0]=4 3825 B12R1.24 COC(=O)c1ccnc(N)c1F Amb26917092 [0,2,0,0,0,0|2,0,0]=4 3826 B12R1.24 COC(=O)c1ccnc(N)c1N Amb25859327 [0,2,0,0,0,0|2,0,0]=4 3827 B12R1.24 COC(=O)c1ccnc(O)c1Br Amb27667860 [0,2,0,0,0,0|2,0,0]=4 3828 B12R1.24 COC(=O)c1ccnc(O)c1Cl Amb26847162 [0,2,0,0,0,0|2,0,0]=4 3829 B12R1.24 COC(=O)c1ccnc(O)c1N Amb27985657 [0,2,0,0,0,0|2,0,0]=4 3830 B12R1.24 Cc1c(Br)cccc1C(=O)CN Amb28370358 [0,2,0,0,0,0|2,0,0]=4 3831 B12R1.24 Cc1c(Br)cccc1C(=O)NN Amb21959358 [0,2,0,0,0,0|1,0,0]=3 3832 B12R1.24 Cc1c(C(=O)CBr)ccnc1Cl Amb27438185 [0,2,0,0,0,0|2,0,0]=4 3833 B12R1.24 Cc1c(Cl)cccc1C(=O)CN Amb18863067 [0,2,0,0,0,0|2,0,0]=4 3834 B12R1.24 Cc1c(Cl)cccc1C(=O)NN Amb10789226 [0,2,0,0,0,0|1,0,0]=3 3835 B12R1.24 Cc1c(F)cccc1C(=O)CN Amb26877524 [0,2,0,0,0,0|2,0,0]=4 3836 B12R1.24 Cc1c(F)cccc1C(=O)NN Amb27215031 [0,2,0,0,0,0|1,0,0]=3 3837 B12R1.24 Cc1c(I)cccc1C(=O)NN Amb21959369 [0,2,0,0,0,0|1,0,0]=3 3838 B12R1.24 Cc1c(O)cccc1C(=O)CN Amb26515079 [0,2,0,0,0,0|2,0,0]=4 3839 B12R1.24 Cc1cccc(C(=O)CN)c1Br Amb26934850 [0,2,0,0,0,0|2,0,0]=4 3840 B12R1.24 Cc1cccc(C(=O)CN)c1C Amb18862587 [0,2,0,0,0,0|2,0,0]=4 3841 B12R1.24 Cc1cccc(C(=O)CN)c1Cl Amb25822404 [0,2,0,0,0,0|2,0,0]=4 3842 B12R1.24 Cc1cccc(C(=O)CN)c1F Amb25898642 [0,2,0,0,0,0|2,0,0]=4 3843 B12R1.24 Cc1cccc(C(=O)CN)c1O Amb26877471 [0,2,0,0,0,0|2,0,0]=4 3844 B12R1.24 Cc1cccc(C(=O)NN)c1Br Amb21959356 [0,2,0,0,0,0|1,0,0]=3 3845 B12R1.24 Cc1cccc(C(=O)NN)c1C Amb1135554 [0,2,0,0,0,0|1,0,0]=3 3846 B12R1.24 Cc1cccc(C(=O)NN)c1F Amb28127049 [0,2,0,0,0,0|1,0,0]=3 3847 B12R1.24 Cc1cccc(C(=O)NN)c1I Amb28457795 [0,2,0,0,0,0|1,0,0]=3 3848 B12R1.24 Cc1cccc(C(=O)NN)c1N Amb25152386 [0,2,0,0,0,0|1,0,0]=3 3849 B12R1.24 Cc1cccc(C(=O)NN)c1O Amb6335774 [0,2,0,0,0,0|1,0,0]=3 3850 B12R1.24 Cc1cccc(C(=O)NO)c1I Amb28043202 [0,2,0,0,0,0|2,0,0]=4 3851 B12R1.24 Cc1cccc(C(=O)NO)c1O Amb6273284 [0,2,0,0,0,0|2,0,0]=4 3852 B12R1.24 Cc1nccc(C(=O)CN)c1C Amb27965515 [0,2,0,0,0,0|1,0,0]=3 3853 B12R1.24 NCC(=O)c1cccc(Br)c1Cl Amb27416511 [0,2,0,0,0,0|2,0,0]=4 3854 B12R1.24 NCC(=O)c1cccc(Br)c1F Amb24663680 [0,2,0,0,0,0|2,0,0]=4 3855 B12R1.24 NCC(=O)c1cccc(Br)c1O Amb33332225 [0,2,0,0,0,0|2,0,0]=4 3856 B12R1.24 NCC(=O)c1cccc(Cl)c1Br Amb24708915 [0,2,0,0,0,0|2,0,0]=4 3857 B12R1.24 NCC(=O)c1cccc(Cl)c1Cl Amb18224893 [0,2,0,0,0,0|2,0,0]=4 3858 B12R1.24 NCC(=O)c1cccc(Cl)c1Cl Amb32670661 [0,2,0,0,0,0|2,0,0]=4 3859 B12R1.24 NCC(=O)c1cccc(Cl)c1F Amb26343054 [0,2,0,0,0,0|2,0,0]=4 3860 B12R1.24 NCC(=O)c1cccc(Cl)c1O Amb26059332 [0,2,0,0,0,0|2,0,0]=4 3861 B12R1.24 NCC(=O)c1cccc(F)c1Br Amb27828291 [0,2,0,0,0,0|2,0,0]=4 3862 B12R1.24 NCC(=O)c1cccc(F)c1Cl Amb24575750 [0,2,0,0,0,0|2,0,0]=4 3863 B12R1.24 NCC(=O)c1cccc(F)c1Cl Amb28963320 [0,2,0,0,0,0|2,0,0]=4 3864 B12R1.24 NCC(=O)c1cccc(F)c1F Amb22739393 [0,2,0,0,0,0|2,0,0]=4 3865 B12R1.24 NCC(=O)c1cccc(F)c1F Amb25780407 [0,2,0,0,0,0|2,0,0]=4 3866 B12R1.24 NCC(=O)c1cccc(F)c1O Amb25689042 [0,2,0,0,0,0|2,0,0]=4 3867 B12R1.24 NCC(=O)c1cccc(O)c1Br Amb27954512 [0,2,0,0,0,0|2,0,0]=4 3868 B12R1.24 NCC(=O)c1cccc(O)c1Cl Amb25786510 [0,2,0,0,0,0|2,0,0]=4 3869 B12R1.24 NCC(=O)c1cccc(O)c1F Amb25761989 [0,2,0,0,0,0|2,0,0]=4 3870 B12R1.24 NCC(=O)c1cccc(O)c1N Amb27966403 [0,2,0,0,0,0|2,0,0]=4 3871 B12R1.24 NCC(=O)c1cccc(O)c1O Amb33271302 [0,2,0,0,0,0|2,0,0]=4 3872 B12R1.24 NNC(=O)c1cccc(Cl)c1Cl Amb6543925 [0,2,0,0,0,0|1,0,0]=3 3873 B12R1.24 NNC(=O)c1cccc(Cl)c1F Amb23438080 [0,2,0,0,0,0|1,0,0]=3 3874 B12R1.24 NNC(=O)c1cccc(F)c1F Amb10840463 [0,2,0,0,0,0|1,0,0]=3 3875 B12R1.24 NNC(=O)c1cccc(N)c1O Amb27614582 [0,2,0,0,0,0|1,0,0]=3 3876 B12R1.24 NNC(=O)c1ccnc(Cl)c1F Amb27983478 [0,2,0,0,0,0|0,0,0]=2 3877 B12R1.24 Nc1c(Cl)cccc1C(=O)NO Amb28132820 [0,2,0,0,0,0|2,0,0]=4 3878 B12R1.24 O=C(CCl)c1ccnc(F)c1Cl Amb27588907 [0,2,0,0,0,0|2,0,0]=4 3879 B12R1.24 O=C(NO)c1cccc(Br)c1I Amb27751517 [0,2,0,0,0,0|2,0,0]=4 3880 B12R1.24 O=C(NO)c1cccc(F)c1F Amb18803322 [0,2,0,0,0,0|2,0,0]=4 3881 B12R1.24 O=C(NO)c1cccc(F)c1I Amb28315348 [0,2,0,0,0,0|2,0,0]=4 3882 B12R1.24 O=C(NO)c1cccc(F)c1O Amb28243956 [0,2,0,0,0,0|2,0,0]=4 3883 B12R1.225 CC(C)C(=O)c1ccnc(Cl)c1 Amb6301708 [0,2,0,0,0,0|2,0,0]=4 3884 B12R1.225 CC(N)C(=O)c1cccc(Br)c1 Amb18160379 [0,2,0,0,0,0|2,0,0]=4 3885 B12R1.225 CC(N)C(=O)c1cccc(Cl)c1 Amb17610845 [0,2,0,0,0,0|2,0,0]=4 3886 B12R1.225 CC(N)C(=O)c1cccc(F)c1 Amb18827240 [0,2,0,0,0,0|2,0,0]=4 3887 B12R1.225 CC(N)C(=O)c1cccc(O)c1 Amb18828422 [0,2,0,0,0,0|2,0,0]=4 3888 B12R1.225 CC(N)C(=O)c1cccc(O)c1 Amb30584924 [0,2,0,0,0,0|2,0,0]=4 3889 B12R1.225 CN(C)C(=O)C1=CC(=O)NC=C1 Amb28456759 [0,2,0,0,0,0|1,0,1]=4 3890 B12R1.225 CN(C)C(=O)c1cc(Cl)ncn1 Amb28313680 [0,2,0,0,0,0|2,0,0]=4 3891 B12R1.225 CN(C)C(=O)c1cccc(Br)c1 Amb3887430 [0,2,0,0,0,0|2,0,0]=4 3892 B12R1.225 CN(C)C(=O)c1cccc(I)c1 Amb3888525 [0,2,0,0,0,0|2,0,0]=4 3893 B12R1.225 CN(C)C(=O)c1cccc(N)c1 Amb2193106 [0,2,0,0,0,0|2,0,0]=4 3894 B12R1.225 CN(C)C(=O)c1cccc(O)c1 Amb6436648 [0,2,0,0,0,0|2,0,0]=4 3895 B12R1.225 CN(C)C(=O)c1cccc(S)c1 Amb26956404 [0,2,0,0,0,0|2,0,0]=4 3896 B12R1.225 CN(C)C(=O)c1ccnc(Br)c1 Amb10576239 [0,2,0,0,0,0|1,0,0]=3 3897 B12R1.225 CN(C)C(=O)c1ccnc(Cl)c1 Amb6668020 [0,2,0,0,0,0|1,0,0]=3 3898 B12R1.225 CN(C)C(=O)c1ccnc(F)c1 Amb18788751 [0,2,0,0,0,0|1,0,0]=3 3899 B12R1.225 CN(C)C(=O)c1ccnc(N)c1 Amb18946765 [0,2,0,0,0,0|1,0,0]=3 3900 B12R1.225 CN(O)C(=O)c1cccc(I)c1 Amb27620056 [0,2,0,0,0,0|2,0,0]=4 3901 B12R1.225 CN(O)C(=O)c1cccc(N)c1 Amb28142118 [0,2,0,0,0,0|2,0,0]=4 3902 B12R1.225 CN(O)C(=O)c1ccnc(F)c1 Amb27493244 [0,2,0,0,0,0|1,0,0]=3 3903 B12R1.225 C[C@@H](N)C(=O)c1cccc(Br)c1 Amb35737760 [0,2,0,0,0,0|2,0,0]=4 3904 B12R1.225 C[C@@H](N)C(=O)c1cccc(Cl)c1 Amb35738374 [0,2,0,0,0,0|2,0,0]=4 3905 B12R1.225 C[C@@H](N)C(=O)c1cccc(F)c1 Amb35618030 [0,2,0,0,0,0|2,0,0]=4 3906 B12R1.225 C[C@H](N)C(=O)c1cccc(Br)c1 Amb30024472 [0,2,0,0,0,0|2,0,0]=4 3907 B12R1.225 C[C@H](N)C(=O)c1cccc(Cl)c1 Amb35588869 [0,2,0,0,0,0|2,0,0]=4 3908 B12R1.225 C[C@H](N)C(=O)c1cccc(F)c1 Amb30024516 [0,2,0,0,0,0|2,0,0]=4 3909 B12R1.225 Cc1cc(C(=O)C(=O)O)ccn1 Amb33268225 [0,2,0,0,0,0|2,0,0]=4 3910 B12R1.225 Cc1cc(C(=O)C(C)C)ccn1 Amb27971865 [0,2,0,0,0,0|2,0,0]=4 3911 B12R1.225 Cc1cc(C(=O)C(C)N)ccn1 Amb33268551 [0,2,0,0,0,0|1,0,0]=3 3912 B12R1.225 Cc1cc(C(=O)C(F)F)ccn1 Amb33412727 [0,2,0,0,0,0|2,0,0]=4 3913 B12R1.225 Cc1cc(C(=O)N(C)C)ccn1 Amb27178591 [0,2,0,0,0,0|1,0,0]=3 3914 B12R1.225 Cc1cc(C(=O)N(C)C)ncn1 Amb27178928 [0,2,0,0,0,0|2,0,0]=4 3915 B12R1.225 Cc1cccc(C(=O)C(C)N)c1 Amb18829244 [0,2,0,0,0,0|2,0,0]=4 3916 B12R1.225 Cc1cccc(C(=O)C(N)=O)c1 Amb26478629 [0,2,0,0,0,0|2,0,0]=4 3917 B12R1.225 Cc1cccc(C(=O)N(C)C)c1 Amb3701760 [0,2,0,0,0,0|2,0,0]=4 3918 B12R1.225 Cc1cccc(C(=O)[C@@H](C)N)c1 Amb35618018 [0,2,0,0,0,0|2,0,0]=4 3919 B12R1.225 Cc1cccc(C(=O)[C@H](C)N)c1 Amb30024481 [0,2,0,0,0,0|2,0,0]=4 3920 B12R1.225 O=C(c1ccnc(Cl)c1)C(F)F Amb33404963 [0,2,0,0,0,0|2,0,0]=4 3921 B12R1.354 C=C(CN)c1cc(Cl)ncc1Br Amb33478144 [0,2,0,0,0,0|2,0,0]=4 3922 B12R1.354 C=CC(=O)c1cc(Cl)ncc1Br Amb33477833 [0,2,0,0,0,0|2,0,0]=4 3923 B12R1.354 C=CC(=O)c1cc(F)ncc1F Amb27391549 [0,2,0,0,0,0|2,0,0]=4 3924 B12R1.354 CCC(=O)c1cc(F)ncc1F Amb27593820 [0,2,0,0,0,0|2,0,0]=4 3925 B12R1.354 CNC(=O)c1cc(Br)ccc1Br Amb27416384 [0,2,0,0,0,0|2,0,0]=4 3926 B12R1.354 CNC(=O)c1cc(Br)ccc1C Amb33547934 [0,2,0,0,0,0|2,0,0]=4 3927 B12R1.354 CNC(=O)c1cc(Br)ccc1Cl Amb1226875 [0,2,0,0,0,0|2,0,0]=4 3928 B12R1.354 CNC(=O)c1cc(Br)ccc1F Amb6263903 [0,2,0,0,0,0|2,0,0]=4 3929 B12R1.354 CNC(=O)c1cc(Br)ccc1N Amb18273721 [0,2,0,0,0,0|2,0,0]=4 3930 B12R1.354 CNC(=O)c1cc(Br)ncc1F Amb27485806 [0,2,0,0,0,0|1,0,0]=3 3931 B12R1.354 CNC(=O)c1cc(C)ccc1F Amb18805591 [0,2,0,0,0,0|2,0,0]=4 3932 B12R1.354 CNC(=O)c1cc(C)ccc1I Amb2760422 [0,2,0,0,0,0|2,0,0]=4 3933 B12R1.354 CNC(=O)c1cc(C)ccc1N Amb18947654 [0,2,0,0,0,0|2,0,0]=4 3934 B12R1.354 CNC(=O)c1cc(Cl)ccc1Cl Amb3701463 [0,2,0,0,0,0|2,0,0]=4 3935 B12R1.354 CNC(=O)c1cc(Cl)ccc1F Amb13979834 [0,2,0,0,0,0|2,0,0]=4 3936 B12R1.354 CNC(=O)c1cc(Cl)ccc1N Amb1114869 [0,2,0,0,0,0|2,0,0]=4 3937 B12R1.354 CNC(=O)c1cc(Cl)ncc1Br Amb28319651 [0,2,0,0,0,0|1,0,0]=3 3938 B12R1.354 CNC(=O)c1cc(Cl)nnc1Cl Amb27389223 [0,2,0,0,0,0|2,0,0]=4 3939 B12R1.354 CNC(=O)c1cc(F)ccc1Br Amb6258938 [0,2,0,0,0,0|2,0,0]=4 3940 B12R1.354 CNC(=O)c1cc(F)ccc1F Amb931411 [0,2,0,0,0,0|2,0,0]=4 3941 B12R1.354 CNC(=O)c1cc(F)ccc1N Amb8825280 [0,2,0,0,0,0|2,0,0]=4 3942 B12R1.354 CNC(=O)c1cc(I)ccc1Cl Amb28322203 [0,2,0,0,0,0|2,0,0]=4 3943 B12R1.354 CNC(=O)c1cc(I)ccc1F Amb27849559 [0,2,0,0,0,0|2,0,0]=4 3944 B12R1.354 CNC(=O)c1cc(I)ccc1N Amb8264837 [0,2,0,0,0,0|2,0,0]=4 3945 B12R1.354 CNC(=O)c1cc(N)ccc1Cl Amb10609351 [0,2,0,0,0,0|2,0,0]=4 3946 B12R1.354 CNC(=O)c1cc(N)ccc1Cl Amb1114005 [0,2,0,0,0,0|2,0,0]=4 3947 B12R1.354 CNC(=O)c1cc(N)ccc1F Amb17622261 [0,2,0,0,0,0|2,0,0]=4 3948 B12R1.354 CNC(=O)c1cc(N)ccc1F Amb9371461 [0,2,0,0,0,0|2,0,0]=4 3949 B12R1.354 CNC(=O)c1cc(N)ncc1Br Amb27783007 [0,2,0,0,0,0|1,0,0]=3 3950 B12R1.354 CNC(=O)c1cc(N)nnc1Cl Amb27186181 [0,2,0,0,0,0|2,0,0]=4 3951 B12R1.354 CNC(=O)c1cc(O)ccc1Br Amb27967859 [0,2,0,0,0,0|2,0,0]=4 3952 B12R1.354 CNC(=O)c1cc(O)ccc1F Amb26599907 [0,2,0,0,0,0|2,0,0]=4 3953 B12R1.354 CNC(=O)c1nc(C)ncc1Br Amb25355280 [0,2,0,0,0,0|2,0,0]=4 3954 B12R1.354 COC(=O)c1cc(Br)ncc1Br Amb26367123 [0,2,0,0,0,0|2,0,0]=4 3955 B12R1.354 COC(=O)c1cc(Br)ncc1C Amb27412497 [0,2,0,0,0,0|2,0,0]=4 3956 B12R1.354 COC(=O)c1cc(Br)ncc1Cl Amb26352630 [0,2,0,0,0,0|2,0,0]=4 3957 B12R1.354 COC(=O)c1cc(Br)ncc1F Amb19895494 [0,2,0,0,0,0|2,0,0]=4 3958 B12R1.354 COC(=O)c1cc(Br)ncc1N Amb23401578 [0,2,0,0,0,0|2,0,0]=4 3959 B12R1.354 COC(=O)c1cc(Br)ncc1O Amb24183360 [0,2,0,0,0,0|2,0,0]=4 3960 B12R1.354 COC(=O)c1cc(C)ncc1Br Amb25211987 [0,2,0,0,0,0|2,0,0]=4 3961 B12R1.354 COC(=O)c1cc(C)ncc1N Amb18827820 [0,2,0,0,0,0|2,0,0]=4 3962 B12R1.354 COC(=O)c1cc(Cl)ncc1Br Amb33548919 [0,2,0,0,0,0|2,0,0]=4 3963 B12R1.354 COC(=O)c1cc(Cl)ncc1C Amb22755834 [0,2,0,0,0,0|2,0,0]=4 3964 B12R1.354 COC(=O)c1cc(Cl)ncc1Cl Amb6751993 [0,2,0,0,0,0|2,0,0]=4 3965 B12R1.354 COC(=O)c1cc(Cl)ncc1F Amb19895492 [0,2,0,0,0,0|2,0,0]=4 3966 B12R1.354 COC(=O)c1cc(Cl)ncc1N Amb18821787 [0,2,0,0,0,0|2,0,0]=4 3967 B12R1.354 COC(=O)c1cc(Cl)ncc1O Amb20242292 [0,2,0,0,0,0|2,0,0]=4 3968 B12R1.354 COC(=O)c1cc(F)ncc1Br Amb26370839 [0,2,0,0,0,0|2,0,0]=4 3969 B12R1.354 COC(=O)c1cc(F)ncc1I Amb27616187 [0,2,0,0,0,0|2,0,0]=4 3970 B12R1.354 COC(=O)c1cc(F)ncc1N Amb27781452 [0,2,0,0,0,0|2,0,0]=4 3971 B12R1.354 COC(=O)c1cc(F)ncc1O Amb27190898 [0,2,0,0,0,0|2,0,0]=4 3972 B12R1.354 COC(=O)c1cc(I)ncc1F Amb26653512 [0,2,0,0,0,0|2,0,0]=4 3973 B12R1.354 COC(=O)c1cc(I)ncc1N Amb13882939 [0,2,0,0,0,0|2,0,0]=4 3974 B12R1.354 COC(=O)c1cc(N)ncc1Br Amb10070753 [0,2,0,0,0,0|2,0,0]=4 3975 B12R1.354 COC(=O)c1cc(N)ncc1C Amb25723742 [0,2,0,0,0,0|2,0,0]=4 3976 B12R1.354 COC(=O)c1cc(N)ncc1Cl Amb22001357 [0,2,0,0,0,0|2,0,0]=4 3977 B12R1.354 COC(=O)c1cc(N)ncc1F Amb27810931 [0,2,0,0,0,0|2,0,0]=4 3978 B12R1.354 COC(=O)c1cc(N)ncc1N Amb25700898 [0,2,0,0,0,0|2,0,0]=4 3979 B12R1.354 COC(=O)c1cc(N)ncc1O Amb27194908 [0,2,0,0,0,0|2,0,0]=4 3980 B12R1.354 COC(=O)c1cc(O)ncc1Br Amb10070345 [0,2,0,0,0,0|2,0,0]=4 3981 B12R1.354 COC(=O)c1cc(O)ncc1C Amb25337630 [0,2,0,0,0,0|2,0,0]=4 3982 B12R1.354 COC(=O)c1cc(O)ncc1Cl Amb28183934 [0,2,0,0,0,0|2,0,0]=4 3983 B12R1.354 COC(=O)c1cc(O)ncc1N Amb18826741 [0,2,0,0,0,0|2,0,0]=4 3984 B12R1.354 Cc1cc(C(=O)NO)c(C)nn1 Amb27470378 [0,2,0,0,0,0|2,0,0]=4 3985 B12R1.354 Cc1cc[n+]([O-])cc1C(=O)NN Amb17778576 [0,2,0,0,0,0|2,0,0]=4 3986 B12R1.354 Cc1ccc(Br)c(C(=O)CN)c1 Amb27460735 [0,2,0,0,0,0|2,0,0]=4 3987 B12R1.354 Cc1ccc(Br)cc1C(=O)CN Amb27879255 [0,2,0,0,0,0|2,0,0]=4 3988 B12R1.354 Cc1ccc(Br)cc1C(=O)NN Amb24485621 [0,2,0,0,0,0|1,0,0]=3 3989 B12R1.354 Cc1ccc(C)c(C(=O)CN)c1 Amb22963508 [0,2,0,0,0,0|2,0,0]=4 3990 B12R1.354 Cc1ccc(C)c(C(=O)CN)c1 Amb5739535 [0,2,0,0,0,0|2,0,0]=4 3991 B12R1.354 Cc1ccc(C)c(C(=O)NN)c1 Amb6254205 [0,2,0,0,0,0|1,0,0]=3 3992 B12R1.354 Cc1ccc(Cl)c(C(=O)CN)c1 Amb24556065 [0,2,0,0,0,0|2,0,0]=4 3993 B12R1.354 Cc1ccc(Cl)cc1C(=O)CN Amb18863068 [0,2,0,0,0,0|2,0,0]=4 3994 B12R1.354 Cc1ccc(F)c(C(=O)CN)c1 Amb27655252 [0,2,0,0,0,0|2,0,0]=4 3995 B12R1.354 Cc1ccc(F)c(C(=O)NN)c1 Amb18805793 [0,2,0,0,0,0|1,0,0]=3 3996 B12R1.354 Cc1ccc(F)c(C(=O)NO)c1 Amb18806075 [0,2,0,0,0,0|2,0,0]=4 3997 B12R1.354 Cc1ccc(F)cc1C(=O)CN Amb26879935 [0,2,0,0,0,0|2,0,0]=4 3998 B12R1.354 Cc1ccc(F)cc1C(=O)NN Amb18805792 [0,2,0,0,0,0|1,0,0]=3 3999 B12R1.354 Cc1ccc(I)cc1C(=O)NN Amb27843692 [0,2,0,0,0,0|1,0,0]=3 4000 B12R1.354 Cc1ccc(N)c(C(=O)NN)c1 Amb841734 [0,2,0,0,0,0|1,0,0]=3 4001 B12R1.354 Cc1ccc(N)cc1C(=O)NN Amb27973630 [0,2,0,0,0,0|1,0,0]=3 4002 B12R1.354 Cc1ccc(O)c(C(=O)CN)c1 Amb24365937 [0,2,0,0,0,0|2,0,0]=4 4003 B12R1.354 Cc1ccc(O)c(C(=O)NN)c1 Amb2780531 [0,2,0,0,0,0|1,0,0]=3 4004 B12R1.354 Cc1ccc(O)c(C(=O)NO)c1 Amb2781148 [0,2,0,0,0,0|2,0,0]=4 4005 B12R1.354 Cc1ccc(O)cc1C(=O)CN Amb25048408 [0,2,0,0,0,0|2,0,0]=4 4006 B12R1.354 Cc1ccc(O)cc1C(=O)NN Amb27981280 [0,2,0,0,0,0|1,0,0]=3 4007 B12R1.354 Cc1ccc(O)cc1C(=O)NO Amb27449111 [0,2,0,0,0,0|2,0,0]=4 4008 B12R1.354 Cc1cnc(Cl)cc1C(=O)NN Amb27876912 [0,2,0,0,0,0|0,0,0]=2 4009 B12R1.354 Cc1cnc(F)c(C(=O)NN)c1 Amb28066743 [0,2,0,0,0,0|2,0,0]=4 4010 B12R1.354 N=C(NN)c1cc(Cl)ccc1O Amb27865794 [0,2,0,0,0,0|2,0,0]=4 4011 B12R1.354 N=C(NN)c1cc(F)ccc1F Amb19373482 [0,2,0,0,0,0|2,0,0]=4 4012 B12R1.354 NCC(=O)c1cc(Br)ccc1Cl Amb25054487 [0,2,0,0,0,0|2,0,0]=4 4013 B12R1.354 NCC(=O)c1cc(Br)ccc1F Amb26879934 [0,2,0,0,0,0|2,0,0]=4 4014 B12R1.354 NCC(=O)c1cc(Br)ccc1I Amb27648737 [0,2,0,0,0,0|2,0,0]=4 4015 B12R1.354 NCC(=O)c1cc(Br)ccc1O Amb24728653 [0,2,0,0,0,0|2,0,0]=4 4016 B12R1.354 NCC(=O)c1cc(Cl)ccc1Br Amb25816483 [0,2,0,0,0,0|2,0,0]=4 4017 B12R1.354 NCC(=O)c1cc(Cl)ccc1Cl Amb18951220 [0,2,0,0,0,0|2,0,0]=4 4018 B12R1.354 NCC(=O)c1cc(Cl)ccc1Cl Amb2693528 [0,2,0,0,0,0|2,0,0]=4 4019 B12R1.354 NCC(=O)c1cc(Cl)ccc1F Amb18893771 [0,2,0,0,0,0|2,0,0]=4 4020 B12R1.354 NCC(=O)c1cc(Cl)ccc1F Amb32655911 [0,2,0,0,0,0|2,0,0]=4 4021 B12R1.354 NCC(=O)c1cc(Cl)ccc1O Amb27237312 [0,2,0,0,0,0|2,0,0]=4 4022 B12R1.354 NCC(=O)c1cc(Cl)ncc1Br Amb33477802 [0,2,0,0,0,0|1,0,0]=3 4023 B12R1.354 NCC(=O)c1cc(Cl)ncc1Cl Amb25148695 [0,2,0,0,0,0|1,0,0]=3 4024 B12R1.354 NCC(=O)c1cc(Cl)nnc1Cl Amb33258519 [0,2,0,0,0,0|2,0,0]=4 4025 B12R1.354 NCC(=O)c1cc(F)ccc1Br Amb25685768 [0,2,0,0,0,0|2,0,0]=4 4026 B12R1.354 NCC(=O)c1cc(F)ccc1Cl Amb18821288 [0,2,0,0,0,0|2,0,0]=4 4027 B12R1.354 NCC(=O)c1cc(F)ccc1F Amb17194485 [0,2,0,0,0,0|2,0,0]=4 4028 B12R1.354 NCC(=O)c1cc(F)ccc1O Amb26025939 [0,2,0,0,0,0|2,0,0]=4 4029 B12R1.354 NCC(=O)c1cc(N)ccc1F Amb27424024 [0,2,0,0,0,0|2,0,0]=4 4030 B12R1.354 NCC(=O)c1cc(N)ccc1O Amb27442492 [0,2,0,0,0,0|2,0,0]=4 4031 B12R1.354 NCC(=O)c1cc(O)ccc1Br Amb27629283 [0,2,0,0,0,0|2,0,0]=4 4032 B12R1.354 NCC(=O)c1cc(O)ccc1Cl Amb26883807 [0,2,0,0,0,0|2,0,0]=4 4033 B12R1.354 NCC(=O)c1cc(O)ccc1Cl Amb32687536 [0,2,0,0,0,0|2,0,0]=4 4034 B12R1.354 NCC(=O)c1cc(O)ccc1F Amb28289643 [0,2,0,0,0,0|2,0,0]=4 4035 B12R1.354 NCC(=O)c1cc(O)ccc1O Amb26021722 [0,2,0,0,0,0|2,0,0]=4 4036 B12R1.354 NNC(=O)c1cc(Br)ccc1Br Amb26956217 [0,2,0,0,0,0|1,0,0]=3 4037 B12R1.354 NNC(=O)c1cc(Br)ccc1Cl Amb6508739 [0,2,0,0,0,0|1,0,0]=3 4038 B12R1.354 NNC(=O)c1cc(Br)ccc1F Amb26072089 [0,2,0,0,0,0|1,0,0]=3 4039 B12R1.354 NNC(=O)c1cc(Br)ccc1O Amb6491704 [0,2,0,0,0,0|1,0,0]=3 4040 B12R1.354 NNC(=O)c1cc(Br)cnc1Cl Amb25667670 [0,2,0,0,0,0|2,0,0]=4 4041 B12R1.354 NNC(=O)c1cc(Br)cnc1S Amb27615777 [0,2,0,0,0,0|2,0,0]=4 4042 B12R1.354 NNC(=O)c1cc(Cl)ccc1Br Amb21959354 [0,2,0,0,0,0|1,0,0]=3 4043 B12R1.354 NNC(=O)c1cc(Cl)ccc1Cl Amb1208717 [0,2,0,0,0,0|1,0,0]=3 4044 B12R1.354 NNC(=O)c1cc(Cl)ccc1F Amb6247331 [0,2,0,0,0,0|1,0,0]=3 4045 B12R1.354 NNC(=O)c1cc(Cl)ccc1O Amb1656679 [0,2,0,0,0,0|1,0,0]=3 4046 B12R1.354 NNC(=O)c1cc(Cl)ccc1S Amb27866413 [0,2,0,0,0,0|1,0,0]=3 4047 B12R1.354 NNC(=O)c1cc(Cl)cnc1Br Amb25669548 [0,2,0,0,0,0|2,0,0]=4 4048 B12R1.354 NNC(=O)c1cc(Cl)cnc1Cl Amb27867143 [0,2,0,0,0,0|2,0,0]=4 4049 B12R1.354 NNC(=O)c1cc(Cl)cnc1N Amb22736295 [0,2,0,0,0,0|2,0,0]=4 4050 B12R1.354 NNC(=O)c1cc(F)ccc1Br Amb1141007 [0,2,0,0,0,0|1,0,0]=3 4051 B12R1.354 NNC(=O)c1cc(F)ccc1F Amb6264723 [0,2,0,0,0,0|1,0,0]=3 4052 B12R1.354 NNC(=O)c1cc(F)ccc1S Amb27878499 [0,2,0,0,0,0|1,0,0]=3 4053 B12R1.354 NNC(=O)c1cc(I)ccc1Cl Amb21959362 [0,2,0,0,0,0|1,0,0]=3 4054 B12R1.354 NNC(=O)c1cc(I)ccc1F Amb27843691 [0,2,0,0,0,0|1,0,0]=3 4055 B12R1.354 NNC(=O)c1cc(I)ccc1I Amb28122173 [0,2,0,0,0,0|1,0,0]=3 4056 B12R1.354 NNC(=O)c1cc(I)ccc1N Amb27756873 [0,2,0,0,0,0|1,0,0]=3 4057 B12R1.354 NNC(=O)c1cc(I)cnc1Cl Amb28344208 [0,2,0,0,0,0|2,0,0]=4 4058 B12R1.354 NNC(=O)c1cc(N)ccc1Cl Amb28314157 [0,2,0,0,0,0|1,0,0]=3 4059 B12R1.354 NNC(=O)c1cc(N)ccc1N Amb28399445 [0,2,0,0,0,0|1,0,0]=3 4060 B12R1.354 NNC(=O)c1cc(O)ccc1I Amb27166715 [0,2,0,0,0,0|1,0,0]=3 4061 B12R1.354 NNC(=O)c1cc(O)ccc1O Amb6490721 [0,2,0,0,0,0|1,0,0]=3 4062 B12R1.354 NNC(=O)c1nc(Cl)ccc1Cl Amb4458309 [0,2,0,0,0,0|2,0,0]=4 4063 B12R1.354 NNC(=S)c1cc(F)ccc1F Amb27469670 [0,2,0,0,0,0|1,1,0]=4 4064 B12R1.354 NNC(=S)c1cc(F)ccc1F Amb32405274 [0,2,0,0,0,0|1,1,0]=4 4065 B12R1.354 Nc1ccc(Cl)cc1C(=O)NO Amb5751307 [0,2,0,0,0,0|2,0,0]=4 4066 B12R1.354 O=C(CCl)c1cc(Cl)ncc1Br Amb27813076 [0,2,0,0,0,0|2,0,0]=4 4067 B12R1.354 O=C(CCl)c1cc(Cl)ncc1Cl Amb25890624 [0,2,0,0,0,0|2,0,0]=4 4068 B12R1.354 O=C(NO)c1cc(Br)ccc1Cl Amb8950860 [0,2,0,0,0,0|2,0,0]=4 4069 B12R1.354 O=C(NO)c1cc(Br)ncc1Cl Amb28078436 [0,2,0,0,0,0|1,0,0]=3 4070 B12R1.354 O=C(NO)c1cc(Cl)ccc1O Amb2725153 [0,2,0,0,0,0|2,0,0]=4 4071 B12R1.354 O=C(NO)c1cc(F)ccc1Br Amb6256838 [0,2,0,0,0,0|2,0,0]=4 4072 B12R1.354 O=C(NO)c1cc(F)ccc1Cl Amb27599134 [0,2,0,0,0,0|2,0,0]=4 4073 B12R1.354 O=C(NO)c1cc(I)ccc1Cl Amb23551849 [0,2,0,0,0,0|2,0,0]=4 4074 B12R1.354 O=C(NO)c1cc(O)ccc1Cl Amb27399652 [0,2,0,0,0,0|2,0,0]=4 4075 B12R1.358 C#CC(=O)c1cc(C)nc(C)c1 Amb27754380 [0,2,0,0,0,0|2,0,0]=4 4076 B12R1.358 C=C(CN)c1cc(C)nc(Cl)c1 Amb33221977 [0,2,0,0,0,0|2,0,0]=4 4077 B12R1.358 C=C(CN)c1cc(Cl)nc(Cl)c1 Amb33258165 [0,2,0,0,0,0|2,0,0]=4 4078 B12R1.358 C=CC(=O)c1cc(C)nc(Cl)c1 Amb33221948 [0,2,0,0,0,0|2,0,0]=4 4079 B12R1.358 C=CC(=O)c1cc(Cl)nc(Cl)c1 Amb33257797 [0,2,0,0,0,0|2,0,0]=4 4080 B12R1.358 CC1=CC(C(=O)NN)=CC(=O)N1 Amb27463471 [0,2,0,0,0,0|0,0,1]=3 4081 B12R1.358 CNC(=N)c1cc(C)nc(C)c1 Amb27645994 [0,2,0,0,0,0|2,0,0]=4 4082 B12R1.358 CNC(=O)c1cc(C)cc(Cl)c1 Amb27463870 [0,2,0,0,0,0|2,0,0]=4 4083 B12R1.358 CNC(=O)c1cc(C)cc(N)c1 Amb28070179 [0,2,0,0,0,0|2,0,0]=4 4084 B12R1.358 CNC(=O)c1cc(C)nc(Cl)n1 Amb23443218 [0,2,0,0,0,0|2,0,0]=4 4085 B12R1.358 CNC(=O)c1cc(C)nc(N)c1 Amb27592625 [0,2,0,0,0,0|1,0,0]=3 4086 B12R1.358 CNC(=O)c1cc(C)nc(N)n1 Amb17490893 [0,2,0,0,0,0|2,0,0]=4 4087 B12R1.358 CNC(=O)c1cc(Cl)cc(Br)c1 Amb25374891 [0,2,0,0,0,0|2,0,0]=4 4088 B12R1.358 CNC(=O)c1cc(Cl)cc(Cl)c1 Amb248621 [0,2,0,0,0,0|2,0,0]=4 4089 B12R1.358 CNC(=O)c1cc(Cl)nc(Cl)n1 Amb27864111 [0,2,0,0,0,0|2,0,0]=4 4090 B12R1.358 CNC(=O)c1cc(F)cc(Br)c1 Amb10741764 [0,2,0,0,0,0|2,0,0]=4 4091 B12R1.358 CNC(=O)c1cc(F)cc(Cl)c1 Amb26476103 [0,2,0,0,0,0|2,0,0]=4 4092 B12R1.358 CNC(=O)c1cc(N)cc(Br)c1 Amb25770399 [0,2,0,0,0,0|2,0,0]=4 4093 B12R1.358 CNC(=O)c1cc(N)cc(F)c1 Amb26003299 [0,2,0,0,0,0|2,0,0]=4 4094 B12R1.358 CNC(=O)c1cc(N)cc(I)c1 Amb27659832 [0,2,0,0,0,0|2,0,0]=4 4095 B12R1.358 CNC(=O)c1cc(N)cc(O)c1 Amb24433877 [0,2,0,0,0,0|2,0,0]=4 4096 B12R1.358 CNC(=O)c1cc(O)cc(F)c1 Amb24415371 [0,2,0,0,0,0|2,0,0]=4 4097 B12R1.358 CNC(=O)c1cc(O)cc(I)c1 Amb27876626 [0,2,0,0,0,0|2,0,0]=4 4098 B12R1.358 CNC(=O)c1cc(O)cc(O)c1 Amb27858971 [0,2,0,0,0,0|2,0,0]=4 4099 B12R1.358 COC(=O)c1cc(Br)nc(Br)c1 Amb16185729 [0,2,0,0,0,0|2,0,0]=4 4100 B12R1.358 COC(=O)c1cc(C)nc(Br)c1 Amb10576347 [0,2,0,0,0,0|2,0,0]=4 4101 B12R1.358 COC(=O)c1cc(C)nc(C)c1 Amb19895087 [0,2,0,0,0,0|2,0,0]=4 4102 B12R1.358 COC(=O)c1cc(C)nc(Cl)c1 Amb2689393 [0,2,0,0,0,0|2,0,0]=4 4103 B12R1.358 COC(=O)c1cc(C)nc(N)c1 Amb20620282 [0,2,0,0,0,0|2,0,0]=4 4104 B12R1.358 COC(=O)c1cc(C)nc(O)c1 Amb16185754 [0,2,0,0,0,0|2,0,0]=4 4105 B12R1.358 COC(=O)c1cc(Cl)nc(Br)c1 Amb24399797 [0,2,0,0,0,0|2,0,0]=4 4106 B12R1.358 COC(=O)c1cc(Cl)nc(Cl)c1 Amb1084718 [0,2,0,0,0,0|2,0,0]=4 4107 B12R1.358 COC(=O)c1cc(F)nc(Br)c1 Amb25784710 [0,2,0,0,0,0|2,0,0]=4 4108 B12R1.358 COC(=O)c1cc(F)nc(F)c1 Amb25034613 [0,2,0,0,0,0|2,0,0]=4 4109 B12R1.358 COC(=O)c1cc(F)nc(I)c1 Amb25973283 [0,2,0,0,0,0|2,0,0]=4 4110 B12R1.358 COC(=O)c1cc(N)nc(Br)c1 Amb27616958 [0,2,0,0,0,0|2,0,0]=4 4111 B12R1.358 COC(=O)c1cc(N)nc(Cl)c1 Amb25866505 [0,2,0,0,0,0|2,0,0]=4 4112 B12R1.358 COC(=O)c1cc(N)nc(F)c1 Amb24596248 [0,2,0,0,0,0|2,0,0]=4 4113 B12R1.358 COC(=O)c1cc(N)nc(N)c1 Amb24309024 [0,2,0,0,0,0|2,0,0]=4 4114 B12R1.358 COC(=O)c1cc(O)nc(Br)c1 Amb24694605 [0,2,0,0,0,0|2,0,0]=4 4115 B12R1.358 COC(=O)c1cc(O)nc(Cl)c1 Amb27249483 [0,2,0,0,0,0|2,0,0]=4 4116 B12R1.358 COC(=O)c1cc(O)nc(F)c1 Amb27246862 [0,2,0,0,0,0|2,0,0]=4 4117 B12R1.358 COC(=O)c1cc(O)nc(O)c1 Amb2610452 [0,2,0,0,0,0|2,0,0]=4 4118 B12R1.358 Cc1cc(Br)cc(C(=O)CN)c1 Amb25702609 [0,2,0,0,0,0|2,0,0]=4 4119 B12R1.358 Cc1cc(Br)cc(C(=O)NO)c1 Amb25303457 [0,2,0,0,0,0|2,0,0]=4 4120 B12R1.358 Cc1cc(C(=O)CCl)cc(Cl)n1 Amb27659435 [0,2,0,0,0,0|2,0,0]=4 4121 B12R1.358 Cc1cc(C(=O)CN)cc(Cl)n1 Amb33221484 [0,2,0,0,0,0|1,0,0]=3 4122 B12R1.358 Cc1cc(C(=O)NN)cc(Br)n1 Amb28342628 [0,2,0,0,0,0|0,0,0]=2 4123 B12R1.358 Cc1cc(C(=O)NN)nc(O)n1 Amb26614271 [0,2,0,0,0,0|1,0,0]=3 4124 B12R1.358 Cc1cc(C(=O)NO)cc(Cl)n1 Amb25669951 [0,2,0,0,0,0|1,0,0]=3 4125 B12R1.358 Cc1cc(C(C)NN)cc(C)n1 Amb27863333 [0,2,0,0,0,0|1,0,1]=4 4126 B12R1.358 Cc1cc(C)cc(C(=O)CN)c1 Amb18829248 [0,2,0,0,0,0|2,0,0]=4 4127 B12R1.358 Cc1cc(C)cc(C(=O)NN)c1 Amb6382249 [0,2,0,0,0,0|1,0,0]=3 4128 B12R1.358 Cc1cc(Cl)cc(C(=O)CN)c1 Amb24451942 [0,2,0,0,0,0|2,0,0]=4 4129 B12R1.358 Cc1cc(Cl)cc(C(=O)NO)c1 Amb27615403 [0,2,0,0,0,0|2,0,0]=4 4130 B12R1.358 Cc1cc(F)cc(C(=O)CN)c1 Amb26018150 [0,2,0,0,0,0|2,0,0]=4 4131 B12R1.358 Cc1cc(O)cc(C(=O)CN)c1 Amb26639414 [0,2,0,0,0,0|2,0,0]=4 4132 B12R1.358 Cc1cc(\C(N)=N\N)cc(C)n1 Amb28119729 [0,2,0,0,0,0|1,0,1]=4 4133 B12R1.358 N=C(NN)c1cc(F)cc(F)c1 Amb19514917 [0,2,0,0,0,0|2,0,0]=4 4134 B12R1.358 NCC(=O)c1cc(Cl)cc(Br)c1 Amb22737729 [0,2,0,0,0,0|2,0,0]=4 4135 B12R1.358 NCC(=O)c1cc(Cl)cc(Br)c1 Amb24406258 [0,2,0,0,0,0|2,0,0]=4 4136 B12R1.358 NCC(=O)c1cc(Cl)cc(Cl)c1 Amb18224973 [0,2,0,0,0,0|2,0,0]=4 4137 B12R1.358 NCC(=O)c1cc(Cl)nc(Cl)c1 Amb27426608 [0,2,0,0,0,0|1,0,0]=3 4138 B12R1.358 NCC(=O)c1cc(F)cc(Br)c1 Amb24627585 [0,2,0,0,0,0|2,0,0]=4 4139 B12R1.358 NCC(=O)c1cc(F)cc(Cl)c1 Amb26585772 [0,2,0,0,0,0|2,0,0]=4 4140 B12R1.358 NCC(=O)c1cc(F)cc(F)c1 Amb10839343 [0,2,0,0,0,0|2,0,0]=4 4141 B12R1.358 NCC(=O)c1cc(F)cc(F)c1 Amb22755933 [0,2,0,0,0,0|2,0,0]=4 4142 B12R1.358 NCC(=O)c1cc(O)cc(Br)c1 Amb27762767 [0,2,0,0,0,0|2,0,0]=4 4143 B12R1.358 NCC(=O)c1cc(O)cc(Cl)c1 Amb25817101 [0,2,0,0,0,0|2,0,0]=4 4144 B12R1.358 NCC(=O)c1cc(O)cc(F)c1 Amb25820428 [0,2,0,0,0,0|2,0,0]=4 4145 B12R1.358 NCC(=O)c1cc(O)cc(O)c1 Amb27231637 [0,2,0,0,0,0|2,0,0]=4 4146 B12R1.358 NNC(=O)C1=CC(=O)NC(=O)N1 Amb18806423 [0,2,0,0,0,0|1,0,1]=4 4147 B12R1.358 NNC(=O)C1=CC(=O)NC(O)=C1 Amb26441212 [0,2,0,0,0,0|0,0,1]=3 4148 B12R1.358 NNC(=O)c1cc(Br)cc(Br)c1 Amb2233176 [0,2,0,0,0,0|1,0,0]=3 4149 B12R1.358 NNC(=O)c1cc(Cl)cc(Br)c1 Amb25126833 [0,2,0,0,0,0|1,0,0]=3 4150 B12R1.358 NNC(=O)c1cc(Cl)cc(Cl)c1 Amb6546449 [0,2,0,0,0,0|1,0,0]=3 4151 B12R1.358 NNC(=O)c1cc(Cl)nc(Cl)c1 Amb2782677 [0,2,0,0,0,0|0,0,0]=2 4152 B12R1.358 NNC(=O)c1cc(F)cc(Br)c1 Amb8875023 [0,2,0,0,0,0|1,0,0]=3 4153 B12R1.358 NNC(=O)c1cc(F)cc(F)c1 Amb2687057 [0,2,0,0,0,0|1,0,0]=3 4154 B12R1.358 NNC(=O)c1cc(I)cc(I)c1 Amb27163997 [0,2,0,0,0,0|1,0,0]=3 4155 B12R1.358 NNC(=O)c1cc(N)cc(Br)c1 Amb27231034 [0,2,0,0,0,0|1,0,0]=3 4156 B12R1.358 NNC(=O)c1cc(N)cc(N)c1 Amb9786601 [0,2,0,0,0,0|1,0,0]=3 4157 B12R1.358 NNC(=O)c1cc(N)nc(Cl)c1 Amb27650617 [0,2,0,0,0,0|0,0,0]=2 4158 B12R1.358 NNC(=O)c1cc(N)nc(N)c1 Amb27244779 [0,2,0,0,0,0|0,0,0]=2 4159 B12R1.358 NNC(=O)c1cc(O)cc(F)c1 Amb25330769 [0,2,0,0,0,0|1,0,0]=3 4160 B12R1.358 NNC(=O)c1cc(O)cc(O)c1 Amb6358079 [0,2,0,0,0,0|1,0,0]=3 4161 B12R1.358 Nc1cc(N)cc(C(=O)NO)c1 Amb27955867 [0,2,0,0,0,0|2,0,0]=4 4162 B12R1.358 O=C(CCl)c1cc(Cl)nc(Cl)c1 Amb33258206 [0,2,0,0,0,0|2,0,0]=4 4163 B12R1.358 O=C(NO)c1cc(Br)cc(Br)c1 Amb27426923 [0,2,0,0,0,0|2,0,0]=4 4164 B12R1.358 O=C(NO)c1cc(Cl)cc(Cl)c1 Amb6262897 [0,2,0,0,0,0|2,0,0]=4 4165 B12R1.358 O=C(NO)c1cc(Cl)nc(Cl)c1 Amb26412558 [0,2,0,0,0,0|1,0,0]=3 4166 B12R1.358 O=C(NO)c1cc(F)cc(Br)c1 Amb8875220 [0,2,0,0,0,0|2,0,0]=4 4167 B12R1.358 O=C(NO)c1cc(F)cc(Cl)c1 Amb26557986 [0,2,0,0,0,0|2,0,0]=4 4168 B12R1.358 O=C(NO)c1cc(F)cc(F)c1 Amb6262424 [0,2,0,0,0,0|2,0,0]=4 4169 B12R1.435 C#CC(=O)c1ccnc(CN)c1 Amb27770814 [0,2,0,0,0,0|2,0,0]=4 4170 B12R1.435 C#Cc1cc(C(=O)OC)ccn1 Amb22751924 [0,2,0,0,0,0|2,0,0]=4 4171 B12R1.435 C#Cc1cccc(C(=O)CN)c1 Amb33267721 [0,2,0,0,0,0|2,0,0]=4 4172 B12R1.435 C#Cc1cccc(C(=O)NC)c1 Amb23399903 [0,2,0,0,0,0|2,0,0]=4 4173 B12R1.435 C#Cc1ccnc(C(=O)NN)c1 Amb28323186 [0,2,0,0,0,0|2,0,0]=4 4174 B12R1.435 C=C(CN)c1ccnc(OC)c1 Amb32730060 [0,2,0,0,0,0|2,0,0]=4 4175 B12R1.435 C=CC(=O)c1ccnc(CN)c1 Amb27468397 [0,2,0,0,0,0|2,0,0]=4 4176 B12R1.435 C=CC(=O)c1ccnc(OC)c1 Amb32730109 [0,2,0,0,0,0|2,0,0]=4 4177 B12R1.435 C=Cc1cc(C(=O)NN)ccn1 Amb27240851 [0,2,0,0,0,0|0,0,0]=2 4178 B12R1.435 CCC(=O)c1ccnc(OC)c1 Amb26425886 [0,2,0,0,0,0|2,0,0]=4 4179 B12R1.435 CCc1cc(C(=O)OC)ccn1 Amb10606526 [0,2,0,0,0,0|2,0,0]=4 4180 B12R1.435 CCc1cc(C(=S)NN)ccn1 Amb27789049 [0,2,0,0,0,0|0,1,0]=3 4181 B12R1.435 CCc1cccc(C(=O)CN)c1 Amb25727359 [0,2,0,0,0,0|2,0,0]=4 4182 B12R1.435 CNC(=O)c1cccc(C#N)c1 Amb6268654 [0,2,0,0,0,0|2,0,0]=4 4183 B12R1.435 CNC(=O)c1cccc(C=O)c1 Amb19943944 [0,2,0,0,0,0|2,0,0]=4 4184 B12R1.435 CNC(=O)c1cccc(CCl)c1 Amb8846424 [0,2,0,0,0,0|2,0,0]=4 4185 B12R1.435 CNC(=O)c1cccc(CN)c1 Amb1119194 [0,2,0,0,0,0|2,0,0]=4 4186 B12R1.435 CNC(=O)c1cccc(CN)c1 Amb6892694 [0,2,0,0,0,0|2,0,0]=4 4187 B12R1.435 CNC(=O)c1cccc(NC)c1 Amb18967614 [0,2,0,0,0,0|2,0,0]=4 4188 B12R1.435 CNC(=O)c1cccc(NC)c1 Amb30584880 [0,2,0,0,0,0|2,0,0]=4 4189 B12R1.435 CNC(=O)c1cccc(OC)c1 Amb2613119 [0,2,0,0,0,0|2,0,0]=4 4190 B12R1.435 CNC(=O)c1ccnc(C#N)c1 Amb24738481 [0,2,0,0,0,0|1,0,0]=3 4191 B12R1.435 CNC(=O)c1ccnc(NC)c1 Amb18959240 [0,2,0,0,0,0|1,0,0]=3 4192 B12R1.435 CNc1cc(C(=O)OC)ccn1 Amb26494957 [0,2,0,0,0,0|2,0,0]=4 4193 B12R1.435 COC(=O)c1ccnc(C#N)c1 Amb8386264 [0,2,0,0,0,0|2,0,0]=4 4194 B12R1.435 COC(=O)c1ccnc(C=O)c1 Amb21857368 [0,2,0,0,0,0|2,0,0]=4 4195 B12R1.435 COC(=O)c1ccnc(CBr)c1 Amb13883483 [0,2,0,0,0,0|2,0,0]=4 4196 B12R1.435 COC(=O)c1ccnc(CBr)c1 Amb22641450 [0,2,0,0,0,0|2,0,0]=4 4197 B12R1.435 COC(=O)c1ccnc(CCl)c1 Amb26495077 [0,2,0,0,0,0|2,0,0]=4 4198 B12R1.435 COC(=O)c1ccnc(CN)c1 Amb16233311 [0,2,0,0,0,0|2,0,0]=4 4199 B12R1.435 COC(=O)c1ccnc(CN)c1 Amb20668528 [0,2,0,0,0,0|2,0,0]=4 4200 B12R1.435 COC(=O)c1ccnc(CN)c1 Amb21964575 [0,2,0,0,0,0|2,0,0]=4 4201 B12R1.435 COC(=O)c1ccnc(CO)c1 Amb21857046 [0,2,0,0,0,0|2,0,0]=4 4202 B12R1.435 COC(=O)c1ccnc(OC)c1 Amb10072099 [0,2,0,0,0,0|2,0,0]=4 4203 B12R1.435 COC(=O)c1ccnc(SC)c1 Amb24731751 [0,2,0,0,0,0|2,0,0]=4 4204 B12R1.435 COc1cc(C(=O)CBr)ccn1 Amb27779161 [0,2,0,0,0,0|2,0,0]=4 4205 B12R1.435 COc1cc(C(=O)CBr)ccn1 Amb32653016 [0,2,0,0,0,0|2,0,0]=4 4206 B12R1.435 COc1cc(C(=O)CN)ccn1 Amb33320592 [0,2,0,0,0,0|1,0,0]=3 4207 B12R1.435 COc1cc(C(=O)NN)ccn1 Amb10975686 [0,2,0,0,0,0|0,0,0]=2 4208 B12R1.435 COc1cc(\C(C)=N\N)ccn1 Amb27598421 [0,2,0,0,0,0|1,0,1]=4 4209 B12R1.435 COc1cccc(C(=O)CN)c1 Amb18972024 [0,2,0,0,0,0|2,0,0]=4 4210 B12R1.435 COc1cccc(C(=O)CN)c1 Amb2693533 [0,2,0,0,0,0|2,0,0]=4 4211 B12R1.435 COc1cccc(C(=O)NN)c1 Amb6356332 [0,2,0,0,0,0|1,0,0]=3 4212 B12R1.435 COc1cccc(C(=O)NN)n1 Amb27261075 [0,2,0,0,0,0|2,0,0]=4 4213 B12R1.435 COc1cccc(C(=O)NN)n1 Amb6565091 [0,2,0,0,0,0|2,0,0]=4 4214 B12R1.435 COc1cccc(C(=O)NO)c1 Amb6280528 [0,2,0,0,0,0|2,0,0]=4 4215 B12R1.435 COc1cccc(C(=S)NN)c1 Amb27607913 [0,2,0,0,0,0|1,1,0]=4 4216 B12R1.435 COc1ccnc(C(=O)NN)c1 Amb6565082 [0,2,0,0,0,0|2,0,0]=4 4217 B12R1.435 CSc1cc(C(=O)NN)ccn1 Amb25198820 [0,2,0,0,0,0|0,0,0]=2 4218 B12R1.435 CSc1cc(C(=O)NO)ccn1 Amb27983039 [0,2,0,0,0,0|1,0,0]=3 4219 B12R1.435 CSc1cccc(C(=O)CN)c1 Amb33144878 [0,2,0,0,0,0|2,0,0]=4 4220 B12R1.435 CSc1cccc(C(=O)NN)c1 Amb27946785 [0,2,0,0,0,0|1,0,0]=3 4221 B12R1.435 N#Cc1cc(C(=O)NN)ccn1 Amb28205164 [0,2,0,0,0,0|0,0,0]=2 4222 B12R1.435 N#Cc1cccc(C(=O)CN)c1 Amb22059377 [0,2,0,0,0,0|2,0,0]=4 4223 B12R1.435 N#Cc1cccc(C(=O)CN)c1 Amb32686919 [0,2,0,0,0,0|2,0,0]=4 4224 B12R1.435 N#Cc1cccc(C(=O)NN)c1 Amb6242321 [0,2,0,0,0,0|1,0,0]=3 4225 B12R1.435 NCC(=O)c1cccc(CF)c1 Amb27638145 [0,2,0,0,0,0|2,0,0]=4 4226 B12R1.435 NCC(=O)c1ccnc(CO)c1 Amb27208499 [0,2,0,0,0,0|1,0,0]=3 4227 B12R1.435 NCc1cc(C(=O)NO)ccn1 Amb27254408 [0,2,0,0,0,0|1,0,0]=3 4228 B12R1.435 NCc1cccc(C(=O)NN)n1 Amb27413547 [0,2,0,0,0,0|2,0,0]=4 4229 B12R1.435 NNC(=O)c1cccc(CO)c1 Amb27474116 [0,2,0,0,0,0|1,0,0]=3 4230 B12R1.435 NNC(=O)c1cccc(CS)c1 Amb28059481 [0,2,0,0,0,0|1,0,0]=3 4231 B12R1.435 NNC(=O)c1cccc(NN)c1 Amb1104500 [0,2,0,0,0,0|1,0,0]=3 4232 B12R1.435 NNC(=O)c1cccc(NN)n1 Amb389049 [0,2,0,0,0,0|2,0,0]=4 4233 B12R1.435 NNC(=O)c1ccnc(NN)c1 Amb16694663 [0,2,0,0,0,0|0,0,0]=2 4234 B12R1.435 O=C(NO)c1cccc(CCl)c1 Amb27758285 [0,2,0,0,0,0|2,0,0]=4 4235 B12R1.435 [C-]#[N+]c1cc(C(=O)OC)ccn1 Amb24616052 [0,2,0,0,0,0|2,0,0]=4 4236 B12R1.124 C=C(C)C(=O)c1ccncc1F Amb27648681 [0,2,0,0,0,0|2,0,0]=4 4237 B12R1.124 CC(N)C(=O)c1ccccc1Br Amb18160374 [0,2,0,0,0,0|2,0,0]=4 4238 B12R1.124 CC(N)C(=O)c1ccccc1Cl Amb18823031 [0,2,0,0,0,0|2,0,0]=4 4239 B12R1.124 CC(N)C(=O)c1ccccc1F Amb18827241 [0,2,0,0,0,0|2,0,0]=4 4240 B12R1.124 CC(N)C(=O)c1ccccc1O Amb27598048 [0,2,0,0,0,0|2,0,0]=4 4241 B12R1.124 CC(N)C(=O)c1ccncc1Br Amb33227488 [0,2,0,0,0,0|1,0,0]=3 4242 B12R1.124 CC(N)C(=O)c1ccncc1Cl Amb33413567 [0,2,0,0,0,0|1,0,0]=3 4243 B12R1.124 CC(N)C(=O)c1ccncc1F Amb26329739 [0,2,0,0,0,0|1,0,0]=3 4244 B12R1.124 CN(C)C(=N)c1ccncc1Cl Amb27635012 [0,2,0,0,0,0|2,0,0]=4 4245 B12R1.124 CN(C)C(=O)c1ccccc1Br Amb2447460 [0,2,0,0,0,0|2,0,0]=4 4246 B12R1.124 CN(C)C(=O)c1ccccc1Cl Amb3886813 [0,2,0,0,0,0|2,0,0]=4 4247 B12R1.124 CN(C)C(=O)c1ccccc1F Amb3886677 [0,2,0,0,0,0|2,0,0]=4 4248 B12R1.124 CN(C)C(=O)c1ccccc1I Amb3888524 [0,2,0,0,0,0|2,0,0]=4 4249 B12R1.124 CN(C)C(=O)c1ccccc1N Amb6336677 [0,2,0,0,0,0|2,0,0]=4 4250 B12R1.124 CN(C)C(=O)c1ccccc1N Amb6465404 [0,2,0,0,0,0|2,0,0]=4 4251 B12R1.124 CN(C)C(=O)c1ccccc1O Amb1485383 [0,2,0,0,0,0|2,0,0]=4 4252 B12R1.124 CN(C)C(=O)c1ccccc1S Amb24484147 [0,2,0,0,0,0|2,0,0]=4 4253 B12R1.124 CN(C)C(=O)c1ccncc1Br Amb27836584 [0,2,0,0,0,0|1,0,0]=3 4254 B12R1.124 CN(C)C(=O)c1ccncc1I Amb27774657 [0,2,0,0,0,0|1,0,0]=3 4255 B12R1.124 CN(C)C(=O)c1ccncc1N Amb28074048 [0,2,0,0,0,0|1,0,0]=3 4256 B12R1.124 CN(C)C(=O)c1ncncc1Br Amb24760013 [0,2,0,0,0,0|2,0,0]=4 4257 B12R1.124 CN(N)C(=O)c1ccccc1N Amb6336642 [0,2,0,0,0,0|1,0,0]=3 4258 B12R1.124 CN(N)C(=O)c1cccnc1N Amb27614727 [0,2,0,0,0,0|2,0,0]=4 4259 B12R1.124 CN(O)C(=O)c1ccccc1Br Amb22441618 [0,2,0,0,0,0|2,0,0]=4 4260 B12R1.124 CN(O)C(=O)c1ccccc1I Amb22488577 [0,2,0,0,0,0|2,0,0]=4 4261 B12R1.124 CN(O)C(=O)c1ccncc1F Amb27880428 [0,2,0,0,0,0|1,0,0]=3 4262 B12R1.124 CN(O)C(=O)c1ncncc1Br Amb27265168 [0,2,0,0,0,0|2,0,0]=4 4263 B12R1.124 C[C@@H](N)C(=O)c1ccccc1Cl Amb35738376 [0,2,0,0,0,0|2,0,0]=4 4264 B12R1.124 C[C@@H](N)C(=O)c1ccccc1F Amb35618029 [0,2,0,0,0,0|2,0,0]=4 4265 B12R1.124 C[C@@H](N)C(=O)c1ccncc1F Amb35618047 [0,2,0,0,0,0|1,0,0]=3 4266 B12R1.124 C[C@H](N)C(=O)c1ccccc1Cl Amb35588871 [0,2,0,0,0,0|2,0,0]=4 4267 B12R1.124 C[C@H](N)C(=O)c1ccccc1F Amb30024515 [0,2,0,0,0,0|2,0,0]=4 4268 B12R1.124 C[C@H](N)C(=O)c1ccncc1F Amb30024535 [0,2,0,0,0,0|1,0,0]=3 4269 B12R1.124 Cc1ccccc1C(=O)C(C)N Amb18829245 [0,2,0,0,0,0|2,0,0]=4 4270 B12R1.124 Cc1ccccc1C(=O)N(C)C Amb3886655 [0,2,0,0,0,0|2,0,0]=4 4271 B12R1.124 Cc1ccccc1C(=O)[C@@H](C)N Amb35618019 [0,2,0,0,0,0|2,0,0]=4 4272 B12R1.124 Cc1ccccc1C(=O)[C@H](C)N Amb30024486 [0,2,0,0,0,0|2,0,0]=4 4273 B12R1.124 Cc1cnccc1C(=N)N(C)C Amb27602978 [0,2,0,0,0,0|2,0,0]=4 4274 B12R1.124 Cc1cnccc1C(=O)C(=O)O Amb33414519 [0,2,0,0,0,0|2,0,0]=4 4275 B12R1.124 Cc1cnccc1C(=O)C(C)C Amb27177823 [0,2,0,0,0,0|2,0,0]=4 4276 B12R1.124 Cc1cnccc1C(=O)C(C)N Amb33226339 [0,2,0,0,0,0|1,0,0]=3 4277 B12R1.124 Cc1cnccc1C(=O)C(F)F Amb32747049 [0,2,0,0,0,0|2,0,0]=4 4278 B12R1.124 O=C(O)C(=O)c1ccncc1Br Amb33388196 [0,2,0,0,0,0|2,0,0]=4 4279 B12R1.124 O=C(O)C(=O)c1ccncc1Cl Amb33413524 [0,2,0,0,0,0|2,0,0]=4 4280 B12R1.124 O=C(O)C(=O)c1ccncc1F Amb27774385 [0,2,0,0,0,0|2,0,0]=4 4281 B12R1.124 O=C(c1ccncc1Br)C(F)F Amb32813686 [0,2,0,0,0,0|2,0,0]=4 4282 B12R1.124 O=C(c1ccncc1Cl)C(F)F Amb32807117 [0,2,0,0,0,0|2,0,0]=4 4283 B12R1.124 O=C(c1ccncc1F)C(F)F Amb26039158 [0,2,0,0,0,0|2,0,0]=4 4284 B12R1.564 CC(C)(N)C(=O)c1ccccc1 Amb22886199 [0,2,0,0,0,0|2,0,0]=4 4285 B12R1.564 CC(C)(N)C(=O)c1ccccc1 Amb5739564 [0,2,0,0,0,0|2,0,0]=4 4286 B12R1.564 CC(C)(N)C(=O)c1ccncc1 Amb18563634 [0,2,0,0,0,0|1,0,0]=3 4287 B12R1.564 O=C(c1ccncc1)C(F)(F)F Amb18929956 [0,2,0,0,0,0|2,0,0]=4 4288 B12R1.564 O=C(c1ccncc1)C(F)(F)F Amb32650191 [0,2,0,0,0,0|2,0,0]=4 4289 B12R1.77 C#Cc1ccccc1C(=O)CN Amb33314784 [0,2,0,0,0,0|2,0,0]=4 4290 B12R1.77 C=Cc1cnccc1C(=O)OC Amb33456835 [0,2,0,0,0,0|2,0,0]=4 4291 B12R1.77 CCC(=O)c1ccncc1CO Amb28074602 [0,2,0,0,0,0|2,0,0]=4 4292 B12R1.77 CCc1ccccc1C(=O)CN Amb26068415 [0,2,0,0,0,0|2,0,0]=4 4293 B12R1.77 CCc1cnccc1C(=N)NC Amb27951438 [0,2,0,0,0,0|2,0,0]=4 4294 B12R1.77 CCc1cnccc1C(=O)NC Amb27836519 [0,2,0,0,0,0|1,0,0]=3 4295 B12R1.77 CCc1cnccc1C(=O)NO Amb28283403 [0,2,0,0,0,0|1,0,0]=3 4296 B12R1.77 CCc1cnccc1C(=O)OC Amb28318416 [0,2,0,0,0,0|2,0,0]=4 4297 B12R1.77 CNC(=O)c1ccccc1C=O Amb18645820 [0,2,0,0,0,0|2,0,0]=4 4298 B12R1.77 CNC(=O)c1ccccc1CN Amb18251685 [0,2,0,0,0,0|2,0,0]=4 4299 B12R1.77 CNC(=O)c1ccccc1CO Amb2196511 [0,2,0,0,0,0|2,0,0]=4 4300 B12R1.77 CNC(=O)c1ccccc1NC Amb18953571 [0,2,0,0,0,0|2,0,0]=4 4301 B12R1.77 CNC(=O)c1ccncc1NN Amb27248110 [0,2,0,0,0,0|1,0,0]=3 4302 B12R1.77 CNc1ccccc1C(=O)NN Amb31156153 [0,2,0,0,0,0|1,0,0]=3 4303 B12R1.77 CNc1ccccc1C(=O)NN Amb841739 [0,2,0,0,0,0|1,0,0]=3 4304 B12R1.77 COC(=O)c1ccncc1C#N Amb18645594 [0,2,0,0,0,0|2,0,0]=4 4305 B12R1.77 COC(=O)c1ccncc1C=O Amb23538928 [0,2,0,0,0,0|2,0,0]=4 4306 B12R1.77 COC(=O)c1ccncc1CBr Amb22757333 [0,2,0,0,0,0|2,0,0]=4 4307 B12R1.77 COC(=O)c1ccncc1CCl Amb22757354 [0,2,0,0,0,0|2,0,0]=4 4308 B12R1.77 COC(=O)c1ccncc1CO Amb23559739 [0,2,0,0,0,0|2,0,0]=4 4309 B12R1.77 COc1ccccc1C(=O)CN Amb18971070 [0,2,0,0,0,0|2,0,0]=4 4310 B12R1.77 COc1ccccc1C(=O)CN Amb19373362 [0,2,0,0,0,0|2,0,0]=4 4311 B12R1.77 COc1ccccc1C(=O)CN Amb20668080 [0,2,0,0,0,0|2,0,0]=4 4312 B12R1.77 COc1ccccc1C(=O)NN Amb6409376 [0,2,0,0,0,0|1,0,0]=3 4313 B12R1.77 COc1ccccc1C(=O)NO Amb6266857 [0,2,0,0,0,0|2,0,0]=4 4314 B12R1.77 COc1ccccc1C(=S)NN Amb27862923 [0,2,0,0,0,0|1,1,0]=4 4315 B12R1.77 COc1cnccc1C(=O)NO Amb27258754 [0,2,0,0,0,0|1,0,0]=3 4316 B12R1.77 COc1ncccc1C(=O)NN Amb8999063 [0,2,0,0,0,0|2,0,0]=4 4317 B12R1.77 CSc1ccccc1C(=O)CN Amb25678790 [0,2,0,0,0,0|2,0,0]=4 4318 B12R1.77 CSc1ccccc1C(=O)NN Amb6384135 [0,2,0,0,0,0|1,0,0]=3 4319 B12R1.77 N#Cc1ccccc1C(=O)CN Amb28062456 [0,2,0,0,0,0|2,0,0]=4 4320 B12R1.77 N#Cc1cccnc1C(=O)NN Amb28189292 [0,2,0,0,0,0|2,0,0]=4 4321 B12R1.77 NCC(=O)c1ccccc1C=O Amb27482065 [0,2,0,0,0,0|2,0,0]=4 4322 B12R1.77 NCC(=O)c1ccccc1CF Amb27208556 [0,2,0,0,0,0|2,0,0]=4 4323 B12R1.77 NNC(=O)c1ccccc1CO Amb595556 [0,2,0,0,0,0|1,0,0]=3 4324 B12R1.77 NNC(=O)c1ccccc1CS Amb27790547 [0,2,0,0,0,0|1,0,0]=3 4325 B12R1.77 NNC(=O)c1cccnc1CO Amb28318002 [0,2,0,0,0,0|2,0,0]=4 4326 B12R1.77 NNC(=O)c1cccnc1CS Amb28280374 [0,2,0,0,0,0|2,0,0]=4 4327 B12R1.3441 C=C(CN)c1c(Cl)cncc1Cl Amb33413450 [0,2,0,0,0,0|2,0,0]=4 4328 B12R1.3441 C=C(CN)c1c(F)cncc1F Amb32880966 [0,2,0,0,0,0|2,0,0]=4 4329 B12R1.3441 C=CC(=O)c1c(Cl)cncc1Cl Amb33260962 [0,2,0,0,0,0|2,0,0]=4 4330 B12R1.3441 C=CC(=O)c1c(F)cncc1F Amb32882335 [0,2,0,0,0,0|2,0,0]=4 4331 B12R1.3441 CC(NN)c1c(F)cncc1F Amb35588911 [0,2,0,0,0,0|1,0,1]=4 4332 B12R1.3441 CCC(=O)c1c(Br)cncc1Br Amb27967906 [0,2,0,0,0,0|2,0,0]=4 4333 B12R1.3441 CCC(=O)c1c(F)cncc1F Amb35630156 [0,2,0,0,0,0|2,0,0]=4 4334 B12R1.3441 CNC(=O)c1c(C)cccc1N Amb1128205 [0,2,0,0,0,0|2,0,0]=4 4335 B12R1.3441 CNC(=O)c1c(C)cccc1O Amb27616909 [0,2,0,0,0,0|2,0,0]=4 4336 B12R1.3441 CNC(=O)c1c(Cl)cncc1Cl Amb27442916 [0,2,0,0,0,0|1,0,0]=3 4337 B12R1.3441 CNC(=O)c1c(F)cccc1Br Amb22135864 [0,2,0,0,0,0|2,0,0]=4 4338 B12R1.3441 CNC(=O)c1c(F)cccc1Cl Amb25892116 [0,2,0,0,0,0|2,0,0]=4 4339 B12R1.3441 CNC(=O)c1c(O)cccc1Br Amb27443066 [0,2,0,0,0,0|2,0,0]=4 4340 B12R1.3441 COC(=O)c1c(Br)cncc1Br Amb23401732 [0,2,0,0,0,0|2,0,0]=4 4341 B12R1.3441 COC(=O)c1c(C)cncc1Br Amb26929569 [0,2,0,0,0,0|2,0,0]=4 4342 B12R1.3441 COC(=O)c1c(C)cncc1Cl Amb26517450 [0,2,0,0,0,0|2,0,0]=4 4343 B12R1.3441 COC(=O)c1c(C)cncc1F Amb27844713 [0,2,0,0,0,0|2,0,0]=4 4344 B12R1.3441 COC(=O)c1c(C)cncc1N Amb26611589 [0,2,0,0,0,0|2,0,0]=4 4345 B12R1.3441 COC(=O)c1c(C)cncc1O Amb24573296 [0,2,0,0,0,0|2,0,0]=4 4346 B12R1.3441 COC(=O)c1c(Cl)cncc1Cl Amb20672052 [0,2,0,0,0,0|2,0,0]=4 4347 B12R1.3441 COC(=O)c1c(F)cncc1Br Amb22276050 [0,2,0,0,0,0|2,0,0]=4 4348 B12R1.3441 COC(=O)c1c(F)cncc1F Amb24545837 [0,2,0,0,0,0|2,0,0]=4 4349 B12R1.3441 COC(=O)c1c(F)cncc1I Amb28323523 [0,2,0,0,0,0|2,0,0]=4 4350 B12R1.3441 COC(=O)c1c(N)cncc1Br Amb25690484 [0,2,0,0,0,0|2,0,0]=4 4351 B12R1.3441 COC(=O)c1c(N)cncc1F Amb25970579 [0,2,0,0,0,0|2,0,0]=4 4352 B12R1.3441 COC(=O)c1c(O)cncc1Cl Amb26879947 [0,2,0,0,0,0|2,0,0]=4 4353 B12R1.3441 COC(=O)c1c(O)cncc1F Amb24743789 [0,2,0,0,0,0|2,0,0]=4 4354 B12R1.3441 Cc1cccc(C)c1C(=O)CN Amb25159806 [0,2,0,0,0,0|2,0,0]=4 4355 B12R1.3441 Cc1cccc(Cl)c1C(=O)CN Amb33259373 [0,2,0,0,0,0|2,0,0]=4 4356 B12R1.3441 Cc1cccc(F)c1C(=O)CN Amb25951936 [0,2,0,0,0,0|2,0,0]=4 4357 B12R1.3441 Cc1cccc(F)c1C(=O)NN Amb27494622 [0,2,0,0,0,0|1,0,0]=3 4358 B12R1.3441 NCC(=O)c1c(Cl)cccc1Br Amb25793810 [0,2,0,0,0,0|2,0,0]=4 4359 B12R1.3441 NCC(=O)c1c(Cl)cccc1Cl Amb27636278 [0,2,0,0,0,0|2,0,0]=4 4360 B12R1.3441 NCC(=O)c1c(Cl)cccc1Cl Amb28653048 [0,2,0,0,0,0|2,0,0]=4 4361 B12R1.3441 NCC(=O)c1c(Cl)cncc1Cl Amb33260871 [0,2,0,0,0,0|1,0,0]=3 4362 B12R1.3441 NCC(=O)c1c(F)cccc1Br Amb24392585 [0,2,0,0,0,0|2,0,0]=4 4363 B12R1.3441 NCC(=O)c1c(F)cccc1Cl Amb27616928 [0,2,0,0,0,0|2,0,0]=4 4364 B12R1.3441 NCC(=O)c1c(F)cccc1Cl Amb29083406 [0,2,0,0,0,0|2,0,0]=4 4365 B12R1.3441 NCC(=O)c1c(F)cccc1F Amb10839341 [0,2,0,0,0,0|2,0,0]=4 4366 B12R1.3441 NCC(=O)c1c(F)cccc1F Amb18951217 [0,2,0,0,0,0|2,0,0]=4 4367 B12R1.3441 NCC(=O)c1c(F)cncc1F Amb33267819 [0,2,0,0,0,0|1,0,0]=3 4368 B12R1.3441 NCC(=O)c1c(O)cccc1Br Amb33331516 [0,2,0,0,0,0|2,0,0]=4 4369 B12R1.3441 NCC(=O)c1c(O)cccc1Cl Amb26895061 [0,2,0,0,0,0|2,0,0]=4 4370 B12R1.3441 NNC(=O)c1c(Cl)cccc1Cl Amb6246157 [0,2,0,0,0,0|1,0,0]=3 4371 B12R1.3441 NNC(=O)c1c(F)cccc1Cl Amb6244999 [0,2,0,0,0,0|1,0,0]=3 4372 B12R1.3441 NNC(=O)c1c(F)cccc1F Amb2687056 [0,2,0,0,0,0|1,0,0]=3 4373 B12R1.3441 NNC(=O)c1c(F)cncc1F Amb25897109 [0,2,0,0,0,0|0,0,0]=2 4374 B12R1.3441 NNC(=O)c1c(N)cccc1Cl Amb28423410 [0,2,0,0,0,0|1,0,0]=3 4375 B12R1.3441 NNC(=O)c1c(O)cccc1Br Amb27242565 [0,2,0,0,0,0|1,0,0]=3 4376 B12R1.3441 N\N=C(/N)c1c(Br)cncc1Br Amb27658298 [0,2,0,0,0,0|1,0,1]=4 4377 B12R1.3441 Nc1cccc(Cl)c1C(=O)NO Amb27482591 [0,2,0,0,0,0|2,0,0]=4 4378 B12R1.3441 O=C(CCl)c1c(Cl)cncc1Cl Amb26356398 [0,2,0,0,0,0|2,0,0]=4 4379 B12R1.3441 O=C(CCl)c1c(F)cncc1F Amb24525731 [0,2,0,0,0,0|2,0,0]=4 4380 B12R1.3441 O=C(NO)c1c(F)cccc1Cl Amb6270497 [0,2,0,0,0,0|2,0,0]=4 4381 B12R1.3441 O=C(NO)c1c(F)cccc1F Amb6260503 [0,2,0,0,0,0|2,0,0]=4 4382 B12R1.3441 O=C(NO)c1c(F)cccc1I Amb27826973 [0,2,0,0,0,0|2,0,0]=4 4383 B12R1.3441 O=C(NO)c1c(O)cccc1F Amb24633395 [0,2,0,0,0,0|2,0,0]=4 4384 B10R1.2 C=Cc1ccnc(N)c1C Amb24479430 [0,0,1,1,0,0|2,0,0]=4 4385 B10R1.2 C=Cc1ccnc(N)c1Cl Amb27410180 [0,0,1,1,0,0|2,0,0]=4 4386 B10R1.2 C=Cc1ccnc(N)c1O Amb28068942 [0,0,1,1,0,0|1,0,1]=4 4387 B10R1.20 C=Cc1cccnc1NN Amb25132731 [0,0,1,1,0,0|2,0,0]=4 4388 B10R1.27 NNC(=O)Cc1ccno1 Amb27839379 [0,0,1,1,0,0|1,0,1]=4 4389 B10R1.27 NNC(=O)Cc1ccsc1 Amb2725959 [0,0,1,1,0,0|1,0,1]=4 4390 B10R1.27 NNC(=O)Cc1cncs1 Amb26008099 [0,0,1,1,0,0|1,0,1]=4 4391 B10R1.27 NNC(=O)Cn1ccnc1 Amb3692314 [0,0,1,1,0,0|1,0,1]=4 4392 B10R1.172 C=Cc1cccc(NN)n1 Amb27614948 [0,0,1,1,0,0|2,0,0]=4 4393 B10R2.6 c1cc(C2CN2)ccn1 Amb18221868 [1,0,0,1,0,0|1,0,1]=4 4394 B10R2.320 NC1=Cc2ccccc21 Amb26390616 [1,0,0,1,0,0|2,0,0]=4 4395 B10R2.320 O=C1Cc2ccccc21 Amb8395940 [1,0,0,1,0,0|2,0,0]=4 4396 B10R2.320 O=C1Nc2ccccc21 Amb28436763 [1,0,0,1,0,0|1,0,0]=3 4397 B10R2.7 C1=CC2=CCN=C2C=N1 Amb27423395 [1,0,0,1,0,0|1,0,1]=4 4398 B10R2.7 c1cc2c(cn1)CNC2 Amb10067652 [1,0,0,1,0,0|1,0,1]=4 4399 B10R2.7 c1cc2c(cn1)CNC2 Amb20242101 [1,0,0,1,0,0|1,0,1]=4 4400 B10R2.7 c1cc2c(cn1)CNC2 Amb2696535 [1,0,0,1,0,0|1,0,1]=4 4401 B10R2.7 c1cc2c(cn1)NCC2 Amb19516033 [1,0,0,1,0,0|1,0,1]=4 4402 B10R2.7 c1cc2c(cn1)NCC2 Amb22495003 [1,0,0,1,0,0|1,0,1]=4 4403 B10R2.7 c1cc2c(cn1)NCC2 Amb23412122 [1,0,0,1,0,0|1,0,1]=4 4404 B10R2.7 c1cc2ccoc2cn1 Amb10067356 [1,0,0,1,0,0|2,0,0]=4 4405 B10R2.7 c1cc2ccsc2cn1 Amb10067355 [1,0,0,1,0,0|2,0,0]=4 4406 B10R2.7 c1cc2ccsc2cn1 Amb24066968 [1,0,0,1,0,0|2,0,0]=4 4407 B10R2.7 c1ccc2c(c1)CNN2 Amb8386538 [1,0,0,1,0,0|1,0,1]=4 4408 B10R2.32 O=C1CNc2ccoc21 Amb18832975 [0,0,0,1,1,0|2,0,0]=4 4409 B10R2.32 O=C1CNc2ccsc21 Amb18202968 [0,0,0,1,1,0|2,0,0]=4 4410 B10R2.32 O=C1CNc2cocc21 Amb18832972 [0,0,0,1,1,0|2,0,0]=4 4411 B10R2.32 O=C1CNc2cscc21 Amb18202966 [0,0,0,1,1,0|2,0,0]=4 4412 B10R2.32 O=C1CNc2occc21 Amb18832976 [0,0,0,1,1,0|2,0,0]=4 4413 B10R2.32 O=C1CNc2sccc21 Amb18202969 [0,0,0,1,1,0|2,0,0]=4 4414 B10R2.32 O=C1NCc2ccoc21 Amb18832974 [0,0,0,1,1,0|2,0,0]=4 4415 B10R2.32 O=C1NCc2ccsc21 Amb18202967 [0,0,0,1,1,0|2,0,0]=4 4416 B10R2.32 O=C1NCc2nccn21 Amb18832967 [0,0,0,1,1,0|2,0,0]=4 4417 B10R2.32 O=C1NCc2occc21 Amb28367896 [0,0,0,1,1,0|2,0,0]=4 4418 B10R2.32 O=C1NCc2oncc21 Amb18203329 [0,0,0,1,1,0|2,0,0]=4 4419 B10R2.32 O=C1NNc2sccc21 Amb28061946 [0,0,0,1,1,0|1,0,0]=3 4420 B12R2.18 CN1C(=O)Cc2ccccc21 Amb1398903 [0,0,0,1,0,1|2,0,0]=4 4421 B12R2.18 CN1C(=O)Cc2ccncc21 Amb22491400 [0,0,0,1,0,1|1,0,0]=3 4422 B12R2.18 CN1C(=O)Nc2ccccc21 Amb18537193 [0,0,0,1,0,1|2,0,0]=4 4423 B12R2.18 CN1C(=O)Nc2ncncc21 Amb24486109 [0,0,0,1,0,1|2,0,0]=4 4424 B12R2.18 CN1C(=O)Oc2ccccc21 Amb18043105 [0,0,0,1,0,1|2,0,0]=4 4425 B12R2.18 CN1C(=O)Sc2ccccc21 Amb19654015 [0,0,0,1,0,1|2,0,0]=4 4426 B12R2.18 Cc1cc2ccccc2n1N Amb28457281 [0,0,0,1,0,1|2,0,0]=4 4427 B12R2.18 Cc1nc2ccccc2n1N Amb1156070 [0,0,0,1,0,1|2,0,0]=4 4428 B12R2.18 Cc1nc2ccncc2n1C Amb23401208 [0,0,0,1,0,1|2,0,0]=4 4429 B12R2.18 Cn1c(Cl)nc2ccncc21 Amb24645747 [0,0,0,1,0,1|2,0,0]=4 4430 B12R2.18 Cn1c(N)nc2ccncc21 Amb24709348 [0,0,0,1,0,1|2,0,0]=4 4431 B12R2.18 Cn1c(S)nc2ccncc21 Amb27216589 [0,0,0,1,0,1|1,1,0]=4 4432 B12R2.18 NC1C(=O)Cc2ccccc21 Amb25949607 [0,0,0,1,0,1|2,0,0]=4 4433 B12R2.18 NC1C(=O)Cc2ccccc21 Amb35788430 [0,0,0,1,0,1|2,0,0]=4 4434 B12R2.18 NC1C(=O)Nc2ccccc21 Amb1154822 [0,0,0,1,0,1|2,0,0]=4 4435 B12R2.18 NC1C(=O)Nc2ccccc21 Amb9745696 [0,0,0,1,0,1|2,0,0]=4 4436 B12R2.18 NC1C(=O)Oc2ccccc21 Amb28240356 [0,0,0,1,0,1|2,0,0]=4 4437 B12R2.18 NN1C(=O)Cc2ccccc21 Amb10560115 [0,0,0,1,0,1|1,0,0]=3 4438 B12R2.18 NN1C(=O)Oc2ccccc21 Amb18644412 [0,0,0,1,0,1|1,0,0]=3 4439 B12R2.18 N[C@@H]1C(=O)Cc2ccccc21 Amb27202727 [0,0,0,1,0,1|2,0,0]=4 4440 B12R2.18 Nc1nc2ccccc2n1N Amb1147317 [0,0,0,1,0,1|2,0,0]=4 4441 B12R2.18 Nn1c(Cl)nc2ccccc21 Amb1082479 [0,0,0,1,0,1|2,0,0]=4 4442 B12R2.18 O=C1Cc2ccccc2N1O Amb17940424 [0,0,0,1,0,1|2,0,0]=4 4443 B12R2.18 O=C1Nc2ccccc2N1O Amb26332921 [0,0,0,1,0,1|2,0,0]=4 4444 B12R2.23 O=C1CCC1c2ccncc2 Amb27470068 [0,0,0,1,0,1|2,0,0]=4 4445 B12R2.23 O=C1NCC1c2ccccc2 Amb614326 [0,0,0,1,0,1|2,0,0]=4 4446 B12R2.24 NC1=Nc2ccccc2NN1 Amb27846252 [0,0,0,1,0,1|2,0,0]=4 4447 B12R2.24 NC1=Nc2ccncc2NN1 Amb27881600 [0,0,0,1,0,1|1,0,0]=3 4448 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [0,0,0,1,0,1|2,0,0]=4 4449 B12R2.24 O=C1C=C2C=CC=CC2=NN1 Amb21864850 [0,0,0,1,0,1|1,0,1]=4 4450 B12R2.24 O=C1C=Cc2cnccc2N1 Amb21618693 [0,0,0,1,0,1|2,0,0]=4 4451 B12R2.24 O=C1CCc2cnccc2N1 Amb22899719 [0,0,0,1,0,1|2,0,0]=4 4452 B12R2.24 O=C1CNc2ccccc2C1 Amb18202302 [0,0,0,1,0,1|2,0,0]=4 4453 B12R2.24 O=C1CNc2ccccc2N1 Amb6355388 [0,0,0,1,0,1|2,0,0]=4 4454 B12R2.24 O=C1CNc2ccccc2O1 Amb22166855 [0,0,0,1,0,1|2,0,0]=4 4455 B12R2.24 O=C1CNc2cnccc2N1 Amb18202157 [0,0,0,1,0,1|1,0,0]=3 4456 B12R2.24 O=C1COc2cnccc2N1 Amb22899221 [0,0,0,1,0,1|2,0,0]=4 4457 B12R2.24 O=C1Cc2ccccc2CN1 Amb33544470 [0,0,0,1,0,1|2,0,0]=4 4458 B12R2.24 O=C1Cc2ccncc2CN1 Amb25760054 [0,0,0,1,0,1|1,0,0]=3 4459 B12R2.24 O=C1NCc2ccccc2O1 Amb27468708 [0,0,0,1,0,1|2,0,0]=4 4460 B12R2.24 O=C1Nc2ccncc2CO1 Amb33625067 [0,0,0,1,0,1|2,0,0]=4 4461 B12R2.32 NCc1cc2ccncc2s1 Amb25342219 [0,0,0,1,0,1|1,1,0]=4 4462 B12R2.32 NCc1cc2cnccc2o1 Amb18831393 [0,0,0,1,0,1|2,0,0]=4 4463 B12R2.32 NCc1cc2cnccc2o1 Amb30584705 [0,0,0,1,0,1|2,0,0]=4 4464 B12R2.32 NCc1nc2ccncc2o1 Amb18202161 [0,0,0,1,0,1|1,0,1]=4 4465 B12R2.32 NCc1nc2cnccc2o1 Amb22737763 [0,0,0,1,0,1|2,0,0]=4 4466 B12R2.32 NCc1nc2cnccc2s1 Amb18828257 [0,0,0,1,0,1|2,0,0]=4 4467 B12R2.32 NCc1nc2cnccc2s1 Amb32670756 [0,0,0,1,0,1|2,0,0]=4 4468 B12R2.32 NNc1nc2ccccc2o1 Amb1148180 [0,0,0,1,0,1|1,0,1]=4 4469 B12R2.32 NNc1nc2ccccc2s1 Amb1101127 [0,0,0,1,0,1|1,1,0]=4 4470 B12R2.32 NNc1nc2ccncc2s1 Amb18126451 [0,0,0,1,0,1|0,1,0]=3 4471 B12R2.32 NNc1nc2cnccc2o1 Amb24126269 [0,0,0,1,0,1|1,0,0]=3 4472 B12R2.32 NNc1nc2cnccc2s1 Amb22756441 [0,0,0,1,0,1|1,0,0]=3 4473 B12R2.1 NCc1noc2cnccc12 Amb27186370 [0,1,0,1,0,0|1,0,1]=4 4474 B12R2.1 NNc1coc2ccccc12 Amb35704215 [0,1,0,1,0,0|1,0,1]=4 4475 B12R2.1 NNc1nsc2ccccc12 Amb1115216 [0,1,0,1,0,0|1,1,0]=4 4476 B12R2.1 NNc1snc2ccccc12 Amb27664497 [0,1,0,1,0,0|1,1,0]=4 4477 B12R2.1 O=Cc1coc2cnccc12 Amb22495092 [0,1,0,1,0,0|2,0,0]=4 4478 B12R2.1 O=Cc1csc2cnccc12 Amb18135843 [0,1,0,1,0,0|2,0,0]=4 4479 B12R2.2 c1cc(C2=NCCN2)ccn1 Amb7968845 [0,1,0,1,0,0|2,0,0]=4 4480 B12R2.2047 CCN1C(=O)c2ccccc21 Amb27265881 [0,1,0,1,0,0|2,0,0]=4 4481 B12R2.1081 O=C1C=CNc2ccccc21 Amb18369085 [0,1,0,1,0,0|2,0,0]=4 4482 B12R2.1081 O=C1C=CNc2cnccc21 Amb22055906 [0,1,0,1,0,0|1,0,0]=3 4483 B12R2.1081 O=C1C=COc2cnccc21 Amb33484174 [0,1,0,1,0,0|2,0,0]=4 4484 B12R2.1081 O=C1C=NNc2ccccc21 Amb18528334 [0,1,0,1,0,0|1,0,1]=4 4485 B12R2.1081 O=C1CCCc2cnccc21 Amb10603887 [0,1,0,1,0,0|2,0,0]=4 4486 B12R2.1081 O=C1CCCc2cnccc21 Amb20621086 [0,1,0,1,0,0|2,0,0]=4 4487 B12R2.1081 O=C1CCNc2ccccc21 Amb2699611 [0,1,0,1,0,0|2,0,0]=4 4488 B12R2.1081 O=C1CCNc2ccccc21 Amb33542509 [0,1,0,1,0,0|2,0,0]=4 4489 B12R2.1081 O=C1CCOc2cnccc21 Amb33742663 [0,1,0,1,0,0|2,0,0]=4 4490 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [0,1,0,1,0,0|2,0,0]=4 4491 B12R2.1081 O=C1CNCc2ccccc21 Amb9783330 [0,1,0,1,0,0|2,0,0]=4 4492 B12R2.1081 O=C1CNNc2ccccc21 Amb22057606 [0,1,0,1,0,0|1,0,0]=3 4493 B12R2.1081 O=C1CNNc2ccccc21 Amb22494235 [0,1,0,1,0,0|1,0,0]=3 4494 B12R2.1081 O=C1CSCc2cnccc21 Amb27974060 [0,1,0,1,0,0|2,0,0]=4 4495 B12R2.1081 O=C1N=NNc2ccccc21 Amb19653630 [0,1,0,1,0,0|1,0,1]=4 4496 B12R2.1081 O=C1NC=Cc2ccccc21 Amb18364338 [0,1,0,1,0,0|2,0,0]=4 4497 B12R2.1081 O=C1NC=Cc2cnccc21 Amb20241097 [0,1,0,1,0,0|1,0,0]=3 4498 B12R2.1081 O=C1NC=Cc2cnncc21 Amb27170657 [0,1,0,1,0,0|2,0,0]=4 4499 B12R2.1081 O=C1NC=Nc2ccccc21 Amb18012662 [0,1,0,1,0,0|1,0,1]=4 4500 B12R2.1081 O=C1NC=Nc2cnccc21 Amb19957554 [0,1,0,1,0,0|0,0,1]=3 4501 B12R2.1081 O=C1NC=Nc2cnncc21 Amb27760126 [0,1,0,1,0,0|1,0,1]=4 4502 B12R2.1081 O=C1NC=Nc2nnccc21 Amb22388525 [0,1,0,1,0,0|1,0,1]=4 4503 B12R2.1081 O=C1NCCc2ccccc21 Amb2502473 [0,1,0,1,0,0|2,0,0]=4 4504 B12R2.1081 O=C1NCNc2ccncc21 Amb24419756 [0,1,0,1,0,0|2,0,0]=4 4505 B12R2.1081 O=C1NCSc2ccccc21 Amb27646438 [0,1,0,1,0,0|2,0,0]=4 4506 B12R2.1081 O=C1NN=Cc2ccccc21 Amb19338634 [0,1,0,1,0,0|1,0,1]=4 4507 B12R2.1081 O=C1NN=Cc2cnccc21 Amb23557709 [0,1,0,1,0,0|0,0,1]=3 4508 B12R2.1081 O=C1NN=Nc2ccccc21 Amb17933278 [0,1,0,1,0,0|1,0,1]=4 4509 B12R2.1081 O=C1NNCc2ccccc21 Amb27215032 [0,1,0,1,0,0|1,0,0]=3 4510 B12R2.1081 O=C1NNCc2ccccc21 Amb33482996 [0,1,0,1,0,0|1,0,0]=3 4511 B12R2.1081 O=C1NNCc2ncccc21 Amb27823289 [0,1,0,1,0,0|2,0,0]=4 4512 B12R2.1081 O=C1NOCc2ccccc21 Amb26878656 [0,1,0,1,0,0|2,0,0]=4 4513 B12R2.1081 O=C1OCCc2cnccc21 Amb27879707 [0,1,0,1,0,0|2,0,0]=4 4514 B12R2.1081 OC1=CNNc2ccccc21 Amb22057612 [0,1,0,1,0,0|1,0,1]=4 4515 B12R2.2028 C=C1NC(=O)c2ccccc21 Amb27487451 [0,1,0,1,0,0|2,0,0]=4 4516 B12R2.2028 CC1NC(=O)c2ccccc21 Amb24104648 [0,1,0,1,0,0|2,0,0]=4 4517 B12R2.2028 CN1NC(=O)c2ccccc21 Amb22372319 [0,1,0,1,0,0|1,0,0]=3 4518 B12R2.2028 CN1NC(=O)c2cccnc21 Amb19314984 [0,1,0,1,0,0|2,0,0]=4 4519 B12R2.2028 CN1NC(=S)c2ccccc21 Amb26952885 [0,1,0,1,0,0|1,1,0]=4 4520 B12R2.2028 CN1SC(=O)c2ccccc21 Amb19664923 [0,1,0,1,0,0|2,0,0]=4 4521 B12R2.2028 Cc1nn(C)c2cnccc12 Amb22741024 [0,1,0,1,0,0|1,0,1]=4 4522 B12R2.2028 Cc1nn(N)c2ccccc12 Amb27859143 [0,1,0,1,0,0|2,0,0]=4 4523 B12R2.2028 Cn1cc(Br)c2ccncc21 Amb18175861 [0,1,0,1,0,0|2,0,0]=4 4524 B12R2.2028 Cn1cc(I)c2ccncc21 Amb25253751 [0,1,0,1,0,0|2,0,0]=4 4525 B12R2.2028 Cn1nc(N)c2ccncc21 Amb26416478 [0,1,0,1,0,0|1,0,1]=4 4526 B12R2.2028 Cn1nc(O)c2ccncc21 Amb25217262 [0,1,0,1,0,0|0,0,2]=4 4527 B12R2.2028 N=C1NC(=O)c2ccccc21 Amb21811514 [0,1,0,1,0,0|1,0,1]=4 4528 B12R2.2028 NC1=NC(=O)c2ccccc21 Amb6252622 [0,1,0,1,0,0|1,0,1]=4 4529 B12R2.2028 NC1CC(=O)c2ccccc21 Amb17470381 [0,1,0,1,0,0|2,0,0]=4 4530 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,1,0,1,0,0|2,0,0]=4 4531 B12R2.2028 NC1NC(=O)c2ccccc21 Amb22372261 [0,1,0,1,0,0|1,0,0]=3 4532 B12R2.2028 N[C@@H]1CC(=O)c2ccccc21 Amb27655630 [0,1,0,1,0,0|2,0,0]=4 4533 B12R2.2028 Nc1sc(N)c2cnccc12 Amb24435071 [0,1,0,1,0,0|2,0,0]=4 4534 B12R2.2028 O=C1NC(=O)c2ccccc21 Amb1934252 [0,1,0,1,0,0|2,0,0]=4 4535 B12R2.2028 O=C1NC(=O)c2ccccc21 Amb33868500 [0,1,0,1,0,0|2,0,0]=4 4536 B12R2.2028 O=C1NC(=O)c2cnccc21 Amb2609991 [0,1,0,1,0,0|1,0,0]=3 4537 B12R2.2028 O=C1NC(F)c2ccccc21 Amb27165216 [0,1,0,1,0,0|2,0,0]=4 4538 B12R2.2028 O=C1NC(O)c2ccccc21 Amb17593710 [0,1,0,1,0,0|2,0,0]=4 4539 B12R2.2028 O=C1OC(=O)c2cnccc21 Amb2609992 [0,1,0,1,0,0|2,0,0]=4 4540 B12R2.2028 O=C1OC(O)c2cnccc21 Amb24426049 [0,1,0,1,0,0|2,0,0]=4 4541 B12R2.2075 O=C(c1ccncc1)C2CC2 Amb23454989 [0,1,0,1,0,0|2,0,0]=4 4542 B12R2.2075 O=C(c1ccncc1)N2CC2 Amb28045530 [0,1,0,1,0,0|1,0,0]=3 4543 B12R2.612 Cc1ccc2c(c1)CNC2=O Amb20248676 [0,1,0,1,0,0|2,0,0]=4 4544 B12R2.612 Cc1ccc2c(c1)SNC2=O Amb26942754 [0,1,0,1,0,0|2,0,0]=4 4545 B12R2.612 Cc1ccc2c(n1)NNC2=O Amb24432148 [0,1,0,1,0,0|2,0,0]=4 4546 B12R2.612 N=C1C=CC2=C(N)NNC2=C1 Amb24392472 [0,1,0,1,0,0|2,0,0]=4 4547 B12R2.612 Nc1ccc2c(c1)CNC2=O Amb16233788 [0,1,0,1,0,0|2,0,0]=4 4548 B12R2.612 Nc1ccc2c(c1)NNC2=O Amb21964765 [0,1,0,1,0,0|1,0,0]=3 4549 B12R2.612 Nc1ccc2c(c1)NNC2=O Amb22008653 [0,1,0,1,0,0|1,0,0]=3 4550 B12R2.612 Nc1ccc2c(c1)NOC2=O Amb27404538 [0,1,0,1,0,0|2,0,0]=4 4551 B12R2.612 Nc1ccc2c(c1)ONC2=O Amb28399452 [0,1,0,1,0,0|2,0,0]=4 4552 B12R2.612 Nc1ccc2c(c1)SNC2=O Amb33548429 [0,1,0,1,0,0|2,0,0]=4 4553 B12R2.612 O=C1C=CC2=C(NNC2=O)O1 Amb24595650 [0,1,0,1,0,0|2,0,0]=4 4554 B12R2.612 O=C1CNc2cc(Br)ccc21 Amb27623314 [0,1,0,1,0,0|2,0,0]=4 4555 B12R2.612 O=C1NCc2cc(Br)ccc21 Amb10602848 [0,1,0,1,0,0|2,0,0]=4 4556 B12R2.612 O=C1NCc2cc(Cl)ccc21 Amb13883708 [0,1,0,1,0,0|2,0,0]=4 4557 B12R2.612 O=C1NCc2cc(F)ccc21 Amb22371476 [0,1,0,1,0,0|2,0,0]=4 4558 B12R2.612 O=C1NCc2cc(F)ccc21 Amb33716954 [0,1,0,1,0,0|2,0,0]=4 4559 B12R2.612 O=C1NCc2cc(I)ccc21 Amb21963157 [0,1,0,1,0,0|2,0,0]=4 4560 B12R2.612 O=C1NCc2cc(O)ccc21 Amb21857015 [0,1,0,1,0,0|2,0,0]=4 4561 B12R2.612 O=C1NNc2cc(Cl)ccc21 Amb22491677 [0,1,0,1,0,0|1,0,0]=3 4562 B12R2.612 O=C1NNc2cc(Cl)ncc21 Amb25312441 [0,1,0,1,0,0|2,0,0]=4 4563 B12R2.612 O=C1NNc2cc(F)ccc21 Amb21864861 [0,1,0,1,0,0|1,0,0]=3 4564 B12R2.612 O=C1NOc2cc(Br)ccc21 Amb21856452 [0,1,0,1,0,0|2,0,0]=4 4565 B12R2.612 O=C1NOc2cc(Cl)ccc21 Amb22015207 [0,1,0,1,0,0|2,0,0]=4 4566 B12R2.612 O=C1NOc2cc(O)ccc21 Amb24427281 [0,1,0,1,0,0|2,0,0]=4 4567 B12R2.612 O=C1NSc2cc(Br)ccc21 Amb25863424 [0,1,0,1,0,0|2,0,0]=4 4568 B12R2.612 O=C1NSc2cc(Cl)ccc21 Amb19131195 [0,1,0,1,0,0|2,0,0]=4 4569 B12R2.612 O=C1NSc2cc(F)ccc21 Amb17933791 [0,1,0,1,0,0|2,0,0]=4 4570 B12R2.612 O=C1ONc2cc(Cl)ccc21 Amb26858350 [0,1,0,1,0,0|2,0,0]=4 4571 B12R2.612 O=C1ONc2cc(F)ccc21 Amb27488717 [0,1,0,1,0,0|2,0,0]=4 4572 B12R2.612 O=C1SNc2cc(F)ccc21 Amb32673866 [0,1,0,1,0,0|2,0,0]=4 4573 B12R2.132 Cc1cc2c(cn1)OCC2=O Amb22728381 [0,1,0,1,0,0|2,0,0]=4 4574 B12R2.132 Cc1ccc2c(c1)C(=O)CN2 Amb18202305 [0,1,0,1,0,0|2,0,0]=4 4575 B12R2.132 Cc1ccc2c(c1)C(=O)NC2 Amb19517084 [0,1,0,1,0,0|2,0,0]=4 4576 B12R2.132 Cc1ccc2c(c1)C(=O)NN2 Amb19748512 [0,1,0,1,0,0|1,0,0]=3 4577 B12R2.132 Cc1ccc2c(c1)C(=O)SN2 Amb32673864 [0,1,0,1,0,0|2,0,0]=4 4578 B12R2.132 Cc1cnc2c(c1)C(=O)NN2 Amb27209989 [0,1,0,1,0,0|2,0,0]=4 4579 B12R2.132 Nc1cc2c(cn1)CNC2=O Amb28051675 [0,1,0,1,0,0|1,0,0]=3 4580 B12R2.132 Nc1ccc2c(c1)C(=O)CN2 Amb27963196 [0,1,0,1,0,0|2,0,0]=4 4581 B12R2.132 Nc1ccc2c(c1)C(=O)NC2 Amb9490509 [0,1,0,1,0,0|2,0,0]=4 4582 B12R2.132 Nc1ccc2c(c1)C(=O)NN2 Amb21959377 [0,1,0,1,0,0|1,0,0]=3 4583 B12R2.132 Nc1ccc2c(c1)C(=O)NO2 Amb21963754 [0,1,0,1,0,0|2,0,0]=4 4584 B12R2.132 Nc1ncc2c(n1)C(=O)NC2 Amb18201983 [0,1,0,1,0,0|2,0,0]=4 4585 B12R2.132 O=C1CCc2cnc(Cl)cc21 Amb27480692 [0,1,0,1,0,0|2,0,0]=4 4586 B12R2.132 O=C1CNc2ccc(Br)cc21 Amb18772113 [0,1,0,1,0,0|2,0,0]=4 4587 B12R2.132 O=C1CNc2ccc(F)cc21 Amb18831267 [0,1,0,1,0,0|2,0,0]=4 4588 B12R2.132 O=C1COc2cnc(Cl)cc21 Amb25189287 [0,1,0,1,0,0|2,0,0]=4 4589 B12R2.132 O=C1NCc2ccc(Br)cc21 Amb19516102 [0,1,0,1,0,0|2,0,0]=4 4590 B12R2.132 O=C1NCc2ccc(Cl)cc21 Amb20241173 [0,1,0,1,0,0|2,0,0]=4 4591 B12R2.132 O=C1NCc2ccc(F)cc21 Amb20171614 [0,1,0,1,0,0|2,0,0]=4 4592 B12R2.132 O=C1NCc2ccc(I)cc21 Amb21963095 [0,1,0,1,0,0|2,0,0]=4 4593 B12R2.132 O=C1NCc2ccc(O)cc21 Amb15690702 [0,1,0,1,0,0|2,0,0]=4 4594 B12R2.132 O=C1NCc2cnc(Cl)cc21 Amb25859073 [0,1,0,1,0,0|1,0,0]=3 4595 B12R2.132 O=C1NNc2cc[n+]([O-])cc21 Amb28437152 [0,1,0,1,0,0|2,0,0]=4 4596 B12R2.132 O=C1NNc2ccc(Br)cc21 Amb22008691 [0,1,0,1,0,0|1,0,0]=3 4597 B12R2.132 O=C1NNc2ccc(Cl)cc21 Amb20460273 [0,1,0,1,0,0|1,0,0]=3 4598 B12R2.132 O=C1NNc2ncc(Br)cc21 Amb19514957 [0,1,0,1,0,0|2,0,0]=4 4599 B12R2.132 O=C1NOc2ccc(Br)cc21 Amb21858197 [0,1,0,1,0,0|2,0,0]=4 4600 B12R2.132 O=C1NOc2ccc(F)cc21 Amb21857209 [0,1,0,1,0,0|2,0,0]=4 4601 B12R2.132 O=C1NOc2ccc(O)cc21 Amb24440443 [0,1,0,1,0,0|2,0,0]=4 4602 B12R2.132 O=C1NSc2ccc(Br)cc21 Amb24628235 [0,1,0,1,0,0|2,0,0]=4 4603 B12R2.132 O=C1NSc2ccc(Cl)cc21 Amb19131194 [0,1,0,1,0,0|2,0,0]=4 4604 B12R2.132 O=C1NSc2ccc(F)cc21 Amb24372116 [0,1,0,1,0,0|2,0,0]=4 4605 B12R2.132 O=C1ONc2ccc(Br)cc21 Amb28119155 [0,1,0,1,0,0|2,0,0]=4 4606 B12R2.132 O=C1ONc2ccc(Cl)cc21 Amb22263320 [0,1,0,1,0,0|2,0,0]=4 4607 B12R2.132 O=C1ONc2ccc(F)cc21 Amb26974015 [0,1,0,1,0,0|2,0,0]=4 4608 B12R2.132 O=C1SNc2ccc(F)cc21 Amb32673853 [0,1,0,1,0,0|2,0,0]=4 4609 B12R2.196 Cc1cccc2c1CNC2=O Amb22229850 [0,1,0,1,0,0|2,0,0]=4 4610 B12R2.196 Cc1cccc2c1NCC2=O Amb18831418 [0,1,0,1,0,0|2,0,0]=4 4611 B12R2.196 Cc1cccc2c1NSC2=O Amb32673862 [0,1,0,1,0,0|2,0,0]=4 4612 B12R2.196 Cc1cccc2c1ONC2=O Amb21857149 [0,1,0,1,0,0|2,0,0]=4 4613 B12R2.196 Cc1cccc2c1SNC2=O Amb27966170 [0,1,0,1,0,0|2,0,0]=4 4614 B12R2.196 Cc1nccc2c1OCC2=O Amb27228818 [0,1,0,1,0,0|2,0,0]=4 4615 B12R2.196 Nc1cccc2c1CNC2=O Amb9677786 [0,1,0,1,0,0|2,0,0]=4 4616 B12R2.196 Nc1nccc2c1CNC2=O Amb18831351 [0,1,0,1,0,0|1,0,0]=3 4617 B12R2.196 O=C1CNc2c(F)cccc21 Amb18201774 [0,1,0,1,0,0|2,0,0]=4 4618 B12R2.196 O=C1NCc2c(Br)cccc21 Amb15693064 [0,1,0,1,0,0|2,0,0]=4 4619 B12R2.196 O=C1NCc2c(Cl)cccc21 Amb21858351 [0,1,0,1,0,0|2,0,0]=4 4620 B12R2.196 O=C1NCc2c(F)cccc21 Amb22008629 [0,1,0,1,0,0|2,0,0]=4 4621 B12R2.196 O=C1NCc2c(O)cccc21 Amb21858279 [0,1,0,1,0,0|2,0,0]=4 4622 B12R2.196 O=C1NCc2c1ccnc2Cl Amb27476367 [0,1,0,1,0,0|1,0,0]=3 4623 B12R2.196 O=C1NNc2c(Br)cccc21 Amb22170435 [0,1,0,1,0,0|1,0,0]=3 4624 B12R2.196 O=C1NNc2c(F)cccc21 Amb22738649 [0,1,0,1,0,0|1,0,0]=3 4625 B12R2.196 O=C1NOc2c(Cl)cccc21 Amb22489850 [0,1,0,1,0,0|2,0,0]=4 4626 B12R2.196 O=C1NOc2c(F)cccc21 Amb21857207 [0,1,0,1,0,0|2,0,0]=4 4627 B12R2.196 O=C1NOc2c(I)cccc21 Amb27813751 [0,1,0,1,0,0|2,0,0]=4 4628 B12R2.196 O=C1NSc2c(Br)cccc21 Amb32710021 [0,1,0,1,0,0|2,0,0]=4 4629 B12R2.196 O=C1NSc2c(Cl)cccc21 Amb26570552 [0,1,0,1,0,0|2,0,0]=4 4630 B12R2.196 O=C1NSc2c(F)cccc21 Amb27670276 [0,1,0,1,0,0|2,0,0]=4 4631 B12R2.196 O=C1SNc2c(F)cccc21 Amb32673867 [0,1,0,1,0,0|2,0,0]=4 4632 B12R2.203 Cc1cccc2c1C(=N)NN2 Amb24413143 [0,1,0,1,0,0|2,0,0]=4 4633 B12R2.203 Cc1cccc2c1C(=O)NC2 Amb22230158 [0,1,0,1,0,0|2,0,0]=4 4634 B12R2.203 Cc1cccc2c1C(=O)SN2 Amb32673870 [0,1,0,1,0,0|2,0,0]=4 4635 B12R2.203 Cc1ccnc2c1C(=O)NN2 Amb22494155 [0,1,0,1,0,0|2,0,0]=4 4636 B12R2.203 Nc1cccc2c1C(=O)NC2 Amb2372743 [0,1,0,1,0,0|2,0,0]=4 4637 B12R2.203 O=C1CCc2cncc(Br)c21 Amb28284910 [0,1,0,1,0,0|2,0,0]=4 4638 B12R2.203 O=C1COc2cncc(Cl)c21 Amb28059960 [0,1,0,1,0,0|2,0,0]=4 4639 B12R2.203 O=C1NCc2cccc(Br)c21 Amb21858350 [0,1,0,1,0,0|2,0,0]=4 4640 B12R2.203 O=C1NCc2cccc(Cl)c21 Amb21963125 [0,1,0,1,0,0|2,0,0]=4 4641 B12R2.203 O=C1NCc2cccc(F)c21 Amb23401773 [0,1,0,1,0,0|2,0,0]=4 4642 B12R2.203 O=C1NCc2cccc(I)c21 Amb21963325 [0,1,0,1,0,0|2,0,0]=4 4643 B12R2.203 O=C1NCc2cccc(O)c21 Amb22008617 [0,1,0,1,0,0|2,0,0]=4 4644 B12R2.203 O=C1NN=C2C=NC=C(Cl)N12 Amb20668233 [0,1,0,1,0,0|1,0,1]=4 4645 B12R2.203 O=C1NNc2cccc(Br)c21 Amb22497381 [0,1,0,1,0,0|1,0,0]=3 4646 B12R2.203 O=C1NNc2cccc(Cl)c21 Amb19373186 [0,1,0,1,0,0|1,0,0]=3 4647 B12R2.203 O=C1NOc2cccc(Br)c21 Amb22494926 [0,1,0,1,0,0|2,0,0]=4 4648 B12R2.203 O=C1NOc2cccc(F)c21 Amb21857210 [0,1,0,1,0,0|2,0,0]=4 4649 B12R2.203 O=C1NSc2cccc(Br)c21 Amb32710018 [0,1,0,1,0,0|2,0,0]=4 4650 B12R2.203 O=C1NSc2cccc(Cl)c21 Amb27445101 [0,1,0,1,0,0|2,0,0]=4 4651 B12R2.203 O=C1NSc2cccc(F)c21 Amb24756929 [0,1,0,1,0,0|2,0,0]=4 4652 B12R2.203 O=C1ONc2cccc(F)c21 Amb27840267 [0,1,0,1,0,0|2,0,0]=4 4653 B8R1.7 CC(=O)C1=C[CH-]C=C1 Amb2227554 [1,0,0,0,1,0|1,0,1]=4 4654 B8R1.7 CC(=O)[c-]1cccc1 Amb34916050 [1,0,0,0,1,0|1,0,1]=4 4655 B8R1.7 CC(=O)c1cc[se]c1 Amb2611517 [1,0,0,0,1,0|2,0,0]=4 4656 B8R1.7 CC(=O)c1ccc[se]1 Amb17673999 [1,0,0,0,1,0|2,0,0]=4 4657 B8R1.7 CC(=O)c1ccco1 Amb2782007 [1,0,0,0,1,0|2,0,0]=4 4658 B8R1.7 CC(=O)c1cccs1 Amb2684284 [1,0,0,0,1,0|2,0,0]=4 4659 B8R1.7 CC(=O)c1ccno1 Amb20242198 [1,0,0,0,1,0|2,0,0]=4 4660 B8R1.7 CC(=O)c1ccns1 Amb13883508 [1,0,0,0,1,0|2,0,0]=4 4661 B8R1.7 CC(=O)c1ccoc1 Amb2440799 [1,0,0,0,1,0|2,0,0]=4 4662 B8R1.7 CC(=O)c1ccsc1 Amb535812 [1,0,0,0,1,0|2,0,0]=4 4663 B8R1.7 CC(=O)c1cnco1 Amb24737064 [1,0,0,0,1,0|2,0,0]=4 4664 B8R1.7 CC(=O)c1cncs1 Amb33531201 [1,0,0,0,1,0|2,0,0]=4 4665 B8R1.7 CC(=O)c1cnsc1 Amb26359853 [1,0,0,0,1,0|2,0,0]=4 4666 B8R1.7 CC(=O)n1ccnc1 Amb2684250 [1,0,0,0,1,0|2,0,0]=4 4667 B8R1.7 CC(C)=C1C=CC=C1 Amb2720978 [1,0,0,0,1,0|2,0,0]=4 4668 B8R1.7 CC(N)=C1C=CC=C1 Amb27245689 [1,0,0,0,1,0|1,0,0]=3 4669 B8R1.7 N=C(N)c1ccco1 Amb13952844 [1,0,0,0,1,0|2,0,0]=4 4670 B8R1.7 N=C(N)c1ccco1 Amb2695169 [1,0,0,0,1,0|2,0,0]=4 4671 B8R1.7 N=C(N)c1ccco1 Amb9210508 [1,0,0,0,1,0|2,0,0]=4 4672 B8R1.7 N=C(N)c1cccs1 Amb2684312 [1,0,0,0,1,0|2,0,0]=4 4673 B8R1.7 N=C(N)c1ccns1 Amb29852545 [1,0,0,0,1,0|2,0,0]=4 4674 B8R1.7 N=C(N)c1ccoc1 Amb24388876 [1,0,0,0,1,0|2,0,0]=4 4675 B8R1.7 N=C(N)c1ccoc1 Amb2724744 [1,0,0,0,1,0|2,0,0]=4 4676 B8R1.7 N=C(N)c1ccsc1 Amb2724755 [1,0,0,0,1,0|2,0,0]=4 4677 B8R1.7 N=C(N)c1ccsc1 Amb8439397 [1,0,0,0,1,0|2,0,0]=4 4678 B8R1.7 N=C(N)c1cnco1 Amb25200229 [1,0,0,0,1,0|2,0,0]=4 4679 B8R1.7 N=C(N)c1cncs1 Amb18255775 [1,0,0,0,1,0|2,0,0]=4 4680 B8R1.7 N=C(N)c1cncs1 Amb28934906 [1,0,0,0,1,0|2,0,0]=4 4681 B8R1.7 N=C(N)c1cnsc1 Amb32674014 [1,0,0,0,1,0|2,0,0]=4 4682 B8R1.7 N=C(N)n1cccc1 Amb27595630 [1,0,0,0,1,0|2,0,0]=4 4683 B8R1.7 N=C(N)n1ccnc1 Amb27596092 [1,0,0,0,1,0|2,0,0]=4 4684 B8R1.7 NC(=O)c1ccco1 Amb6373632 [1,0,0,0,1,0|1,0,0]=3 4685 B8R1.7 NC(=O)c1cccs1 Amb2722696 [1,0,0,0,1,0|1,0,0]=3 4686 B8R1.7 NC(=O)c1ccno1 Amb4477414 [1,0,0,0,1,0|1,0,0]=3 4687 B8R1.7 NC(=O)c1ccns1 Amb24409499 [1,0,0,0,1,0|1,0,0]=3 4688 B8R1.7 NC(=O)c1ccoc1 Amb8998597 [1,0,0,0,1,0|1,0,0]=3 4689 B8R1.7 NC(=O)c1ccon1 Amb20630182 [1,0,0,0,1,0|2,0,0]=4 4690 B8R1.7 NC(=O)c1ccsc1 Amb8998201 [1,0,0,0,1,0|1,0,0]=3 4691 B8R1.7 NC(=O)c1ccsn1 Amb25224962 [1,0,0,0,1,0|2,0,0]=4 4692 B8R1.7 NC(=O)c1cnco1 Amb22000976 [1,0,0,0,1,0|1,0,0]=3 4693 B8R1.7 NC(=O)c1cncs1 Amb19514920 [1,0,0,0,1,0|1,0,0]=3 4694 B8R1.7 NC(=O)c1cnns1 Amb9383988 [1,0,0,0,1,0|2,0,0]=4 4695 B8R1.7 NC(=O)c1cnsc1 Amb24681476 [1,0,0,0,1,0|1,0,0]=3 4696 B8R1.7 NC(=O)c1cocn1 Amb21857139 [1,0,0,0,1,0|2,0,0]=4 4697 B8R1.7 NC(=O)c1cscn1 Amb8631050 [1,0,0,0,1,0|2,0,0]=4 4698 B8R1.7 NC(=O)c1csnn1 Amb2725701 [1,0,0,0,1,0|2,0,0]=4 4699 B8R1.7 NC(=O)c1ncco1 Amb21963562 [1,0,0,0,1,0|2,0,0]=4 4700 B8R1.7 NC(=O)c1nccs1 Amb5494087 [1,0,0,0,1,0|2,0,0]=4 4701 B8R1.7 NC(=O)c1nncs1 Amb23437055 [1,0,0,0,1,0|2,0,0]=4 4702 B8R1.7 NC(=O)n1cccc1 Amb17938700 [1,0,0,0,1,0|1,0,0]=3 4703 B8R1.7 NC(=O)n1ccnn1 Amb27877905 [1,0,0,0,1,0|2,0,0]=4 4704 B8R1.7 NC(=O)n1cncn1 Amb24621879 [1,0,0,0,1,0|2,0,0]=4 4705 B8R1.7 NC(=S)c1ccco1 Amb2099744 [1,0,0,0,1,0|1,1,0]=4 4706 B8R1.7 NC(=S)c1cccs1 Amb1152349 [1,0,0,0,1,0|1,1,0]=4 4707 B8R1.7 NC(=S)c1ccno1 Amb2726012 [1,0,0,0,1,0|1,1,0]=4 4708 B8R1.7 NC(=S)c1ccns1 Amb35720413 [1,0,0,0,1,0|1,1,0]=4 4709 B8R1.7 NC(=S)c1ccoc1 Amb2724745 [1,0,0,0,1,0|1,1,0]=4 4710 B8R1.7 NC(=S)c1ccsc1 Amb1154612 [1,0,0,0,1,0|1,1,0]=4 4711 B8R1.7 NC(=S)c1cnco1 Amb21928050 [1,0,0,0,1,0|1,1,0]=4 4712 B8R1.7 NC(=S)c1cncs1 Amb18255776 [1,0,0,0,1,0|1,1,0]=4 4713 B8R1.7 NC(=S)c1cnoc1 Amb19514891 [1,0,0,0,1,0|1,1,0]=4 4714 B8R1.7 NC(=S)c1cnsc1 Amb32674003 [1,0,0,0,1,0|1,1,0]=4 4715 B8R1.7 NC(N)=C1C=CC=N1 Amb25711339 [1,0,0,0,1,0|2,0,0]=4 4716 B8R1.7 NC(N)=C1C=CN=N1 Amb27808459 [1,0,0,0,1,0|2,0,0]=4 4717 B8R1.7 O=C(Br)c1cccs1 Amb27239935 [1,0,0,0,1,0|2,0,0]=4 4718 B8R1.7 O=C(Cl)c1ccco1 Amb2716231 [1,0,0,0,1,0|2,0,0]=4 4719 B8R1.7 O=C(Cl)c1cccs1 Amb1157175 [1,0,0,0,1,0|2,0,0]=4 4720 B8R1.7 O=C(Cl)c1ccno1 Amb2689052 [1,0,0,0,1,0|2,0,0]=4 4721 B8R1.7 O=C(Cl)c1ccns1 Amb26413872 [1,0,0,0,1,0|2,0,0]=4 4722 B8R1.7 O=C(Cl)c1ccoc1 Amb33528390 [1,0,0,0,1,0|2,0,0]=4 4723 B8R1.7 O=C(Cl)c1ccsc1 Amb33527269 [1,0,0,0,1,0|2,0,0]=4 4724 B8R1.7 O=C(Cl)c1cnco1 Amb26915176 [1,0,0,0,1,0|2,0,0]=4 4725 B8R1.7 O=C(Cl)c1cncs1 Amb33329448 [1,0,0,0,1,0|2,0,0]=4 4726 B8R1.7 O=C(O)[c-]1cccc1 Amb33801890 [1,0,0,0,1,0|1,0,1]=4 4727 B8R1.7 O=C(O)[c-]1cccc1 Amb34916034 [1,0,0,0,1,0|1,0,1]=4 4728 B8R1.7 O=C(O)c1ccc[se]1 Amb2611630 [1,0,0,0,1,0|2,0,0]=4 4729 B8R1.7 O=C(O)c1ccco1 Amb6335264 [1,0,0,0,1,0|2,0,0]=4 4730 B8R1.7 O=C(O)c1cccs1 Amb2690602 [1,0,0,0,1,0|2,0,0]=4 4731 B8R1.7 O=C(O)c1ccno1 Amb1152220 [1,0,0,0,1,0|2,0,0]=4 4732 B8R1.7 O=C(O)c1ccns1 Amb1091955 [1,0,0,0,1,0|2,0,0]=4 4733 B8R1.7 O=C(O)c1ccoc1 Amb2720344 [1,0,0,0,1,0|2,0,0]=4 4734 B8R1.7 O=C(O)c1ccsc1 Amb1156673 [1,0,0,0,1,0|2,0,0]=4 4735 B8R1.7 O=C(O)c1cnco1 Amb1158212 [1,0,0,0,1,0|2,0,0]=4 4736 B8R1.7 O=C(O)c1cncs1 Amb1158214 [1,0,0,0,1,0|2,0,0]=4 4737 B8R1.7 O=C(O)c1cnoc1 Amb8878121 [1,0,0,0,1,0|2,0,0]=4 4738 B8R1.7 O=C(O)c1cnsc1 Amb2785373 [1,0,0,0,1,0|2,0,0]=4 4739 B8R1.7 O=C(O)n1cccc1 Amb17938698 [1,0,0,0,1,0|2,0,0]=4 4740 B8R1.7 O=C([O-])c1cccs1 Amb10067272 [1,0,0,0,1,0|2,0,0]=4 4741 B8R1.7 O=C([O-])c1cncs1 Amb13951709 [1,0,0,0,1,0|2,0,0]=4 4742 B8R1.8 NNCc1ccco1 Amb29848033 [1,0,0,0,1,0|1,0,1]=4 4743 B8R1.8 NNCc1ccco1 Amb6246463 [1,0,0,0,1,0|1,0,1]=4 4744 B8R1.8 NNCc1cccs1 Amb22587449 [1,0,0,0,1,0|1,0,1]=4 4745 B8R1.8 NNCc1cccs1 Amb29848034 [1,0,0,0,1,0|1,0,1]=4 4746 B8R1.8 NNCc1cccs1 Amb6242338 [1,0,0,0,1,0|1,0,1]=4 4747 B8R1.8 NNCc1ccoc1 Amb6245644 [1,0,0,0,1,0|1,0,1]=4 4748 B8R1.8 NNCc1ccsc1 Amb33329439 [1,0,0,0,1,0|1,0,1]=4 4749 B8R1.8 NNCc1ccsc1 Amb33329450 [1,0,0,0,1,0|1,0,1]=4 4750 B8R1.8 NNCc1ccsc1 Amb6250886 [1,0,0,0,1,0|1,0,1]=4 4751 B8R1.8 NNCc1cnco1 Amb33415258 [1,0,0,0,1,0|1,0,1]=4 4752 B8R1.8 NNCc1cncs1 Amb19664525 [1,0,0,0,1,0|1,0,1]=4 4753 B8R1.8 NNCc1cnsc1 Amb35720052 [1,0,0,0,1,0|1,0,1]=4 4754 B8R1.8 N\C=C\c1ccco1 Amb28367758 [1,0,0,0,1,0|2,0,0]=4 4755 B8R1.8 N\C=C\c1cnco1 Amb28133163 [1,0,0,0,1,0|2,0,0]=4 4756 B8R1.8 N\N=C\c1ccco1 Amb35789578 [1,0,0,0,1,0|1,0,1]=4 4757 B8R1.8 N\N=C\c1ccns1 Amb35717311 [1,0,0,0,1,0|1,0,1]=4 4758 B8R1.8 OCC=C1C=CC=C1 Amb27662404 [1,0,0,0,1,0|2,0,0]=4 4759 B10R1.348 CC(=O)C1=CC=CC=CN1 Amb25921212 [1,0,0,0,0,1|2,0,0]=4 4760 B10R1.348 CC(=O)C1=CCC=CC=C1 Amb27164696 [1,0,0,0,0,1|2,0,0]=4 4761 B10R1.348 NC(=O)C1C=CC=CC=C1 Amb24611356 [1,0,0,0,0,1|1,0,1]=4 4762 B10R1.348 O=C(Cl)C1=CC=CC=CC1 Amb25374042 [1,0,0,0,0,1|2,0,0]=4 4763 B10R1.348 O=C(O)C1=CC=CC=CC1 Amb27948020 [1,0,0,0,0,1|2,0,0]=4 4764 B10R1.348 O=C(O)C1=CC=CC=CO1 Amb27453492 [1,0,0,0,0,1|2,0,0]=4 4765 B10R1.348 O=C(O)C1=CC=CCC=C1 Amb27425007 [1,0,0,0,0,1|2,0,0]=4 4766 B10R1.348 O=C(O)C1=CCC=CC=C1 Amb28118852 [1,0,0,0,0,1|2,0,0]=4 4767 B12R1.27 CCC(=O)\C=C\c1ccncc1 Amb25962375 [0,0,0,0,0,2|2,0,0]=4 4768 B12R1.27 CNC(=N)NCc1ccncc1 Amb18798338 [0,0,0,0,0,2|2,0,0]=4 4769 B12R1.27 CNC(=O)CCc1ccccc1 Amb3886651 [0,0,0,0,0,2|2,0,0]=4 4770 B12R1.27 CNC(=O)CCc1ccncn1 Amb27982663 [0,0,0,0,0,2|2,0,0]=4 4771 B12R1.27 CNC(=O)CSc1ccccc1 Amb33545141 [0,0,0,0,0,2|2,0,0]=4 4772 B12R1.27 CNC(=O)NCc1ccncc1 Amb2132791 [0,0,0,0,0,2|1,0,0]=3 4773 B12R1.27 CNC(=O)NNc1ccccc1 Amb25751263 [0,0,0,0,0,2|2,0,0]=4 4774 B12R1.27 CNC(=O)NOc1ccccc1 Amb27848154 [0,0,0,0,0,2|2,0,0]=4 4775 B12R1.27 CNC(=O)OCc1ccccc1 Amb26883461 [0,0,0,0,0,2|2,0,0]=4 4776 B12R1.27 CNC(=O)OCc1ccncc1 Amb27798878 [0,0,0,0,0,2|1,0,0]=3 4777 B12R1.27 CNC(=O)SCc1ccccc1 Amb28243771 [0,0,0,0,0,2|2,0,0]=4 4778 B12R1.27 CNC(=O)\C=C\c1ccncc1 Amb28454984 [0,0,0,0,0,2|1,0,0]=3 4779 B12R1.27 CNC(=S)NCc1ccncc1 Amb2756846 [0,0,0,0,0,2|1,1,0]=4 4780 B12R1.27 COC(=O)C#Cc1ccncc1 Amb27227860 [0,0,0,0,0,2|2,0,0]=4 4781 B12R1.27 COC(=O)CCc1ccncc1 Amb10604945 [0,0,0,0,0,2|2,0,0]=4 4782 B12R1.27 COC(=O)CNc1ccncc1 Amb6631083 [0,0,0,0,0,2|2,0,0]=4 4783 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb20668041 [0,0,0,0,0,2|2,0,0]=4 4784 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb24074160 [0,0,0,0,0,2|2,0,0]=4 4785 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [0,0,0,0,0,2|2,0,0]=4 4786 B12R1.27 NCC(=O)CCc1ccccc1 Amb35788694 [0,0,0,0,0,2|2,0,0]=4 4787 B12R1.27 NCC(=O)NCc1ccccc1 Amb6477742 [0,0,0,0,0,2|2,0,0]=4 4788 B12R1.27 NCC(=O)NCc1ccccc1 Amb7969763 [0,0,0,0,0,2|2,0,0]=4 4789 B12R1.27 NCC(=O)NCc1ccncc1 Amb13951584 [0,0,0,0,0,2|1,0,0]=3 4790 B12R1.27 NCC(=O)NCc1ccncc1 Amb5783056 [0,0,0,0,0,2|1,0,0]=3 4791 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [0,0,0,0,0,2|2,0,0]=4 4792 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [0,0,0,0,0,2|2,0,0]=4 4793 B12R1.27 NCC(=O)\C=C\c1ccccc1 Amb32954851 [0,0,0,0,0,2|2,0,0]=4 4794 B12R1.27 NNC(=O)C#Cc1ccncc1 Amb27864433 [0,0,0,0,0,2|0,0,0]=2 4795 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [0,0,0,0,0,2|1,0,0]=3 4796 B12R1.27 NNC(=O)CCc1cccnc1 Amb8387840 [0,0,0,0,0,2|2,0,0]=4 4797 B12R1.27 NNC(=O)CNc1ccccc1 Amb1104534 [0,0,0,0,0,2|1,0,0]=3 4798 B12R1.27 NNC(=O)CNc1ccccc1 Amb29844457 [0,0,0,0,0,2|1,0,0]=3 4799 B12R1.27 NNC(=O)COc1ccccc1 Amb6402305 [0,0,0,0,0,2|1,0,0]=3 4800 B12R1.27 NNC(=O)CSc1ccccc1 Amb4065797 [0,0,0,0,0,2|1,0,0]=3 4801 B12R1.27 NNC(=O)CSc1ccccn1 Amb1060961 [0,0,0,0,0,2|2,0,0]=4 4802 B12R1.27 NNC(=O)CSc1ccncc1 Amb32708482 [0,0,0,0,0,2|0,0,0]=2 4803 B12R1.27 NNC(=O)NCc1ccccc1 Amb8853874 [0,0,0,0,0,2|1,0,0]=3 4804 B12R1.27 NNC(=O)NCc1cccnc1 Amb8854012 [0,0,0,0,0,2|2,0,0]=4 4805 B12R1.27 NNC(=O)NNc1ccccc1 Amb28045865 [0,0,0,0,0,2|1,0,0]=3 4806 B12R1.27 NNC(=O)OCc1ccccc1 Amb33422006 [0,0,0,0,0,2|1,0,0]=3 4807 B12R1.27 NNC(=O)OCc1ccccc1 Amb8516532 [0,0,0,0,0,2|1,0,0]=3 4808 B12R1.27 NNC(=O)OCc1ccncc1 Amb27769029 [0,0,0,0,0,2|0,0,0]=2 4809 B12R1.27 NNC(=O)\C=C\c1ccccc1 Amb9817076 [0,0,0,0,0,2|1,0,0]=3 4810 B12R1.27 NNC(=O)\C=C\c1cccnc1 Amb2612884 [0,0,0,0,0,2|2,0,0]=4 4811 B12R1.27 NNC(=O)\C=C\c1ccncc1 Amb26611701 [0,0,0,0,0,2|0,0,0]=2 4812 B12R1.27 NNC(=S)CCc1ccccc1 Amb27492786 [0,0,0,0,0,2|1,1,0]=4 4813 B12R1.27 NNC(=S)NCc1ccccc1 Amb1636204 [0,0,0,0,0,2|1,1,0]=4 4814 B12R1.27 NNC(=S)NCc1ccncc1 Amb9205811 [0,0,0,0,0,2|0,1,0]=3 4815 B12R1.27 NNC(=S)NCc1ccncn1 Amb27622556 [0,0,0,0,0,2|1,1,0]=4 4816 B12R1.27 NNC(=S)NNc1ccccc1 Amb24502103 [0,0,0,0,0,2|1,1,0]=4 4817 B12R1.27 NNC(=S)OCc1ccncc1 Amb27875387 [0,0,0,0,0,2|0,1,0]=3 4818 B12R1.27 NNC(=S)SCc1ccccc1 Amb26045477 [0,0,0,0,0,2|1,1,0]=4 4819 B12R1.27 NNC(=S)SCc1ccncc1 Amb28342490 [0,0,0,0,0,2|0,1,0]=3 4820 B12R1.27 N\N=C(\N)NCc1ccncc1 Amb27175642 [0,0,0,0,0,2|1,0,1]=4 4821 B12R1.27 O=C(C#Cc1ccccc1)NO Amb27755294 [0,0,0,0,0,2|2,0,0]=4 4822 B12R1.27 O=C(CBr)NCc1ccncc1 Amb17328296 [0,0,0,0,0,2|2,0,0]=4 4823 B12R1.27 O=C(CCc1ccccc1)NO Amb6277186 [0,0,0,0,0,2|2,0,0]=4 4824 B12R1.27 O=C(CCc1ccncn1)NO Amb27163861 [0,0,0,0,0,2|2,0,0]=4 4825 B12R1.27 O=C(CCl)NCc1ccncc1 Amb3356995 [0,0,0,0,0,2|2,0,0]=4 4826 B12R1.27 O=C(CO)CCc1ccncc1 Amb18563675 [0,0,0,0,0,2|2,0,0]=4 4827 B12R1.27 O=C(CO)NCc1ccncc1 Amb17334669 [0,0,0,0,0,2|2,0,0]=4 4828 B12R1.27 O=C(CO)NNc1ccncc1 Amb28061791 [0,0,0,0,0,2|2,0,0]=4 4829 B12R1.27 O=C(COc1ccccc1)NO Amb6270455 [0,0,0,0,0,2|2,0,0]=4 4830 B12R1.27 O=C(CSc1ccccc1)NO Amb27590137 [0,0,0,0,0,2|2,0,0]=4 4831 B12R1.27 O=C(CSc1ccncc1)NO Amb28140463 [0,0,0,0,0,2|1,0,0]=3 4832 B12R1.27 O=C(NCl)NCc1ccccc1 Amb22735087 [0,0,0,0,0,2|2,0,0]=4 4833 B12R1.27 O=C(NCl)OCc1ccccc1 Amb21948731 [0,0,0,0,0,2|2,0,0]=4 4834 B12R1.27 O=C(NO)NNc1ccccc1 Amb3427817 [0,0,0,0,0,2|2,0,0]=4 4835 B12R1.27 O=C(NO)OCc1ccccc1 Amb2445312 [0,0,0,0,0,2|2,0,0]=4 4836 B12R1.27 O=C(\C=C\c1ccccc1)N[O-] Amb27185829 [0,0,0,0,0,2|2,0,0]=4