0 B9R1.12 BrCCCc1ccco1 Amb17104550 [0,0,0,0,0,0|1,0,3]=4 1 B9R1.12 BrCCSc1ccco1 Amb27817680 [0,0,0,0,0,0|2,0,2]=4 2 B9R1.12 BrC\C=C\c1ccco1 Amb27867174 [0,0,0,0,0,0|1,0,1]=2 3 B9R1.12 BrC\C=C\c1ccns1 Amb35731172 [0,0,0,0,0,0|2,1,1]=4 4 B9R1.12 BrC\C=C\c1cscn1 Amb28285186 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.12 Br\C=C\Sc1ccsc1 Amb27224331 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.12 C#CCCc1ccco1 Amb27838602 [0,0,0,0,0,0|1,0,3]=4 7 B9R1.12 C#CCOc1ccco1 Amb27239981 [0,0,0,0,0,0|2,0,2]=4 8 B9R1.12 C=CCCc1ccco1 Amb35680299 [0,0,0,0,0,0|1,0,2]=3 9 B9R1.12 C=CCCc1cccs1 Amb27476978 [0,0,0,0,0,0|1,1,2]=4 10 B9R1.12 C=CCSc1ncco1 Amb27956580 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.12 C=C\C=C/n1cncn1 Amb27249505 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.12 C=C\C=C\c1cccs1 Amb26418485 [0,0,0,0,0,0|1,1,0]=2 13 B9R1.12 C=C\C=C\c1ccsc1 Amb26569661 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.12 C=C\N=C\c1cccs1 Amb27240018 [0,0,0,0,0,0|2,1,0]=3 15 B9R1.12 CCCCc1ccco1 Amb10070290 [0,0,0,0,0,0|1,0,3]=4 16 B9R1.12 CCNCc1ccco1 Amb1137312 [0,0,0,0,0,0|2,0,2]=4 17 B9R1.12 CCNCc1ccco1 Amb8191019 [0,0,0,0,0,0|2,0,2]=4 18 B9R1.12 CCOCc1ccco1 Amb22234292 [0,0,0,0,0,0|2,0,2]=4 19 B9R1.12 CCSCc1ccco1 Amb26949169 [0,0,0,0,0,0|2,0,2]=4 20 B9R1.12 CC\N=C\c1ccco1 Amb27443134 [0,0,0,0,0,0|2,0,1]=3 21 B9R1.12 CNCCc1ccco1 Amb17399803 [0,0,0,0,0,0|2,0,2]=4 22 B9R1.12 CNNCc1ccco1 Amb27463559 [0,0,0,0,0,0|3,0,1]=4 23 B9R1.12 CO\C=C\c1cccs1 Amb27638492 [0,0,0,0,0,0|2,1,0]=3 24 B9R1.12 CO\C=C\c1ccoc1 Amb25349455 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.12 CO\C=C\c1ccsc1 Amb27246685 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.12 CO\C=C\c1cncs1 Amb32663125 [0,0,0,0,0,0|3,1,0]=4 27 B9R1.12 CO\N=C\c1cccs1 Amb27396629 [0,0,0,0,0,0|3,1,0]=4 28 B9R1.12 CSCCc1ccco1 Amb27438612 [0,0,0,0,0,0|2,0,2]=4 29 B9R1.12 CSSCc1ccco1 Amb8393174 [0,0,0,0,0,0|3,0,1]=4 30 B9R1.12 C\C=C/Cn1cccc1 Amb27790551 [0,0,0,0,0,0|3,0,1]=4 31 B9R1.12 C\C=C\Cn1cccn1 Amb27168412 [0,0,0,0,0,0|3,0,1]=4 32 B9R1.12 ClCCCc1ccco1 Amb8860563 [0,0,0,0,0,0|1,0,3]=4 33 B9R1.12 ClC\C=C\c1ccns1 Amb35731171 [0,0,0,0,0,0|2,1,1]=4 34 B9R1.12 ClC\C=C\c1cncs1 Amb28285194 [0,0,0,0,0,0|2,1,1]=4 35 B9R1.12 ClC\C=C\c1nccs1 Amb27753734 [0,0,0,0,0,0|2,1,1]=4 36 B9R1.12 Cl\C=C\Cc1ccco1 Amb27843650 [0,0,0,0,0,0|1,0,1]=2 37 B9R1.12 Cl\C=C\Sc1cccs1 Amb27444040 [0,0,0,0,0,0|2,1,0]=3 38 B9R1.12 N#CC#Cc1ccco1 Amb28143883 [0,0,0,0,0,0|1,0,3]=4 39 B9R1.12 N#CCCc1ccco1 Amb20623925 [0,0,0,0,0,0|1,0,3]=4 40 B9R1.12 N#CCNc1ccco1 Amb28247716 [0,0,0,0,0,0|2,0,2]=4 41 B9R1.12 N#CSCc1ccco1 Amb27162772 [0,0,0,0,0,0|2,0,2]=4 42 B9R1.12 N#C\C=C/c1ccco1 Amb28200911 [0,0,0,0,0,0|1,0,1]=2 43 B9R1.12 N#C\C=C\c1cccs1 Amb3429733 [0,0,0,0,0,0|1,1,1]=3 44 B9R1.12 N#C\C=C\c1ccns1 Amb35709499 [0,0,0,0,0,0|2,1,1]=4 45 B9R1.12 N#C\C=C\c1ccoc1 Amb27817415 [0,0,0,0,0,0|3,0,1]=4 46 B9R1.12 N#C\C=C\c1cscn1 Amb25321688 [0,0,0,0,0,0|3,0,1]=4 47 B9R1.12 N#C\C=C\c1nccs1 Amb27400709 [0,0,0,0,0,0|2,1,1]=4 48 B9R1.12 NCC#Cc1ccco1 Amb27604728 [0,0,0,0,0,0|1,0,3]=4 49 B9R1.12 NCCCc1ccco1 Amb534785 [0,0,0,0,0,0|1,0,3]=4 50 B9R1.12 NCCOc1ccco1 Amb33360919 [0,0,0,0,0,0|2,0,2]=4 51 B9R1.12 NCCSc1ccco1 Amb28326221 [0,0,0,0,0,0|2,0,2]=4 52 B9R1.12 NC\C=C/c1cccs1 Amb27167022 [0,0,0,0,0,0|1,1,1]=3 53 B9R1.12 NC\C=C\c1ccco1 Amb10560864 [0,0,0,0,0,0|1,0,1]=2 54 B9R1.12 NC\C=C\c1cccs1 Amb18563038 [0,0,0,0,0,0|1,1,1]=3 55 B9R1.12 NC\C=C\c1ccns1 Amb29855983 [0,0,0,0,0,0|2,1,1]=4 56 B9R1.12 NC\C=C\c1ccoc1 Amb28347981 [0,0,0,0,0,0|3,0,1]=4 57 B9R1.12 NC\C=C\c1ccon1 Amb33197557 [0,0,0,0,0,0|3,0,1]=4 58 B9R1.12 NC\C=C\c1ccsc1 Amb18643463 [0,0,0,0,0,0|3,0,1]=4 59 B9R1.12 NC\C=C\c1cnco1 Amb33414799 [0,0,0,0,0,0|2,0,1]=3 60 B9R1.12 NC\C=C\c1cncs1 Amb33080085 [0,0,0,0,0,0|2,1,1]=4 61 B9R1.12 NC\C=C\c1cscn1 Amb33359219 [0,0,0,0,0,0|3,0,1]=4 62 B9R1.12 NOCCc1ccco1 Amb25208726 [0,0,0,0,0,0|2,0,2]=4 63 B9R1.12 O=C=NCc1ccco1 Amb901884 [0,0,0,0,0,0|1,0,2]=3 64 B9R1.12 O=C=NCc1cccs1 Amb33541078 [0,0,0,0,0,0|1,1,2]=4 65 B9R1.12 O=C=NCc1ccno1 Amb18061876 [0,0,0,0,0,0|2,0,2]=4 66 B9R1.12 O=C=NCc1cnco1 Amb33415269 [0,0,0,0,0,0|2,0,2]=4 67 B9R1.12 O=CC#Cc1ccoc1 Amb27966716 [0,0,0,0,0,0|2,0,2]=4 68 B9R1.12 O=CCCc1ccco1 Amb17081672 [0,0,0,0,0,0|0,0,2]=2 69 B9R1.12 O=CCCc1cccs1 Amb17081673 [0,0,0,0,0,0|0,1,2]=3 70 B9R1.12 O=CCCc1ccns1 Amb27235027 [0,0,0,0,0,0|1,1,2]=4 71 B9R1.12 O=CCCc1ccoc1 Amb8394152 [0,0,0,0,0,0|2,0,2]=4 72 B9R1.12 O=CCCc1ccsc1 Amb26961096 [0,0,0,0,0,0|2,0,2]=4 73 B9R1.12 O=CCCc1cnco1 Amb26986955 [0,0,0,0,0,0|1,0,2]=3 74 B9R1.12 O=CCCc1cncs1 Amb25705083 [0,0,0,0,0,0|1,1,2]=4 75 B9R1.12 O=CCCc1nccs1 Amb8010561 [0,0,0,0,0,0|1,1,2]=4 76 B9R1.12 O=CCCn1cccn1 Amb4303948 [0,0,0,0,0,0|2,0,2]=4 77 B9R1.12 O=CCOc1ccsc1 Amb27191888 [0,0,0,0,0,0|3,0,1]=4 78 B9R1.12 O=CCSc1cccs1 Amb17082929 [0,0,0,0,0,0|1,1,1]=3 79 B9R1.12 O=CNCc1ccco1 Amb3319177 [0,0,0,0,0,0|1,0,1]=2 80 B9R1.12 O=CNCc1cccs1 Amb27774671 [0,0,0,0,0,0|1,1,1]=3 81 B9R1.12 O=CNCc1ccns1 Amb35720521 [0,0,0,0,0,0|2,1,1]=4 82 B9R1.12 O=CNCc1ccoc1 Amb28188531 [0,0,0,0,0,0|3,0,1]=4 83 B9R1.12 O=CNCc1ccon1 Amb27838478 [0,0,0,0,0,0|3,0,1]=4 84 B9R1.12 O=CNCc1cncs1 Amb27628845 [0,0,0,0,0,0|2,1,1]=4 85 B9R1.12 O=CNCc1nccs1 Amb25295210 [0,0,0,0,0,0|2,1,1]=4 86 B9R1.12 O=COCc1ccco1 Amb26359842 [0,0,0,0,0,0|1,0,1]=2 87 B9R1.12 O=COCn1cccc1 Amb26423885 [0,0,0,0,0,0|3,0,1]=4 88 B9R1.12 O=C\C=C/c1ccco1 Amb27590405 [0,0,0,0,0,0|0,0,0]=0 89 B9R1.12 O=C\C=C\C1CCCO1 Amb26992295 [0,0,0,0,0,0|0,0,4]=4 90 B9R1.12 O=C\C=C\c1ccco1 Amb33870988 [0,0,0,0,0,0|0,0,0]=0 91 B9R1.12 O=C\C=C\c1cccs1 Amb17334164 [0,0,0,0,0,0|0,1,0]=1 92 B9R1.12 O=C\C=C\c1ccns1 Amb35719811 [0,0,0,0,0,0|1,1,0]=2 93 B9R1.12 O=C\C=C\c1ccoc1 Amb33136412 [0,0,0,0,0,0|2,0,0]=2 94 B9R1.12 O=C\C=C\c1ccon1 Amb33197559 [0,0,0,0,0,0|2,0,0]=2 95 B9R1.12 O=C\C=C\c1ccsc1 Amb18643292 [0,0,0,0,0,0|2,0,0]=2 96 B9R1.12 O=C\C=C\c1cnco1 Amb33414801 [0,0,0,0,0,0|1,0,0]=1 97 B9R1.12 O=C\C=C\c1cncs1 Amb33079492 [0,0,0,0,0,0|1,1,0]=2 98 B9R1.12 O=C\C=C\c1cscn1 Amb25299918 [0,0,0,0,0,0|2,0,0]=2 99 B9R1.12 O=C\C=C\c1csnn1 Amb33079502 [0,0,0,0,0,0|3,0,0]=3 100 B9R1.12 O=C\C=C\c1nccs1 Amb33359384 [0,0,0,0,0,0|1,1,0]=2 101 B9R1.12 O=C\C=C\n1cccn1 Amb18642043 [0,0,0,0,0,0|2,0,0]=2 102 B9R1.12 OCC#Cc1ccco1 Amb28049071 [0,0,0,0,0,0|0,0,4]=4 103 B9R1.12 OCCCc1ccco1 Amb8860560 [0,0,0,0,0,0|0,0,4]=4 104 B9R1.12 OCCNc1ccco1 Amb27246618 [0,0,0,0,0,0|1,0,3]=4 105 B9R1.12 OCCSc1ccco1 Amb27200113 [0,0,0,0,0,0|1,0,3]=4 106 B9R1.12 OC\C=C\c1ccco1 Amb837544 [0,0,0,0,0,0|0,0,2]=2 107 B9R1.12 OC\C=C\c1cccs1 Amb23555588 [0,0,0,0,0,0|0,1,2]=3 108 B9R1.12 OC\C=C\c1ccns1 Amb30017499 [0,0,0,0,0,0|1,1,2]=4 109 B9R1.12 OC\C=C\c1ccoc1 Amb33136449 [0,0,0,0,0,0|2,0,2]=4 110 B9R1.12 OC\C=C\c1ccon1 Amb33197558 [0,0,0,0,0,0|2,0,2]=4 111 B9R1.12 OC\C=C\c1ccsc1 Amb33136405 [0,0,0,0,0,0|2,0,2]=4 112 B9R1.12 OC\C=C\c1cnco1 Amb33414800 [0,0,0,0,0,0|1,0,2]=3 113 B9R1.12 OC\C=C\c1cncs1 Amb25733141 [0,0,0,0,0,0|1,1,2]=4 114 B9R1.12 OC\C=C\c1cscn1 Amb28195848 [0,0,0,0,0,0|2,0,2]=4 115 B9R1.12 OC\C=C\c1nccs1 Amb33429167 [0,0,0,0,0,0|1,1,2]=4 116 B9R1.12 OC\C=C\n1cccc1 Amb28049227 [0,0,0,0,0,0|2,0,2]=4 117 B9R1.12 O\N=C\Cc1ccco1 Amb28368538 [0,0,0,0,0,0|1,0,2]=3 118 B9R1.12 S=C=NCc1ccco1 Amb6565407 [0,0,0,0,0,0|1,1,2]=4 119 B9R1.12 SCCCc1ccco1 Amb17399874 [0,0,0,0,0,0|0,1,3]=4 120 B9R1.12 [C-]#[N+]CCc1ccco1 Amb24743086 [0,0,0,0,0,0|2,0,2]=4 121 B9R1.12 [N-]=[N+]=NC=C1C=CC=C1 Amb27424730 [0,0,0,0,0,0|4,0,0]=4 122 B9R1.12 [N-]=[N+]=NCc1ccco1 Amb25791515 [0,0,0,0,0,0|3,0,1]=4 123 B8R1.8 BrCCc1ccco1 Amb22752866 [1,0,0,0,0,0|1,0,2]=4 124 B8R1.8 Br\C=C\c1ccco1 Amb33134803 [1,0,0,0,0,0|1,0,0]=2 125 B8R1.8 Br\C=C\c1cccs1 Amb33134763 [1,0,0,0,0,0|1,1,0]=3 126 B8R1.8 Br\C=C\c1ccoc1 Amb27849530 [1,0,0,0,0,0|3,0,0]=4 127 B8R1.8 Br\C=C\c1ccon1 Amb33135283 [1,0,0,0,0,0|3,0,0]=4 128 B8R1.8 Br\C=C\c1ccsc1 Amb27612884 [1,0,0,0,0,0|3,0,0]=4 129 B8R1.8 Br\C=C\c1cncs1 Amb33135071 [1,0,0,0,0,0|2,1,0]=4 130 B8R1.8 Br\C=C\c1cocn1 Amb33135210 [1,0,0,0,0,0|3,0,0]=4 131 B8R1.8 Br\C=C\c1cscn1 Amb33135090 [1,0,0,0,0,0|3,0,0]=4 132 B8R1.8 Br\C=C\c1nccs1 Amb33135037 [1,0,0,0,0,0|2,1,0]=4 133 B8R1.8 C#CCc1ccco1 Amb26445263 [1,0,0,0,0,0|0,0,3]=4 134 B8R1.8 C#NCc1ccco1 Amb31132339 [1,0,0,0,0,0|1,0,2]=4 135 B8R1.8 C=C=Cc1ccco1 Amb27638814 [1,0,0,0,0,0|0,0,1]=2 136 B8R1.8 C=CCc1ccco1 Amb26612842 [1,0,0,0,0,0|0,0,1]=2 137 B8R1.8 C=CCc1cccs1 Amb27882648 [1,0,0,0,0,0|0,1,1]=3 138 B8R1.8 C=CCc1ccns1 Amb27205998 [1,0,0,0,0,0|1,1,1]=4 139 B8R1.8 C=CCc1ccsc1 Amb27799958 [1,0,0,0,0,0|2,0,1]=4 140 B8R1.8 C=CCc1cncs1 Amb35625105 [1,0,0,0,0,0|1,1,1]=4 141 B8R1.8 C=CCn1cccc1 Amb9371428 [1,0,0,0,0,0|2,0,1]=4 142 B8R1.8 C=CCn1cccn1 Amb4036063 [1,0,0,0,0,0|2,0,1]=4 143 B8R1.8 C=NCc1ccco1 Amb28287800 [1,0,0,0,0,0|1,0,1]=3 144 B8R1.8 C=NCc1cccs1 Amb27964411 [1,0,0,0,0,0|1,1,1]=4 145 B8R1.8 CCCc1ccco1 Amb10070288 [1,0,0,0,0,0|0,0,3]=4 146 B8R1.8 CCNc1ccco1 Amb27593280 [1,0,0,0,0,0|1,0,2]=4 147 B8R1.8 CCSc1ccco1 Amb27667158 [1,0,0,0,0,0|1,0,2]=4 148 B8R1.8 CNCc1ccco1 Amb1153202 [1,0,0,0,0,0|1,0,2]=4 149 B8R1.8 CNCc1ccco1 Amb7172520 [1,0,0,0,0,0|1,0,2]=4 150 B8R1.8 COCc1ccco1 Amb24116969 [1,0,0,0,0,0|1,0,2]=4 151 B8R1.8 CO[SiH2]c1ccco1 Amb27215529 [1,0,0,0,0,0|1,1,1]=4 152 B8R1.8 CSCc1ccco1 Amb8393158 [1,0,0,0,0,0|1,0,2]=4 153 B8R1.8 C\N=C\c1cccs1 Amb27849144 [1,0,0,0,0,0|1,1,1]=4 154 B8R1.8 ClC#Cc1ccco1 Amb27200082 [1,0,0,0,0,0|1,0,2]=4 155 B8R1.8 ICCc1ccco1 Amb27224391 [1,0,0,0,0,0|1,0,2]=4 156 B8R1.8 I\C=C\c1ccco1 Amb24697510 [1,0,0,0,0,0|1,0,0]=2 157 B8R1.8 N#CCc1ccco1 Amb9210908 [1,0,0,0,0,0|1,0,2]=4 158 B8R1.8 NCCc1ccco1 Amb1080943 [1,0,0,0,0,0|1,0,2]=4 159 B8R1.8 NCCc1ccco1 Amb22587649 [1,0,0,0,0,0|1,0,2]=4 160 B8R1.8 NCSc1ccco1 Amb27843491 [1,0,0,0,0,0|2,0,1]=4 161 B8R1.8 NNCc1ccco1 Amb29848033 [1,0,0,0,0,0|2,0,1]=4 162 B8R1.8 NNCc1ccco1 Amb6246463 [1,0,0,0,0,0|2,0,1]=4 163 B8R1.8 NOCc1ccco1 Amb25141783 [1,0,0,0,0,0|2,0,1]=4 164 B8R1.8 N\C=C\c1ccco1 Amb28367758 [1,0,0,0,0,0|1,0,0]=2 165 B8R1.8 N\C=C\c1cnco1 Amb28133163 [1,0,0,0,0,0|2,0,0]=3 166 B8R1.8 N\N=C\c1ccco1 Amb35789578 [1,0,0,0,0,0|2,0,0]=3 167 B8R1.8 O=C=Cc1cccs1 Amb27632892 [1,0,0,0,0,0|0,1,1]=3 168 B8R1.8 O=C=Nc1ccco1 Amb6272977 [1,0,0,0,0,0|1,0,1]=3 169 B8R1.8 O=C=Nc1cccs1 Amb2723194 [1,0,0,0,0,0|1,1,1]=4 170 B8R1.8 O=C=Nc1ccno1 Amb18061875 [1,0,0,0,0,0|2,0,1]=4 171 B8R1.8 O=CCc1ccco1 Amb17089526 [1,0,0,0,0,0|0,0,1]=2 172 B8R1.8 O=CCc1cccs1 Amb17089527 [1,0,0,0,0,0|0,1,1]=3 173 B8R1.8 O=CCc1ccno1 Amb28060201 [1,0,0,0,0,0|1,0,1]=3 174 B8R1.8 O=CCc1ccoc1 Amb18641576 [1,0,0,0,0,0|2,0,1]=4 175 B8R1.8 O=CCc1ccon1 Amb26390824 [1,0,0,0,0,0|2,0,1]=4 176 B8R1.8 O=CCc1ccsc1 Amb26603755 [1,0,0,0,0,0|2,0,1]=4 177 B8R1.8 O=CCc1ccsn1 Amb27190366 [1,0,0,0,0,0|2,0,1]=4 178 B8R1.8 O=CCc1cnco1 Amb24653904 [1,0,0,0,0,0|1,0,1]=3 179 B8R1.8 O=CCc1cncs1 Amb28316235 [1,0,0,0,0,0|1,1,1]=4 180 B8R1.8 O=CCc1cscn1 Amb24469342 [1,0,0,0,0,0|2,0,1]=4 181 B8R1.8 O=CCc1ncco1 Amb26946687 [1,0,0,0,0,0|1,0,1]=3 182 B8R1.8 O=CCc1nccs1 Amb26856976 [1,0,0,0,0,0|1,1,1]=4 183 B8R1.8 O=CCn1cccc1 Amb18203408 [1,0,0,0,0,0|2,0,1]=4 184 B8R1.8 O=CCn1cccn1 Amb32411521 [1,0,0,0,0,0|2,0,1]=4 185 B8R1.8 O=CNc1ccco1 Amb28135036 [1,0,0,0,0,0|1,0,0]=2 186 B8R1.8 O=CNc1cccs1 Amb28282647 [1,0,0,0,0,0|1,1,0]=3 187 B8R1.8 O=CNc1nccs1 Amb10561672 [1,0,0,0,0,0|2,1,0]=4 188 B8R1.8 O=COc1ccco1 Amb27591421 [1,0,0,0,0,0|1,0,0]=2 189 B8R1.8 O=COc1cccs1 Amb27798954 [1,0,0,0,0,0|1,1,0]=3 190 B8R1.8 O=C\C=C1/C=COC1 Amb27461596 [1,0,0,0,0,0|2,0,0]=3 191 B8R1.8 O=C\C=C1\CCCO1 Amb26868026 [1,0,0,0,0,0|0,0,3]=4 192 B8R1.8 OCC=C1C=CC=C1 Amb27662404 [1,0,0,0,0,0|1,0,2]=4 193 B8R1.8 OCCc1ccco1 Amb17089516 [1,0,0,0,0,0|0,0,3]=4 194 B8R1.8 ONCc1ccco1 Amb23449450 [1,0,0,0,0,0|1,0,2]=4 195 B8R1.8 O\N=C/c1cccs1 Amb27801792 [1,0,0,0,0,0|1,1,1]=4 196 B8R1.8 O\N=C\c1ccco1 Amb6374169 [1,0,0,0,0,0|1,0,1]=3 197 B8R1.8 O\N=C\c1cccs1 Amb6384738 [1,0,0,0,0,0|1,1,1]=4 198 B8R1.8 SCCc1ccco1 Amb24511324 [1,0,0,0,0,0|0,1,2]=4 199 B8R1.8 SCOc1ccco1 Amb28130026 [1,0,0,0,0,0|1,1,1]=4 200 B8R1.8 [C-]#[N+]Cc1ccco1 Amb1981056 [1,0,0,0,0,0|1,0,2]=4 201 B8R1.8 [N-]=[N+]=Cc1ccco1 Amb27971199 [1,0,0,0,0,0|2,0,0]=3 202 B10R1.11 C=C(CCN)c1ccco1 Amb33360926 [0,1,0,0,0,0|1,0,2]=4 203 B10R1.11 C=C=CC(=O)c1cccs1 Amb28351543 [0,1,0,0,0,0|1,1,1]=4 204 B10R1.11 C=C=CC(O)c1ccco1 Amb27410405 [0,1,0,0,0,0|1,0,2]=4 205 B10R1.11 C=C=C[C@@H](O)c1ccco1 Amb28119448 [0,1,0,0,0,0|1,0,2]=4 206 B10R1.11 C=CCC(=O)c1ccco1 Amb10562220 [0,1,0,0,0,0|1,0,1]=3 207 B10R1.11 C=CCC(=O)c1cccs1 Amb10574830 [0,1,0,0,0,0|1,1,1]=4 208 B10R1.11 C=CCC(O)c1ccco1 Amb22360627 [0,1,0,0,0,0|1,0,2]=4 209 B10R1.11 CC(C=[N+]=[N-])c1ccco1 Amb27441038 [0,1,0,0,0,0|2,0,1]=4 210 B10R1.11 CC(CC=O)c1ccco1 Amb17593491 [0,1,0,0,0,0|0,0,2]=3 211 B10R1.11 CC(N=C=O)c1ccco1 Amb25702120 [0,1,0,0,0,0|1,0,2]=4 212 B10R1.11 CCCC(=O)c1ccco1 Amb4018004 [0,1,0,0,0,0|1,0,2]=4 213 B10R1.11 CCOC(=N)c1ccco1 Amb27837592 [0,1,0,0,0,0|2,0,1]=4 214 B10R1.11 CCOC(=O)c1ccco1 Amb2725474 [0,1,0,0,0,0|2,0,1]=4 215 B10R1.11 CNCC(=O)c1ccco1 Amb21862170 [0,1,0,0,0,0|2,0,1]=4 216 B10R1.11 COCC(=O)c1ccco1 Amb9665979 [0,1,0,0,0,0|2,0,1]=4 217 B10R1.11 CO\N=C(/N)c1ccco1 Amb18224072 [0,1,0,0,0,0|3,0,0]=4 218 B10R1.11 CSCC(=O)c1ccco1 Amb18791728 [0,1,0,0,0,0|2,0,1]=4 219 B10R1.11 C[C@@H](NC=O)c1ccco1 Amb27485041 [0,1,0,0,0,0|1,0,1]=3 220 B10R1.11 C[C@H](\C=N\O)c1ccco1 Amb27791041 [0,1,0,0,0,0|1,0,2]=4 221 B10R1.11 C\C(=C/CN)c1cccs1 Amb23555596 [0,1,0,0,0,0|1,1,1]=4 222 B10R1.11 C\C(=C\CO)c1cccs1 Amb28134112 [0,1,0,0,0,0|0,1,2]=4 223 B10R1.11 C\C=C\C(=O)c1cncs1 Amb24646601 [0,1,0,0,0,0|2,1,0]=4 224 B10R1.11 C\C=C\C(=O)n1cccn1 Amb27448112 [0,1,0,0,0,0|3,0,0]=4 225 B10R1.11 C\C=C\[C@@H](O)c1ccco1 Amb27978317 [0,1,0,0,0,0|1,0,1]=3 226 B10R1.11 N#CCC(=O)c1ccco1 Amb1154496 [0,1,0,0,0,0|1,0,2]=4 227 B10R1.11 N#C\C=C(\N)c1cccs1 Amb27984808 [0,1,0,0,0,0|1,1,1]=4 228 B10R1.11 N#C\N=C(/N)c1ccco1 Amb16186666 [0,1,0,0,0,0|2,0,1]=4 229 B10R1.11 N#C\N=C(\N)c1ccco1 Amb20414408 [0,1,0,0,0,0|2,0,1]=4 230 B10R1.11 NCCC(=O)c1ccco1 Amb18639567 [0,1,0,0,0,0|1,0,2]=4 231 B10R1.11 O=C(CCCl)c1ccco1 Amb17138476 [0,1,0,0,0,0|1,0,2]=4 232 B10R1.11 O=C(N=C=S)c1ccco1 Amb2688615 [0,1,0,0,0,0|1,1,1]=4 233 B10R1.11 O=C(OCF)c1ccco1 Amb24553124 [0,1,0,0,0,0|2,0,1]=4 234 B10R1.11 O=C(\C=C\Cl)c1cccs1 Amb24478325 [0,1,0,0,0,0|1,1,0]=3 235 B10R1.11 O=C(\C=C\Cl)c1ccoc1 Amb29880172 [0,1,0,0,0,0|3,0,0]=4 236 B10R1.11 O=C(\C=C\Cl)c1ccon1 Amb35609139 [0,1,0,0,0,0|3,0,0]=4 237 B10R1.11 O=C(\C=C\Cl)c1ccsc1 Amb29880143 [0,1,0,0,0,0|3,0,0]=4 238 B10R1.11 O=C(\C=C\Cl)c1cncs1 Amb29880181 [0,1,0,0,0,0|2,1,0]=4 239 B10R1.11 O=C(\C=C\Cl)c1cscn1 Amb35628610 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.11 O=C(\C=C\[O-])c1ccco1 Amb24121225 [0,1,0,0,0,0|0,0,1]=2 241 B10R1.11 O=C(\C=C\[O-])c1cccs1 Amb27251932 [0,1,0,0,0,0|0,1,1]=3 242 B10R1.11 O=C(\C=C\[O-])c1ccsc1 Amb27655311 [0,1,0,0,0,0|2,0,1]=4 243 B10R1.11 O=C=NC(=O)c1ccco1 Amb17231898 [0,1,0,0,0,0|1,0,1]=3 244 B10R1.11 O=C=NC(=O)c1cccs1 Amb6252636 [0,1,0,0,0,0|1,1,1]=4 245 B10R1.11 O=CCC(=O)c1ccco1 Amb9204969 [0,1,0,0,0,0|0,0,1]=2 246 B10R1.11 O=CCC(=O)c1cccs1 Amb9204971 [0,1,0,0,0,0|0,1,1]=3 247 B10R1.11 O=CCC(=O)c1ccoc1 Amb25251013 [0,1,0,0,0,0|2,0,1]=4 248 B10R1.11 O=CCC(=O)c1ccsc1 Amb18799499 [0,1,0,0,0,0|2,0,1]=4 249 B10R1.11 O=CCC(=O)c1cncs1 Amb25147746 [0,1,0,0,0,0|1,1,1]=4 250 B10R1.11 O=CCC(=O)c1cscn1 Amb26972671 [0,1,0,0,0,0|2,0,1]=4 251 B10R1.11 O=CCC(=O)c1nccs1 Amb24590145 [0,1,0,0,0,0|1,1,1]=4 252 B10R1.11 O=CNC(=O)c1cccs1 Amb5282864 [0,1,0,0,0,0|1,1,0]=3 253 B10R1.11 O=C\C=C(/Cl)c1cccs1 Amb28076086 [0,1,0,0,0,0|0,1,0]=2 254 B10R1.11 O=C\C=C(/Cl)c1ccsc1 Amb13777329 [0,1,0,0,0,0|2,0,0]=3 255 B10R1.11 O=C\C=C(\Cl)c1cccs1 Amb28049394 [0,1,0,0,0,0|0,1,0]=2 256 B10R1.11 OCSC(=S)c1ccco1 Amb27206570 [0,1,0,0,0,0|1,0,2]=4 257 B10R1.11 [N-]=[N+]=CC(=O)c1ccco1 Amb17593439 [0,1,0,0,0,0|2,0,0]=3 258 B10R1.11 [N-]=[N+]=CC(=O)c1cccs1 Amb27466464 [0,1,0,0,0,0|2,1,0]=4 259 B10R1.11 [N-]=[N+]=NC(=O)c1ccco1 Amb8938223 [0,1,0,0,0,0|3,0,0]=4 260 B10R1.16 BrC\C=C\c1cc(Br)cs1 Amb27645685 [0,1,0,0,0,0|1,1,1]=4 261 B10R1.16 C=CCCc1ccc(C)o1 Amb22339450 [0,1,0,0,0,0|1,0,2]=4 262 B10R1.16 CC\C=C\c1cc(N)no1 Amb33272618 [0,1,0,0,0,0|2,0,1]=4 263 B10R1.16 CC\C=C\c1cnc(N)o1 Amb33272604 [0,1,0,0,0,0|2,0,1]=4 264 B10R1.16 CO\N=C\c1cc(Br)co1 Amb27451767 [0,1,0,0,0,0|3,0,0]=4 265 B10R1.16 CO\N=C\c1ccc(Br)o1 Amb27408473 [0,1,0,0,0,0|3,0,0]=4 266 B10R1.16 C\C=C\Sc1ccc(C)o1 Amb27778637 [0,1,0,0,0,0|2,0,0]=3 267 B10R1.16 Cc1cc(CCC=O)on1 Amb33326420 [0,1,0,0,0,0|1,0,2]=4 268 B10R1.16 Cc1cc(\C=C\C=O)no1 Amb33316704 [0,1,0,0,0,0|2,0,0]=3 269 B10R1.16 Cc1cc(\C=C\C=O)on1 Amb33429946 [0,1,0,0,0,0|1,0,0]=2 270 B10R1.16 Cc1cc(\C=C\C=O)sn1 Amb35719815 [0,1,0,0,0,0|1,1,0]=3 271 B10R1.16 Cc1cc(\C=C\CCl)on1 Amb27812542 [0,1,0,0,0,0|2,0,1]=4 272 B10R1.16 Cc1cc(\C=C\CN)on1 Amb33359080 [0,1,0,0,0,0|2,0,1]=4 273 B10R1.16 Cc1cc(\C=C\CO)on1 Amb33474385 [0,1,0,0,0,0|1,0,2]=4 274 B10R1.16 Cc1ccc(CCC=O)o1 Amb2794106 [0,1,0,0,0,0|0,0,2]=3 275 B10R1.16 Cc1ccc(CCC=O)s1 Amb24720268 [0,1,0,0,0,0|0,1,2]=4 276 B10R1.16 Cc1ccc(CN=C=O)o1 Amb19648776 [0,1,0,0,0,0|1,0,2]=4 277 B10R1.16 Cc1ccc(CNC=O)o1 Amb27238043 [0,1,0,0,0,0|1,0,1]=3 278 B10R1.16 Cc1ccc(\C=C\C#N)o1 Amb27268196 [0,1,0,0,0,0|1,0,1]=3 279 B10R1.16 Cc1ccc(\C=C\C=O)o1 Amb17593442 [0,1,0,0,0,0|0,0,0]=1 280 B10R1.16 Cc1ccc(\C=C\C=O)s1 Amb33136417 [0,1,0,0,0,0|0,1,0]=2 281 B10R1.16 Cc1ccc(\C=C\CN)o1 Amb25139173 [0,1,0,0,0,0|1,0,1]=3 282 B10R1.16 Cc1ccc(\C=C\CN)s1 Amb33136492 [0,1,0,0,0,0|1,1,1]=4 283 B10R1.16 Cc1ccc(\C=C\CO)o1 Amb17593490 [0,1,0,0,0,0|0,0,2]=3 284 B10R1.16 Cc1ccc(\C=C\CO)s1 Amb33136413 [0,1,0,0,0,0|0,1,2]=4 285 B10R1.16 Cc1cnc(\C=C\C=O)s1 Amb28057892 [0,1,0,0,0,0|1,1,0]=3 286 B10R1.16 Cc1coc(SCC=O)n1 Amb28324437 [0,1,0,0,0,0|2,0,1]=4 287 B10R1.16 Cc1csc(CCC=O)c1 Amb33373461 [0,1,0,0,0,0|0,1,2]=4 288 B10R1.16 Cc1csc(CNC=O)c1 Amb27185562 [0,1,0,0,0,0|1,1,1]=4 289 B10R1.16 Cc1csc(\C=C\C=O)c1 Amb33427137 [0,1,0,0,0,0|0,1,0]=2 290 B10R1.16 Cc1csc(\C=C\CN)c1 Amb33427135 [0,1,0,0,0,0|1,1,1]=4 291 B10R1.16 Cc1csc(\C=C\CO)c1 Amb33427136 [0,1,0,0,0,0|0,1,2]=4 292 B10R1.16 Cc1nc(\C=C\C=O)cs1 Amb32954224 [0,1,0,0,0,0|2,0,0]=3 293 B10R1.16 Cc1ncc(CNC=O)o1 Amb28073187 [0,1,0,0,0,0|2,0,1]=4 294 B10R1.16 Cc1ncc(\C=C\C=O)s1 Amb32953984 [0,1,0,0,0,0|1,1,0]=3 295 B10R1.16 Clc1ccc(\C=C\CBr)o1 Amb28050906 [0,1,0,0,0,0|1,0,1]=3 296 B10R1.16 Cn1cc(\C=C\C=O)cn1 Amb33136420 [0,1,0,0,0,0|3,0,0]=4 297 B10R1.16 Cn1cc(\C=C\C=O)nn1 Amb26587527 [0,1,0,0,0,0|3,0,0]=4 298 B10R1.16 Cn1ccc(\C=C\C=O)n1 Amb32725249 [0,1,0,0,0,0|2,0,0]=3 299 B10R1.16 Cn1cnc(\C=C\C=O)c1 Amb33359161 [0,1,0,0,0,0|2,0,0]=3 300 B10R1.16 Cn1ncc(\C=C\C=O)n1 Amb28285984 [0,1,0,0,0,0|3,0,0]=4 301 B10R1.16 N#C\C=C\c1cc(Br)cs1 Amb27875059 [0,1,0,0,0,0|1,1,1]=4 302 B10R1.16 N#C\C=C\c1ccc(Br)o1 Amb27799316 [0,1,0,0,0,0|1,0,1]=3 303 B10R1.16 NC\C=C\c1cc(Br)co1 Amb33431900 [0,1,0,0,0,0|1,0,1]=3 304 B10R1.16 NC\C=C\c1cc(Br)cs1 Amb18065174 [0,1,0,0,0,0|1,1,1]=4 305 B10R1.16 NC\C=C\c1cc(Cl)cs1 Amb33390731 [0,1,0,0,0,0|1,1,1]=4 306 B10R1.16 NC\C=C\c1ccc(Br)o1 Amb27765203 [0,1,0,0,0,0|1,0,1]=3 307 B10R1.16 NC\C=C\c1ccc(Br)s1 Amb18066244 [0,1,0,0,0,0|1,1,1]=4 308 B10R1.16 NC\C=C\c1ccc(Cl)o1 Amb33407181 [0,1,0,0,0,0|1,0,1]=3 309 B10R1.16 NC\C=C\c1ccc(Cl)s1 Amb18065502 [0,1,0,0,0,0|1,1,1]=4 310 B10R1.16 O=C=NCc1cc(Br)co1 Amb33431529 [0,1,0,0,0,0|1,0,2]=4 311 B10R1.16 O=C=NCc1ccc(Br)o1 Amb24646002 [0,1,0,0,0,0|1,0,2]=4 312 B10R1.16 O=C=NCc1ccc(Cl)o1 Amb33258314 [0,1,0,0,0,0|1,0,2]=4 313 B10R1.16 O=CCCc1cc(Br)co1 Amb33431940 [0,1,0,0,0,0|0,0,2]=3 314 B10R1.16 O=CCCc1cc(Br)cs1 Amb26363941 [0,1,0,0,0,0|0,1,2]=4 315 B10R1.16 O=CCCc1cc(Cl)cs1 Amb33058557 [0,1,0,0,0,0|0,1,2]=4 316 B10R1.16 O=CCCc1ccc(Br)o1 Amb24690247 [0,1,0,0,0,0|0,0,2]=3 317 B10R1.16 O=CCCc1ccc(Br)s1 Amb26913485 [0,1,0,0,0,0|0,1,2]=4 318 B10R1.16 O=CCCc1ccc(Cl)o1 Amb26916053 [0,1,0,0,0,0|0,0,2]=3 319 B10R1.16 O=CCCc1ccc(Cl)s1 Amb18803947 [0,1,0,0,0,0|0,1,2]=4 320 B10R1.16 O=CCCc1ccc(F)o1 Amb27240180 [0,1,0,0,0,0|0,0,2]=3 321 B10R1.16 O=CCSc1ccc(Br)s1 Amb17082937 [0,1,0,0,0,0|1,1,1]=4 322 B10R1.16 O=CCSc1ccc(Cl)s1 Amb17082930 [0,1,0,0,0,0|1,1,1]=4 323 B10R1.16 O=CNCc1ccc(Cl)o1 Amb35635341 [0,1,0,0,0,0|1,0,1]=3 324 B10R1.16 O=C\C=C/C1=CC(=O)OC1 Amb18643212 [0,1,0,0,0,0|2,0,0]=3 325 B10R1.16 O=C\C=C\C1C=CC(=O)O1 Amb27185828 [0,1,0,0,0,0|0,0,1]=2 326 B10R1.16 O=C\C=C\C1CCC(=O)O1 Amb24524332 [0,1,0,0,0,0|0,0,3]=4 327 B10R1.16 O=C\C=C\c1cc(Br)co1 Amb33431864 [0,1,0,0,0,0|0,0,0]=1 328 B10R1.16 O=C\C=C\c1cc(Br)cs1 Amb33136419 [0,1,0,0,0,0|0,1,0]=2 329 B10R1.16 O=C\C=C\c1cc(Cl)cs1 Amb27238215 [0,1,0,0,0,0|0,1,0]=2 330 B10R1.16 O=C\C=C\c1ccc(Br)o1 Amb18130678 [0,1,0,0,0,0|0,0,0]=1 331 B10R1.16 O=C\C=C\c1ccc(Br)s1 Amb27184057 [0,1,0,0,0,0|0,1,0]=2 332 B10R1.16 O=C\C=C\c1ccc(Cl)o1 Amb18644875 [0,1,0,0,0,0|0,0,0]=1 333 B10R1.16 O=C\C=C\c1ccc(Cl)s1 Amb33261658 [0,1,0,0,0,0|0,1,0]=2 334 B10R1.16 O=C\C=C\c1cnc(Cl)s1 Amb33221345 [0,1,0,0,0,0|1,1,0]=3 335 B10R1.16 O=C\C=C\c1csc(Br)c1 Amb33451389 [0,1,0,0,0,0|2,0,0]=3 336 B10R1.16 O=C\C=C\c1csc(Br)n1 Amb33335373 [0,1,0,0,0,0|2,0,0]=3 337 B10R1.16 O=C\C=C\c1ncc(Br)s1 Amb33436092 [0,1,0,0,0,0|1,1,0]=3 338 B10R1.16 O=C\C=C\c1ncc(I)s1 Amb27960225 [0,1,0,0,0,0|1,1,0]=3 339 B10R1.16 OC\C=C\c1cc(Br)co1 Amb33431896 [0,1,0,0,0,0|0,0,2]=3 340 B10R1.16 OC\C=C\c1cc(Br)cs1 Amb33136415 [0,1,0,0,0,0|0,1,2]=4 341 B10R1.16 OC\C=C\c1cc(Cl)cs1 Amb33220747 [0,1,0,0,0,0|0,1,2]=4 342 B10R1.16 OC\C=C\c1ccc(Br)o1 Amb27403742 [0,1,0,0,0,0|0,0,2]=3 343 B10R1.16 OC\C=C\c1ccc(Br)s1 Amb33136407 [0,1,0,0,0,0|0,1,2]=4 344 B10R1.16 OC\C=C\c1ccc(Cl)o1 Amb33390418 [0,1,0,0,0,0|0,0,2]=3 345 B10R1.16 OC\C=C\c1ccc(Cl)s1 Amb33406481 [0,1,0,0,0,0|0,1,2]=4 346 B10R1.21 BrCC\C=C\c1ccco1 Amb24572899 [0,1,0,0,0,0|1,0,1]=3 347 B10R1.21 BrCC\C=C\c1cccs1 Amb17141007 [0,1,0,0,0,0|1,1,1]=4 348 B10R1.21 C=CCNCc1ccco1 Amb19890257 [0,1,0,0,0,0|1,0,2]=4 349 B10R1.21 C=CCNCc1ccco1 Amb5261474 [0,1,0,0,0,0|1,0,2]=4 350 B10R1.21 C=CCSCc1ccco1 Amb26336655 [0,1,0,0,0,0|1,0,2]=4 351 B10R1.21 CCO\N=C\c1ccco1 Amb26411540 [0,1,0,0,0,0|2,0,1]=4 352 B10R1.21 CC\C=C\Cc1ccco1 Amb24558353 [0,1,0,0,0,0|1,0,1]=3 353 B10R1.21 CNC\C=C\c1cccs1 Amb23555589 [0,1,0,0,0,0|1,1,1]=4 354 B10R1.21 C\C=C\C#Cc1ccco1 Amb27191763 [0,1,0,0,0,0|1,0,1]=3 355 B10R1.21 C\C=C\CSc1ncco1 Amb27424942 [0,1,0,0,0,0|2,0,1]=4 356 B10R1.21 ClCC\C=C\c1cccs1 Amb17232925 [0,1,0,0,0,0|1,1,1]=4 357 B10R1.21 Cl\C=C\C#Cc1cccs1 Amb27440006 [0,1,0,0,0,0|1,1,1]=4 358 B10R1.21 Cl\C=C\SCc1ccco1 Amb27219625 [0,1,0,0,0,0|1,0,1]=3 359 B10R1.21 N#CC\C=C\c1ccco1 Amb24360130 [0,1,0,0,0,0|1,0,1]=3 360 B10R1.21 N#CC\C=C\c1cccs1 Amb24700344 [0,1,0,0,0,0|1,1,1]=4 361 B10R1.21 NCC\C=C\c1ccco1 Amb27400758 [0,1,0,0,0,0|1,0,1]=3 362 B10R1.21 NCC\C=C\c1cccs1 Amb17138447 [0,1,0,0,0,0|1,1,1]=4 363 B10R1.21 O=C=NCCc1ccco1 Amb17231900 [0,1,0,0,0,0|0,0,3]=4 364 B10R1.21 O=C=N\C=C\c1ccco1 Amb27984198 [0,1,0,0,0,0|0,0,1]=2 365 B10R1.21 O=C=N\C=C\c1cccs1 Amb25945396 [0,1,0,0,0,0|0,1,1]=3 366 B10R1.21 O=CCCCc1ccco1 Amb28050259 [0,1,0,0,0,0|0,0,2]=3 367 B10R1.21 O=CCCCc1cccs1 Amb17089166 [0,1,0,0,0,0|0,1,2]=4 368 B10R1.21 O=CCCCc1cnco1 Amb24478357 [0,1,0,0,0,0|1,0,2]=4 369 B10R1.21 O=CCCSc1cccs1 Amb17082969 [0,1,0,0,0,0|0,1,2]=4 370 B10R1.21 O=CNCCc1cccs1 Amb28141381 [0,1,0,0,0,0|0,1,2]=4 371 B10R1.21 O=CN\C=C\c1cccs1 Amb27482776 [0,1,0,0,0,0|0,1,0]=2 372 B10R1.21 O=CN\N=C\c1ccco1 Amb28184754 [0,1,0,0,0,0|1,0,0]=2 373 B10R1.21 O=CO\C=C\c1ccco1 Amb28436284 [0,1,0,0,0,0|0,0,0]=1 374 B10R1.21 OCC\C=C\c1cccs1 Amb27197496 [0,1,0,0,0,0|0,1,2]=4 375 B10R1.21 OCC\N=C\c1ccco1 Amb17593526 [0,1,0,0,0,0|0,0,3]=4 376 B10R1.21 O\N=C\C=C\c1ccco1 Amb27765781 [0,1,0,0,0,0|0,0,1]=2 377 B10R1.21 [N-]=[N+]=N\C=C\c1cccs1 Amb24519605 [0,1,0,0,0,0|2,1,0]=4 378 B10R1.27 C#C\C(C)=C\c1ccco1 Amb33311315 [0,1,0,0,0,0|1,0,1]=3 379 B10R1.27 C=CC(=O)Cc1ccco1 Amb27476270 [0,1,0,0,0,0|1,0,1]=3 380 B10R1.27 C=C\C(C)=C/c1ccco1 Amb27440408 [0,1,0,0,0,0|1,0,0]=2 381 B10R1.27 C=C\C(C)=C\c1ccco1 Amb33359794 [0,1,0,0,0,0|1,0,0]=2 382 B10R1.27 CC(C=O)Sc1cccs1 Amb30034330 [0,1,0,0,0,0|1,1,1]=4 383 B10R1.27 CC(C=O)Sc1ncco1 Amb35652159 [0,1,0,0,0,0|2,0,1]=4 384 B10R1.27 CCC(=O)Cc1ccco1 Amb1102322 [0,1,0,0,0,0|1,0,2]=4 385 B10R1.27 CCC(=O)Sc1ccco1 Amb27968127 [0,1,0,0,0,0|2,0,1]=4 386 B10R1.27 CN(C=O)Cc1cccs1 Amb27667566 [0,1,0,0,0,0|1,1,1]=4 387 B10R1.27 COC(=O)Nc1ccco1 Amb28241377 [0,1,0,0,0,0|3,0,0]=4 388 B10R1.27 COC(=O)Oc1ccco1 Amb27974836 [0,1,0,0,0,0|3,0,0]=4 389 B10R1.27 CSC(=O)Cc1ccco1 Amb27843701 [0,1,0,0,0,0|2,0,1]=4 390 B10R1.27 C[C@H](C=O)Cc1ccco1 Amb27861368 [0,1,0,0,0,0|0,0,2]=3 391 B10R1.27 C\C(=C/c1ccco1)CBr Amb33136397 [0,1,0,0,0,0|1,0,1]=3 392 B10R1.27 C\C(=C/c1ccco1)CCl Amb33136399 [0,1,0,0,0,0|1,0,1]=3 393 B10R1.27 C\C(=C/c1ccco1)CN Amb33136395 [0,1,0,0,0,0|1,0,1]=3 394 B10R1.27 C\C(=C/c1ccco1)CO Amb27185698 [0,1,0,0,0,0|0,0,2]=3 395 B10R1.27 C\C(=C/c1ccco1)CS Amb33197995 [0,1,0,0,0,0|0,1,1]=3 396 B10R1.27 C\C(=C\c1ccco1)CO Amb28240574 [0,1,0,0,0,0|0,0,2]=3 397 B10R1.27 C\C(=C\c1cccs1)CBr Amb27262831 [0,1,0,0,0,0|1,1,1]=4 398 B10R1.27 C\C(=C\c1cccs1)CCl Amb27591691 [0,1,0,0,0,0|1,1,1]=4 399 B10R1.27 C\C(C#N)=C/c1ccco1 Amb18642923 [0,1,0,0,0,0|1,0,1]=3 400 B10R1.27 C\C(C#N)=C\c1ccco1 Amb27444803 [0,1,0,0,0,0|1,0,1]=3 401 B10R1.27 C\C(C=O)=C/c1ccco1 Amb3599297 [0,1,0,0,0,0|0,0,0]=1 402 B10R1.27 C\C(C=O)=C/c1cccs1 Amb17334333 [0,1,0,0,0,0|0,1,0]=2 403 B10R1.27 C\C(C=O)=C/c1ccns1 Amb35719812 [0,1,0,0,0,0|1,1,0]=3 404 B10R1.27 C\C(C=O)=C/c1ccsc1 Amb18644530 [0,1,0,0,0,0|2,0,0]=3 405 B10R1.27 C\C(C=O)=C/c1cncs1 Amb27405461 [0,1,0,0,0,0|1,1,0]=3 406 B10R1.27 C\C(C=O)=C\c1ccco1 Amb2792767 [0,1,0,0,0,0|0,0,0]=1 407 B10R1.27 C\C(C=O)=C\c1ccoc1 Amb28050918 [0,1,0,0,0,0|2,0,0]=3 408 B10R1.27 C\C(C=O)=C\c1ccsc1 Amb27402244 [0,1,0,0,0,0|2,0,0]=3 409 B10R1.27 C\C(C=O)=C\c1nccs1 Amb27172890 [0,1,0,0,0,0|1,1,0]=3 410 B10R1.27 NCC(=O)Cc1ccco1 Amb18251183 [0,1,0,0,0,0|1,0,2]=4 411 B10R1.27 NCC(=O)Oc1ccco1 Amb28428465 [0,1,0,0,0,0|2,0,1]=4 412 B10R1.27 NNC(=O)Cc1ccco1 Amb27261852 [0,1,0,0,0,0|2,0,1]=4 413 B10R1.27 N\C(=C/c1cccs1)CO Amb28245870 [0,1,0,0,0,0|0,1,2]=4 414 B10R1.27 N\C(=C\c1cccs1)CO Amb27624553 [0,1,0,0,0,0|0,1,2]=4 415 B10R1.27 N\C(Cc1ccco1)=N\O Amb27769895 [0,1,0,0,0,0|1,0,2]=4 416 B10R1.27 O=C(CCl)Cc1ccco1 Amb27214672 [0,1,0,0,0,0|1,0,2]=4 417 B10R1.27 O=C(CCl)Nc1ccco1 Amb27184026 [0,1,0,0,0,0|2,0,1]=4 418 B10R1.27 O=C(CO)Cc1ccco1 Amb27226948 [0,1,0,0,0,0|0,0,3]=4 419 B10R1.27 O=CC(=O)Cc1ccco1 Amb27180510 [0,1,0,0,0,0|0,0,1]=2 420 B10R1.27 O=CC(O)Cc1ccco1 Amb27174865 [0,1,0,0,0,0|0,0,2]=3 421 B10R1.27 O=C\C(Cl)=C/c1cccs1 Amb27227152 [0,1,0,0,0,0|0,1,0]=2 422 B10R1.27 O=C\C(Cl)=C\c1ccco1 Amb27166107 [0,1,0,0,0,0|0,0,0]=1 423 B10R1.27 O=C\C(F)=C\c1cccs1 Amb27770449 [0,1,0,0,0,0|0,1,0]=2 424 B10R1.27 OC\C(F)=C\c1cccs1 Amb27829738 [0,1,0,0,0,0|0,1,2]=4 425 B10R1.29 BrC\C=C\c1sccc1Br Amb28049456 [0,1,0,0,0,0|1,1,1]=4 426 B10R1.29 C=CCCc1occc1Br Amb29863834 [0,1,0,0,0,0|1,0,2]=4 427 B10R1.29 CC\C=C\c1oncc1N Amb33272608 [0,1,0,0,0,0|2,0,1]=4 428 B10R1.29 Cc1ccoc1CCC=O Amb33343122 [0,1,0,0,0,0|0,0,2]=3 429 B10R1.29 Cc1ccoc1CN=C=O Amb25057025 [0,1,0,0,0,0|1,0,2]=4 430 B10R1.29 Cc1ccoc1\C=C\C=O Amb32954708 [0,1,0,0,0,0|0,0,0]=1 431 B10R1.29 Cc1ccoc1\C=C\CBr Amb28144293 [0,1,0,0,0,0|1,0,1]=3 432 B10R1.29 Cc1ccoc1\C=C\CN Amb33474801 [0,1,0,0,0,0|1,0,1]=3 433 B10R1.29 Cc1ccoc1\C=C\CO Amb33079472 [0,1,0,0,0,0|0,0,2]=3 434 B10R1.29 Cc1ccsc1CCC=O Amb26454122 [0,1,0,0,0,0|0,1,2]=4 435 B10R1.29 Cc1ccsc1\C=C\C=O Amb33136416 [0,1,0,0,0,0|0,1,0]=2 436 B10R1.29 Cc1ccsc1\C=C\CCl Amb28146518 [0,1,0,0,0,0|1,1,1]=4 437 B10R1.29 Cc1ccsc1\C=C\CN Amb33136501 [0,1,0,0,0,0|1,1,1]=4 438 B10R1.29 Cc1ccsc1\C=C\CO Amb33136400 [0,1,0,0,0,0|0,1,2]=4 439 B10R1.29 Cc1cscc1\C=C\C=O Amb33145868 [0,1,0,0,0,0|2,0,0]=3 440 B10R1.29 Cc1ncsc1\C=C\C=O Amb33358465 [0,1,0,0,0,0|1,1,0]=3 441 B10R1.29 Cc1occc1\C=C\C=O Amb33358783 [0,1,0,0,0,0|2,0,0]=3 442 B10R1.29 Cc1oncc1\C=C\C=O Amb33361406 [0,1,0,0,0,0|3,0,0]=4 443 B10R1.29 ClC\C=C\c1sccc1Cl Amb27443904 [0,1,0,0,0,0|1,1,1]=4 444 B10R1.29 Cn1cccc1CCC=O Amb26546875 [0,1,0,0,0,0|1,0,2]=4 445 B10R1.29 Cn1cccc1\C=C\C#N Amb28193251 [0,1,0,0,0,0|2,0,1]=4 446 B10R1.29 Cn1cccc1\C=C\C=O Amb18124458 [0,1,0,0,0,0|1,0,0]=2 447 B10R1.29 Cn1cccc1\C=C\CN Amb28325402 [0,1,0,0,0,0|2,0,1]=4 448 B10R1.29 Cn1cccc1\C=C\CO Amb24601782 [0,1,0,0,0,0|1,0,2]=4 449 B10R1.29 Cn1ccnc1\C=C\C=O Amb33359231 [0,1,0,0,0,0|2,0,0]=3 450 B10R1.29 Cn1cncc1\C=C\C=O Amb28312849 [0,1,0,0,0,0|2,0,0]=3 451 B10R1.29 Cn1nccc1\C=C\C=O Amb33080181 [0,1,0,0,0,0|2,0,0]=3 452 B10R1.29 Cn1nncc1\C=C\C=O Amb33146041 [0,1,0,0,0,0|3,0,0]=4 453 B10R1.29 N#C\C=C\c1sccc1Br Amb27621503 [0,1,0,0,0,0|1,1,1]=4 454 B10R1.29 NC\C=C\c1sccc1Br Amb33451103 [0,1,0,0,0,0|1,1,1]=4 455 B10R1.29 NC\C=C\c1sccc1Cl Amb27444315 [0,1,0,0,0,0|1,1,1]=4 456 B10R1.29 O=CCCc1occc1Br Amb28194630 [0,1,0,0,0,0|0,0,2]=3 457 B10R1.29 O=CCCc1sccc1Br Amb25838062 [0,1,0,0,0,0|0,1,2]=4 458 B10R1.29 O=CCCc1sccc1Cl Amb26969365 [0,1,0,0,0,0|0,1,2]=4 459 B10R1.29 O=CNCc1sccc1Br Amb28049593 [0,1,0,0,0,0|1,1,1]=4 460 B10R1.29 O=C\C=C\c1occc1Br Amb27839525 [0,1,0,0,0,0|0,0,0]=1 461 B10R1.29 O=C\C=C\c1sccc1Br Amb33242845 [0,1,0,0,0,0|0,1,0]=2 462 B10R1.29 O=C\C=C\c1sccc1Cl Amb27847772 [0,1,0,0,0,0|0,1,0]=2 463 B10R1.29 OC\C=C\c1occc1Br Amb27238915 [0,1,0,0,0,0|0,0,2]=3 464 B10R1.29 OC\C=C\c1sccc1Br Amb33241635 [0,1,0,0,0,0|0,1,2]=4 465 B10R1.29 OC\C=C\c1sccc1Cl Amb27964959 [0,1,0,0,0,0|0,1,2]=4 466 B10R1.66 C=C(O)OCc1ccco1 Amb27861064 [0,1,0,0,0,0|1,0,2]=4 467 B10R1.66 CC(=N)NCc1ccco1 Amb27412338 [0,1,0,0,0,0|2,0,1]=4 468 B10R1.66 CC(=O)CCc1ccco1 Amb1107538 [0,1,0,0,0,0|0,0,2]=3 469 B10R1.66 CC(=O)CCc1cccs1 Amb5740049 [0,1,0,0,0,0|0,1,2]=4 470 B10R1.66 CC(=O)CCc1cnco1 Amb18832107 [0,1,0,0,0,0|1,0,2]=4 471 B10R1.66 CC(=O)CCc1ncco1 Amb18832106 [0,1,0,0,0,0|1,0,2]=4 472 B10R1.66 CC(=O)CSc1cccs1 Amb2724458 [0,1,0,0,0,0|1,1,1]=4 473 B10R1.66 CC(=O)NCc1ccco1 Amb1209246 [0,1,0,0,0,0|1,0,1]=3 474 B10R1.66 CC(=O)NCc1cccs1 Amb1218150 [0,1,0,0,0,0|1,1,1]=4 475 B10R1.66 CC(=O)NCc1ccno1 Amb27868350 [0,1,0,0,0,0|2,0,1]=4 476 B10R1.66 CC(=O)OCc1ccco1 Amb4334378 [0,1,0,0,0,0|1,0,1]=3 477 B10R1.66 CC(=O)\C=C/c1ccco1 Amb25066388 [0,1,0,0,0,0|0,0,0]=1 478 B10R1.66 CC(=O)\C=C\C1=CCCC1 Amb25209541 [0,1,0,0,0,0|1,0,2]=4 479 B10R1.66 CC(=O)\C=C\c1ccco1 Amb6608963 [0,1,0,0,0,0|0,0,0]=1 480 B10R1.66 CC(=O)\C=C\c1cccs1 Amb33512960 [0,1,0,0,0,0|0,1,0]=2 481 B10R1.66 CC(=O)\C=C\c1ccns1 Amb35720406 [0,1,0,0,0,0|1,1,0]=3 482 B10R1.66 CC(=O)\C=C\c1ccoc1 Amb24479175 [0,1,0,0,0,0|2,0,0]=3 483 B10R1.66 CC(=O)\C=C\c1ccon1 Amb33199366 [0,1,0,0,0,0|2,0,0]=3 484 B10R1.66 CC(=O)\C=C\c1ccsc1 Amb22370887 [0,1,0,0,0,0|2,0,0]=3 485 B10R1.66 CC(=O)\C=C\c1cnco1 Amb33319933 [0,1,0,0,0,0|1,0,0]=2 486 B10R1.66 CC(=O)\C=C\c1cncs1 Amb33359799 [0,1,0,0,0,0|1,1,0]=3 487 B10R1.66 CC(=O)\C=C\c1cnsc1 Amb26986340 [0,1,0,0,0,0|3,0,0]=4 488 B10R1.66 CC(=O)\C=C\c1cscn1 Amb32954498 [0,1,0,0,0,0|2,0,0]=3 489 B10R1.66 CC(=O)\C=C\c1csnn1 Amb33474077 [0,1,0,0,0,0|3,0,0]=4 490 B10R1.66 CC(=O)\C=C\c1nccs1 Amb33449103 [0,1,0,0,0,0|1,1,0]=3 491 B10R1.66 CC(C)\N=C\c1ccco1 Amb26390881 [0,1,0,0,0,0|2,0,1]=4 492 B10R1.66 CC(Cl)\C=C\c1ccco1 Amb28068285 [0,1,0,0,0,0|1,0,1]=3 493 B10R1.66 CC(Cl)\C=C\c1cccs1 Amb27951483 [0,1,0,0,0,0|1,1,1]=4 494 B10R1.66 CC(N)\C=C\c1ccco1 Amb33362421 [0,1,0,0,0,0|1,0,1]=3 495 B10R1.66 CC(N)\C=C\c1cccs1 Amb33359023 [0,1,0,0,0,0|1,1,1]=4 496 B10R1.66 CC(N)\C=C\c1cnco1 Amb33319912 [0,1,0,0,0,0|2,0,1]=4 497 B10R1.66 CC(O)\C=C\c1ccco1 Amb24504965 [0,1,0,0,0,0|0,0,2]=3 498 B10R1.66 CC(O)\C=C\c1cccs1 Amb25097279 [0,1,0,0,0,0|0,1,2]=4 499 B10R1.66 CN(C)\N=C\c1ccco1 Amb16192915 [0,1,0,0,0,0|3,0,0]=4 500 B10R1.66 CS(=O)\N=C\c1ccco1 Amb35681668 [0,1,0,0,0,0|2,0,0]=3 501 B10R1.66 CS(=O)\N=C\c1cccs1 Amb35681657 [0,1,0,0,0,0|2,1,0]=4 502 B10R1.66 C[C@@H](O)\C=C\c1cccs1 Amb28050630 [0,1,0,0,0,0|0,1,2]=4 503 B10R1.66 C[C@H](O)\C=C\c1cccs1 Amb28050629 [0,1,0,0,0,0|0,1,2]=4 504 B10R1.66 N=C(N)CCc1ccco1 Amb18063862 [0,1,0,0,0,0|1,0,2]=4 505 B10R1.66 N=C(N)NCc1ccco1 Amb1981457 [0,1,0,0,0,0|2,0,1]=4 506 B10R1.66 NC(=O)C#Cc1ccco1 Amb28340501 [0,1,0,0,0,0|0,0,2]=3 507 B10R1.66 NC(=O)C#Cc1cccs1 Amb26378787 [0,1,0,0,0,0|0,1,2]=4 508 B10R1.66 NC(=O)CSc1cccs1 Amb4330204 [0,1,0,0,0,0|1,1,1]=4 509 B10R1.66 NC(=O)NCc1ccco1 Amb1105644 [0,1,0,0,0,0|1,0,1]=3 510 B10R1.66 NC(=O)NCc1cccs1 Amb1106145 [0,1,0,0,0,0|1,1,1]=4 511 B10R1.66 NC(=O)OCc1ccco1 Amb28424169 [0,1,0,0,0,0|1,0,1]=3 512 B10R1.66 NC(=O)\C=C/c1ccoc1 Amb27493171 [0,1,0,0,0,0|2,0,0]=3 513 B10R1.66 NC(=O)\C=C\C1=CCCC1 Amb28315908 [0,1,0,0,0,0|1,0,2]=4 514 B10R1.66 NC(=O)\C=C\c1ccco1 Amb6387328 [0,1,0,0,0,0|0,0,0]=1 515 B10R1.66 NC(=O)\C=C\c1cccs1 Amb3429140 [0,1,0,0,0,0|0,1,0]=2 516 B10R1.66 NC(=O)\C=C\c1ccns1 Amb24558336 [0,1,0,0,0,0|1,1,0]=3 517 B10R1.66 NC(=O)\C=C\c1cscn1 Amb28370560 [0,1,0,0,0,0|2,0,0]=3 518 B10R1.66 NC(=S)NCc1ccco1 Amb1152245 [0,1,0,0,0,0|1,1,1]=4 519 B10R1.66 NC(=S)\C=C/c1ccco1 Amb18108368 [0,1,0,0,0,0|0,1,0]=2 520 B10R1.66 NC(=[NH2+])NCc1ccco1 Amb9799916 [0,1,0,0,0,0|2,0,1]=4 521 B10R1.66 O=C(Cl)CCc1cccs1 Amb23440823 [0,1,0,0,0,0|0,1,2]=4 522 B10R1.66 O=C(Cl)NCc1ccco1 Amb35636921 [0,1,0,0,0,0|1,0,1]=3 523 B10R1.66 O=C(Cl)NCc1cccs1 Amb30028127 [0,1,0,0,0,0|1,1,1]=4 524 B10R1.66 O=C(Cl)OCc1ccco1 Amb26542188 [0,1,0,0,0,0|1,0,1]=3 525 B10R1.66 O=C(Cl)OCc1cccs1 Amb28049418 [0,1,0,0,0,0|1,1,1]=4 526 B10R1.66 O=C(Cl)\C=C/c1ccco1 Amb26581586 [0,1,0,0,0,0|0,0,0]=1 527 B10R1.66 O=C(Cl)\C=C\c1ccco1 Amb16230244 [0,1,0,0,0,0|0,0,0]=1 528 B10R1.66 O=C(Cl)\C=C\c1cccs1 Amb7173093 [0,1,0,0,0,0|0,1,0]=2 529 B10R1.66 O=C(Cl)\C=C\c1ccsc1 Amb8385105 [0,1,0,0,0,0|2,0,0]=3 530 B10R1.66 O=C(O)C#Cc1ccco1 Amb20672984 [0,1,0,0,0,0|0,0,2]=3 531 B10R1.66 O=C(O)C#Cc1cccs1 Amb17138439 [0,1,0,0,0,0|0,1,2]=4 532 B10R1.66 O=C(O)C#Cc1cnco1 Amb33168946 [0,1,0,0,0,0|1,0,2]=4 533 B10R1.66 O=C(O)CCc1ccco1 Amb1153073 [0,1,0,0,0,0|0,0,2]=3 534 B10R1.66 O=C(O)CCc1cccs1 Amb1154297 [0,1,0,0,0,0|0,1,2]=4 535 B10R1.66 O=C(O)CCc1ccno1 Amb1092001 [0,1,0,0,0,0|1,0,2]=4 536 B10R1.66 O=C(O)CCc1cnco1 Amb22011672 [0,1,0,0,0,0|1,0,2]=4 537 B10R1.66 O=C(O)CCc1ncco1 Amb17399867 [0,1,0,0,0,0|1,0,2]=4 538 B10R1.66 O=C(O)CNc1ccco1 Amb27846560 [0,1,0,0,0,0|1,0,1]=3 539 B10R1.66 O=C(O)CNc1cccs1 Amb26516474 [0,1,0,0,0,0|1,1,1]=4 540 B10R1.66 O=C(O)COc1ccco1 Amb28050105 [0,1,0,0,0,0|1,0,1]=3 541 B10R1.66 O=C(O)COc1cccs1 Amb27233232 [0,1,0,0,0,0|1,1,1]=4 542 B10R1.66 O=C(O)COc1cnco1 Amb33319560 [0,1,0,0,0,0|2,0,1]=4 543 B10R1.66 O=C(O)CSc1ccco1 Amb27975289 [0,1,0,0,0,0|1,0,1]=3 544 B10R1.66 O=C(O)CSc1cccs1 Amb2796029 [0,1,0,0,0,0|1,1,1]=4 545 B10R1.66 O=C(O)\C=C/c1ccco1 Amb26458726 [0,1,0,0,0,0|0,0,0]=1 546 B10R1.66 O=C(O)\C=C/c1cccs1 Amb27658635 [0,1,0,0,0,0|0,1,0]=2 547 B10R1.66 O=C(O)\C=C/c1ccsc1 Amb10071559 [0,1,0,0,0,0|2,0,0]=3 548 B10R1.66 O=C(O)\C=C\C1=CCCC1 Amb18643237 [0,1,0,0,0,0|1,0,2]=4 549 B10R1.66 O=C(O)\C=C\c1ccco1 Amb6335256 [0,1,0,0,0,0|0,0,0]=1 550 B10R1.66 O=C(O)\C=C\c1cccs1 Amb24076486 [0,1,0,0,0,0|0,1,0]=2 551 B10R1.66 O=C(O)\C=C\c1cccs1 Amb33716246 [0,1,0,0,0,0|0,1,0]=2 552 B10R1.66 O=C(O)\C=C\c1ccno1 Amb27851739 [0,1,0,0,0,0|1,0,0]=2 553 B10R1.66 O=C(O)\C=C\c1ccns1 Amb27234709 [0,1,0,0,0,0|1,1,0]=3 554 B10R1.66 O=C(O)\C=C\c1ccoc1 Amb33946022 [0,1,0,0,0,0|2,0,0]=3 555 B10R1.66 O=C(O)\C=C\c1ccon1 Amb33198351 [0,1,0,0,0,0|2,0,0]=3 556 B10R1.66 O=C(O)\C=C\c1ccsc1 Amb1154295 [0,1,0,0,0,0|2,0,0]=3 557 B10R1.66 O=C(O)\C=C\c1ccsn1 Amb24624065 [0,1,0,0,0,0|2,0,0]=3 558 B10R1.66 O=C(O)\C=C\c1cnco1 Amb32954265 [0,1,0,0,0,0|1,0,0]=2 559 B10R1.66 O=C(O)\C=C\c1cncs1 Amb33473685 [0,1,0,0,0,0|1,1,0]=3 560 B10R1.66 O=C(O)\C=C\c1cnns1 Amb33470055 [0,1,0,0,0,0|2,1,0]=4 561 B10R1.66 O=C(O)\C=C\c1cnsc1 Amb28239806 [0,1,0,0,0,0|3,0,0]=4 562 B10R1.66 O=C(O)\C=C\c1cnsn1 Amb18644786 [0,1,0,0,0,0|3,0,0]=4 563 B10R1.66 O=C(O)\C=C\c1cocn1 Amb24638306 [0,1,0,0,0,0|2,0,0]=3 564 B10R1.66 O=C(O)\C=C\c1cscn1 Amb8836304 [0,1,0,0,0,0|2,0,0]=3 565 B10R1.66 O=C(O)\C=C\c1csnn1 Amb33079448 [0,1,0,0,0,0|3,0,0]=4 566 B10R1.66 O=C(O)\C=C\c1ncco1 Amb26921286 [0,1,0,0,0,0|1,0,0]=2 567 B10R1.66 O=C(O)\C=C\c1nccs1 Amb8836307 [0,1,0,0,0,0|1,1,0]=3 568 B10R1.66 O=C(O)\C=C\n1ccnc1 Amb26919413 [0,1,0,0,0,0|3,0,0]=4 569 B10R1.66 O=C([O-])CCc1cccs1 Amb33512993 [0,1,0,0,0,0|0,1,2]=4 570 B10R1.66 O=C([O-])\C=C\c1ccsc1 Amb33512980 [0,1,0,0,0,0|2,0,0]=3 571 B10R1.66 O=N(=O)CCc1ccco1 Amb5498739 [0,1,0,0,0,0|1,0,2]=4 572 B10R1.66 O=N(=O)\C=C\c1cccs1 Amb20621961 [0,1,0,0,0,0|1,1,0]=3 573 B10R1.66 O=[N+]([O-])CCc1ccco1 Amb534787 [0,1,0,0,0,0|1,0,2]=4 574 B10R1.66 O=[N+]([O-])\C=C/c1cccs1 Amb4015634 [0,1,0,0,0,0|1,1,0]=3 575 B10R1.66 O=[N+]([O-])\C=C\c1ccco1 Amb6316064 [0,1,0,0,0,0|1,0,0]=2 576 B10R1.66 O=[N+]([O-])\C=C\c1cccs1 Amb6739796 [0,1,0,0,0,0|1,1,0]=3 577 B10R1.66 O=[N+]([O-])\C=C\c1ccns1 Amb35731136 [0,1,0,0,0,0|2,1,0]=4 578 B10R1.66 O=[N+]([O-])\C=C\c1ccoc1 Amb22643231 [0,1,0,0,0,0|3,0,0]=4 579 B10R1.66 O=[N+]([O-])\C=C\c1ccon1 Amb33197554 [0,1,0,0,0,0|3,0,0]=4 580 B10R1.66 O=[N+]([O-])\C=C\c1ccsc1 Amb2764123 [0,1,0,0,0,0|3,0,0]=4 581 B10R1.66 O=[N+]([O-])\C=C\c1cnco1 Amb28135374 [0,1,0,0,0,0|2,0,0]=3 582 B10R1.66 O=[N+]([O-])\C=C\c1cncs1 Amb27944585 [0,1,0,0,0,0|2,1,0]=4 583 B10R1.66 O=[N+]([O-])\C=C\c1cscn1 Amb33172546 [0,1,0,0,0,0|3,0,0]=4 584 B10R1.66 O=[N+]([O-])\C=C\c1ncco1 Amb28135361 [0,1,0,0,0,0|2,0,0]=3 585 B10R1.66 O=[N+]([O-])\C=C\c1nccs1 Amb24106743 [0,1,0,0,0,0|2,1,0]=4 586 B10R1.66 OB(O)\C=C\c1ccco1 Amb27760362 [0,1,0,0,0,0|1,0,1]=3 587 B10R1.66 OB(O)\C=C\c1cccs1 Amb25790951 [0,1,0,0,0,0|1,1,1]=4 588 B10R1.66 S=C(S)NCc1ccco1 Amb16231255 [0,1,0,0,0,0|1,1,1]=4 589 B8R0.1 C=C\C=C\C(=C)CC=O Amb26851275 [0,0,1,0,0,0|3,0,0]=4 590 B8R0.1 CC(=C\C=O)\C=C\C=O Amb27227121 [0,0,1,0,0,0|2,0,0]=3 591 B8R0.1 CCOC(=O)\C=C\C=O Amb18642570 [0,0,1,0,0,0|1,0,2]=4 592 B8R0.1 CC\C=C(C)/C=C/C=O Amb27435439 [0,0,1,0,0,0|1,0,2]=4 593 B8R0.1 CC\C=C(C)\C=C\C=O Amb28202059 [0,0,1,0,0,0|1,0,2]=4 594 B8R0.4 CCC\C=C/C=C/C=O Amb27643510 [0,0,1,0,0,0|1,0,2]=4 595 B8R0.4 CCC\C=C\C=C\C=O Amb8392848 [0,0,1,0,0,0|1,0,2]=4 596 B8R0.4 CC\C=C/C\C=C\C=O Amb28251042 [0,0,1,0,0,0|1,0,2]=4 597 B8R0.4 CO\C=C\C=C\C=C\Br Amb27634863 [0,0,1,0,0,0|3,0,0]=4 598 B8R0.4 CO\C=C\C=C\C=C\Cl Amb27243657 [0,0,1,0,0,0|3,0,0]=4 599 B8R0.4 C\C=C\C=C\C=C\C=O Amb17593248 [0,0,1,0,0,0|1,0,0]=2 600 B8R0.4 C\C=C\C=C\C=C\CBr Amb27424622 [0,0,1,0,0,0|2,0,1]=4 601 B8R0.4 C\C=C\CC\C=C\C=O Amb18642215 [0,0,1,0,0,0|1,0,2]=4 602 B8R0.4 C\C=C\C\C=C\CC=O Amb27489085 [0,0,1,0,0,0|1,0,2]=4 603 B8R0.4 O=CCC\C=C/C=C/Br Amb27484031 [0,0,1,0,0,0|1,0,2]=4 604 B8R0.4 O=C\C=C\C=C/CC=O Amb28285297 [0,0,1,0,0,0|0,0,2]=3 605 B8R0.4 O=C\C=C\C=C\C=C/Cl Amb27754044 [0,0,1,0,0,0|1,0,0]=2 606 B8R0.4 O=C\C=C\C=C\CC=O Amb27841285 [0,0,1,0,0,0|0,0,2]=3 607 B8R0.4 OC\C=C\C=C\C=C\Cl Amb27878783 [0,0,1,0,0,0|1,0,1]=3 608 B8R0.11 CO\C(C=O)=C\C=C\[O-] Amb28131328 [0,0,1,0,0,0|1,0,2]=4 609 B10R2.7 C1=CC2=NC=CCC2=C1 Amb28123850 [0,0,0,1,0,0|2,0,1]=4 610 B10R2.7 C1=CC2C=CC=C2N=C1 Amb27862361 [0,0,0,1,0,0|2,0,1]=4 611 B10R2.7 C1=CNC2=CCSC2=C1 Amb28318140 [0,0,0,1,0,0|1,1,1]=4 612 B10R2.7 C1=Cc2ccccc2C1 Amb2383760 [0,0,0,1,0,0|2,0,0]=3 613 B10R2.7 C1=Cc2cccn2CS1 Amb27431938 [0,0,0,1,0,0|3,0,0]=4 614 B10R2.7 C1=Cc2cnccc2C1 Amb27945600 [0,0,0,1,0,0|3,0,0]=4 615 B10R2.7 C1=Cc2sccc2SC1 Amb27473293 [0,0,0,1,0,0|0,2,1]=4 616 B10R2.7 C1=NCC2=CC=NC2=C1 Amb28054865 [0,0,0,1,0,0|3,0,0]=4 617 B10R2.7 C1=NCc2cccnc21 Amb27250387 [0,0,0,1,0,0|3,0,0]=4 618 B10R2.7 C1=Nc2cccnc2C1 Amb24099986 [0,0,0,1,0,0|2,0,1]=4 619 B10R2.7 b1oc2ccccc2o1 Amb22731069 [0,0,0,1,0,0|3,0,0]=4 620 B10R2.7 b1oc2cccnc2o1 Amb27848527 [0,0,0,1,0,0|3,0,0]=4 621 B10R2.7 c1c[siH]c2ncsc2c1 Amb25917418 [0,0,0,1,0,0|2,1,0]=4 622 B10R2.7 c1cc2ccoc2cn1 Amb10067356 [0,0,0,1,0,0|2,0,0]=3 623 B10R2.7 c1cc2ccsc2cn1 Amb10067355 [0,0,0,1,0,0|2,1,0]=4 624 B10R2.7 c1cc2ccsc2cn1 Amb24066968 [0,0,0,1,0,0|2,1,0]=4 625 B10R2.7 c1cc2cnccn2c1 Amb8630012 [0,0,0,1,0,0|3,0,0]=4 626 B10R2.7 c1cc2cncnn2c1 Amb27158037 [0,0,0,1,0,0|3,0,0]=4 627 B10R2.7 c1cc2cnncc2o1 Amb23560299 [0,0,0,1,0,0|3,0,0]=4 628 B10R2.7 c1cc2occc2cn1 Amb19895064 [0,0,0,1,0,0|2,0,0]=3 629 B10R2.7 c1cc2ocnc2cn1 Amb24478645 [0,0,0,1,0,0|3,0,0]=4 630 B10R2.7 c1cc2oncc2cn1 Amb27764807 [0,0,0,1,0,0|3,0,0]=4 631 B10R2.7 c1cc2sccc2cn1 Amb32664779 [0,0,0,1,0,0|2,1,0]=4 632 B10R2.7 c1cc2sccc2cn1 Amb8383970 [0,0,0,1,0,0|2,1,0]=4 633 B10R2.7 c1cc2sccc2nn1 Amb25082561 [0,0,0,1,0,0|2,1,0]=4 634 B10R2.7 c1ccc2[se]ccc2c1 Amb8515166 [0,0,0,1,0,0|1,1,0]=3 635 B10R2.7 c1ccc2c(c1)CCO2 Amb2687295 [0,0,0,1,0,0|1,0,2]=4 636 B10R2.7 c1ccc2c(c1)NCO2 Amb28050014 [0,0,0,1,0,0|2,0,1]=4 637 B10R2.7 c1ccc2c(c1)OCO2 Amb2684576 [0,0,0,1,0,0|2,0,1]=4 638 B10R2.7 c1ccc2c(c1)OSO2 Amb28050023 [0,0,0,1,0,0|3,0,0]=4 639 B10R2.7 c1ccc2cscc2c1 Amb24066379 [0,0,0,1,0,0|3,0,0]=4 640 B10R2.7 c1ccc2nscc2c1 Amb25336989 [0,0,0,1,0,0|3,0,0]=4 641 B10R2.7 c1ccc2occc2c1 Amb2725466 [0,0,0,1,0,0|1,0,0]=2 642 B10R2.7 c1ccc2ocnc2c1 Amb6608831 [0,0,0,1,0,0|2,0,0]=3 643 B10R2.7 c1ccc2oncc2c1 Amb1233398 [0,0,0,1,0,0|2,0,0]=3 644 B10R2.7 c1ccc2sccc2c1 Amb2782006 [0,0,0,1,0,0|1,1,0]=3 645 B10R2.7 c1ccc2scnc2c1 Amb2609954 [0,0,0,1,0,0|2,1,0]=4 646 B10R2.7 c1ccn2cccc2c1 Amb10605601 [0,0,0,1,0,0|2,0,0]=3 647 B10R2.7 c1ccn2ccnc2c1 Amb2235938 [0,0,0,1,0,0|3,0,0]=4 648 B10R2.7 c1ccn2ccnc2c1 Amb8629968 [0,0,0,1,0,0|3,0,0]=4 649 B10R2.7 c1ccn2cncc2c1 Amb10070943 [0,0,0,1,0,0|3,0,0]=4 650 B10R2.7 c1ccn2nccc2c1 Amb10604230 [0,0,0,1,0,0|3,0,0]=4 651 B10R2.7 c1cnc2c(c1)OCC2 Amb23455396 [0,0,0,1,0,0|1,0,2]=4 652 B10R2.7 c1cnc2cc[se]c2c1 Amb2611539 [0,0,0,1,0,0|1,1,0]=3 653 B10R2.7 c1cnc2cccn2c1 Amb22490786 [0,0,0,1,0,0|3,0,0]=4 654 B10R2.7 c1cnc2ccnn2c1 Amb33544071 [0,0,0,1,0,0|3,0,0]=4 655 B10R2.7 c1cnc2ccoc2c1 Amb16185654 [0,0,0,1,0,0|1,0,0]=2 656 B10R2.7 c1cnc2ccoc2c1 Amb30585174 [0,0,0,1,0,0|1,0,0]=2 657 B10R2.7 c1cnc2ccsc2c1 Amb10070404 [0,0,0,1,0,0|1,1,0]=3 658 B10R2.7 c1cnc2cnsc2c1 Amb27185797 [0,0,0,1,0,0|2,1,0]=4 659 B10R2.7 c1cnc2conc2c1 Amb26001309 [0,0,0,1,0,0|3,0,0]=4 660 B10R2.7 c1cnc2cscc2c1 Amb27955126 [0,0,0,1,0,0|3,0,0]=4 661 B10R2.7 c1cnc2ncoc2c1 Amb17194206 [0,0,0,1,0,0|2,0,0]=3 662 B10R2.7 c1cnc2ncsc2c1 Amb22002122 [0,0,0,1,0,0|2,1,0]=4 663 B10R2.7 c1cnc2occc2c1 Amb21963452 [0,0,0,1,0,0|2,0,0]=3 664 B10R2.7 c1cnc2ocnc2c1 Amb18100438 [0,0,0,1,0,0|3,0,0]=4 665 B10R2.7 c1cnc2oncc2c1 Amb27954714 [0,0,0,1,0,0|3,0,0]=4 666 B10R2.7 c1cnc2sccc2c1 Amb10070403 [0,0,0,1,0,0|2,1,0]=4 667 B10R2.7 c1cnc2sccc2n1 Amb19957744 [0,0,0,1,0,0|2,1,0]=4 668 B10R2.7 c1cnc2scnc2c1 Amb16231378 [0,0,0,1,0,0|3,0,0]=4 669 B10R2.7 c1cnn2ccnc2c1 Amb19959698 [0,0,0,1,0,0|3,0,0]=4 670 B10R2.7 c1cnn2ccnc2c1 Amb8628746 [0,0,0,1,0,0|3,0,0]=4 671 B10R2.7 c1cnn2cncc2c1 Amb25921156 [0,0,0,1,0,0|3,0,0]=4 672 B10R2.7 c1cnn2nccc2c1 Amb26844243 [0,0,0,1,0,0|3,0,0]=4 673 B10R2.7 c1ncc2sccc2n1 Amb22234765 [0,0,0,1,0,0|2,1,0]=4 674 B10R2.32 Nc1csc2sccc12 Amb18830849 [0,0,0,1,0,0|2,1,0]=4 675 B10R2.32 Nc1snc2occc12 Amb18202873 [0,0,0,1,0,0|3,0,0]=4 676 B10R2.32 O=C1C=CC2C=CCC12 Amb27861344 [0,0,0,1,0,0|1,0,2]=4 677 B10R2.32 O=C1C=C[C@@H]2CC=C[C@H]12 Amb28198613 [0,0,0,1,0,0|1,0,2]=4 678 B10R2.32 O=C1C=Cc2cccn21 Amb27409386 [0,0,0,1,0,0|1,0,0]=2 679 B10R2.32 O=C1CCc2occc21 Amb6740010 [0,0,0,1,0,0|0,0,2]=3 680 B10R2.32 O=C1CCc2oncc21 Amb27966150 [0,0,0,1,0,0|1,0,2]=4 681 B10R2.32 O=C1CCc2sccc21 Amb2232897 [0,0,0,1,0,0|0,1,2]=4 682 B10R2.32 O=C1CNc2occc21 Amb18832976 [0,0,0,1,0,0|1,0,1]=3 683 B10R2.32 O=C1CNc2sccc21 Amb18202969 [0,0,0,1,0,0|1,1,1]=4 684 B10R2.32 O=C1NCc2occc21 Amb28367896 [0,0,0,1,0,0|1,0,1]=3 685 B10R2.32 O=C1NCc2oncc21 Amb18203329 [0,0,0,1,0,0|2,0,1]=4 686 B10R2.32 O=C1NNc2sccc21 Amb28061946 [0,0,0,1,0,0|2,1,0]=4 687 B10R2.178 O=C1C=CC2C=CC1C2 Amb24370110 [0,0,0,1,0,0|1,0,2]=4 688 B10R2.178 O=C1C=C[C@H]2C=C[C@@H]1C2 Amb27195873 [0,0,0,1,0,0|1,0,2]=4 689 B10R1.17 BrC\C=C\c1ccccc1 Amb8513086 [0,0,0,0,0,1|2,0,1]=4 690 B10R1.17 BrC\C=C\c1ccccn1 Amb28365946 [0,0,0,0,0,1|2,0,1]=4 691 B10R1.17 BrC\C=C\c1ccncn1 Amb27246121 [0,0,0,0,0,1|2,0,1]=4 692 B10R1.17 BrC\C=C\c1cnccn1 Amb35600898 [0,0,0,0,0,1|2,0,1]=4 693 B10R1.17 Br\C=C\Cc1ccccc1 Amb33134791 [0,0,0,0,0,1|2,0,1]=4 694 B10R1.17 Br\C=C\Oc1ccccc1 Amb28145099 [0,0,0,0,0,1|3,0,0]=4 695 B10R1.17 Br\C=C\Sc1ccccc1 Amb26993510 [0,0,0,0,0,1|3,0,0]=4 696 B10R1.17 C#C\C=C/c1cccnc1 Amb24085625 [0,0,0,0,0,1|2,0,1]=4 697 B10R1.17 C#C\C=C\c1ccccc1 Amb33082101 [0,0,0,0,0,1|2,0,1]=4 698 B10R1.17 C=C\C=C\c1ccccc1 Amb17938988 [0,0,0,0,0,1|2,0,0]=3 699 B10R1.17 C=C\C=C\c1cccnc1 Amb27976078 [0,0,0,0,0,1|2,0,0]=3 700 B10R1.17 CC=C=Cc1ccccc1 Amb27435633 [0,0,0,0,0,1|2,0,1]=4 701 B10R1.17 CC\C=C/c1cccnc1 Amb24602371 [0,0,0,0,0,1|2,0,1]=4 702 B10R1.17 CC\C=C\c1ccccc1 Amb17673826 [0,0,0,0,0,1|2,0,1]=4 703 B10R1.17 CC\C=C\c1cccnc1 Amb28076152 [0,0,0,0,0,1|2,0,1]=4 704 B10R1.17 CO\C=C/c1ccncc1 Amb24103279 [0,0,0,0,0,1|3,0,0]=4 705 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [0,0,0,0,0,1|3,0,0]=4 706 B10R1.17 CS\C=C\c1ccccc1 Amb27654244 [0,0,0,0,0,1|3,0,0]=4 707 B10R1.17 C\C=C/Cc1cccnc1 Amb27470932 [0,0,0,0,0,1|2,0,1]=4 708 B10R1.17 C\C=C\Cc1ccccc1 Amb4035140 [0,0,0,0,0,1|2,0,1]=4 709 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [0,0,0,0,0,1|3,0,0]=4 710 B10R1.17 ClC\C=C\c1ccccc1 Amb6608898 [0,0,0,0,0,1|2,0,1]=4 711 B10R1.17 ClC\C=C\c1cccnc1 Amb26369517 [0,0,0,0,0,1|2,0,1]=4 712 B10R1.17 ClC\C=C\c1ccncc1 Amb27392424 [0,0,0,0,0,1|2,0,1]=4 713 B10R1.17 ClC\C=C\c1cnccn1 Amb35600897 [0,0,0,0,0,1|2,0,1]=4 714 B10R1.17 Cl\C=C/Oc1ccccc1 Amb27865618 [0,0,0,0,0,1|3,0,0]=4 715 B10R1.17 FC\C=C\c1ccccc1 Amb27449580 [0,0,0,0,0,1|2,0,1]=4 716 B10R1.17 N#C\C=C/c1cccnc1 Amb27453523 [0,0,0,0,0,1|2,0,1]=4 717 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [0,0,0,0,0,1|2,0,1]=4 718 B10R1.17 N#C\C=C\c1ccccn1 Amb32658017 [0,0,0,0,0,1|2,0,1]=4 719 B10R1.17 N#C\C=C\c1cccnc1 Amb17477822 [0,0,0,0,0,1|2,0,1]=4 720 B10R1.17 N#C\C=C\c1ccncc1 Amb17477821 [0,0,0,0,0,1|2,0,1]=4 721 B10R1.17 N#C\C=C\c1cnccn1 Amb35602892 [0,0,0,0,0,1|2,0,1]=4 722 B10R1.17 N#C\C=C\c1ncccn1 Amb27230880 [0,0,0,0,0,1|2,0,1]=4 723 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [0,0,0,0,0,1|2,0,1]=4 724 B10R1.17 NC\C=C/c1ccccc1 Amb6383106 [0,0,0,0,0,1|2,0,1]=4 725 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [0,0,0,0,0,1|2,0,1]=4 726 B10R1.17 NC\C=C\c1ccccc1 Amb4019220 [0,0,0,0,0,1|2,0,1]=4 727 B10R1.17 NC\C=C\c1ccccn1 Amb18063261 [0,0,0,0,0,1|2,0,1]=4 728 B10R1.17 NC\C=C\c1cccnc1 Amb18063302 [0,0,0,0,0,1|2,0,1]=4 729 B10R1.17 NC\C=C\c1cccnc1 Amb31148908 [0,0,0,0,0,1|2,0,1]=4 730 B10R1.17 NC\C=C\c1ccncc1 Amb18062333 [0,0,0,0,0,1|2,0,1]=4 731 B10R1.17 NC\C=C\c1ccncn1 Amb27617981 [0,0,0,0,0,1|2,0,1]=4 732 B10R1.17 NC\C=C\c1cnccn1 Amb35602895 [0,0,0,0,0,1|2,0,1]=4 733 B10R1.17 NC\C=C\c1ncccn1 Amb33270034 [0,0,0,0,0,1|2,0,1]=4 734 B10R1.17 O=C=C\C=C1/C=CC=CN1 Amb27779702 [0,0,0,0,0,1|1,0,1]=3 735 B10R1.17 O=CC#Cc1ccccc1 Amb3778943 [0,0,0,0,0,1|1,0,2]=4 736 B10R1.17 O=CC#Cc1cccnc1 Amb25950612 [0,0,0,0,0,1|1,0,2]=4 737 B10R1.17 O=CCCc1ccccc1 Amb2720576 [0,0,0,0,0,1|1,0,2]=4 738 B10R1.17 O=CCCc1ccccn1 Amb17081674 [0,0,0,0,0,1|1,0,2]=4 739 B10R1.17 O=CCCc1cccnc1 Amb17081675 [0,0,0,0,0,1|1,0,2]=4 740 B10R1.17 O=CCCc1ccncc1 Amb8388451 [0,0,0,0,0,1|1,0,2]=4 741 B10R1.17 O=CCCc1ccncn1 Amb26958514 [0,0,0,0,0,1|1,0,2]=4 742 B10R1.17 O=CCCc1cnccn1 Amb25876683 [0,0,0,0,0,1|1,0,2]=4 743 B10R1.17 O=CCCc1ncccn1 Amb24056162 [0,0,0,0,0,1|1,0,2]=4 744 B10R1.17 O=CCOc1ccccc1 Amb3465095 [0,0,0,0,0,1|2,0,1]=4 745 B10R1.17 O=CCOc1ccccn1 Amb27823582 [0,0,0,0,0,1|2,0,1]=4 746 B10R1.17 O=CCSc1ccccc1 Amb17082903 [0,0,0,0,0,1|2,0,1]=4 747 B10R1.17 O=CNCc1ccccc1 Amb1916036 [0,0,0,0,0,1|2,0,1]=4 748 B10R1.17 O=CNCc1ccccn1 Amb22370826 [0,0,0,0,0,1|2,0,1]=4 749 B10R1.17 O=CNCc1cccnc1 Amb2694543 [0,0,0,0,0,1|2,0,1]=4 750 B10R1.17 O=CNCc1ncccn1 Amb27638889 [0,0,0,0,0,1|2,0,1]=4 751 B10R1.17 O=CNNc1ccccc1 Amb2721099 [0,0,0,0,0,1|3,0,0]=4 752 B10R1.17 O=CNNc1ccncc1 Amb26560692 [0,0,0,0,0,1|3,0,0]=4 753 B10R1.17 O=COCc1ccccc1 Amb4605893 [0,0,0,0,0,1|2,0,1]=4 754 B10R1.17 O=C[CH]Cc1ccccc1 Amb34916523 [0,0,0,0,0,1|1,0,2]=4 755 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [0,0,0,0,0,1|1,0,0]=2 756 B10R1.17 O=C\C=C\C1=CCCCC1 Amb18643092 [0,0,0,0,0,1|1,0,2]=4 757 B10R1.17 O=C\C=C\C1=COCCC1 Amb33414875 [0,0,0,0,0,1|0,0,3]=4 758 B10R1.17 O=C\C=C\C1CC=CCC1 Amb25691324 [0,0,0,0,0,1|1,0,2]=4 759 B10R1.17 O=C\C=C\c1ccccc1 Amb2792758 [0,0,0,0,0,1|1,0,0]=2 760 B10R1.17 O=C\C=C\c1ccccn1 Amb17334135 [0,0,0,0,0,1|1,0,0]=2 761 B10R1.17 O=C\C=C\c1cccnc1 Amb17334136 [0,0,0,0,0,1|1,0,0]=2 762 B10R1.17 O=C\C=C\c1cccnn1 Amb18642956 [0,0,0,0,0,1|1,0,0]=2 763 B10R1.17 O=C\C=C\c1ccncc1 Amb33249631 [0,0,0,0,0,1|1,0,0]=2 764 B10R1.17 O=C\C=C\c1ccncn1 Amb18642951 [0,0,0,0,0,1|1,0,0]=2 765 B10R1.17 O=C\C=C\c1cnccn1 Amb35600870 [0,0,0,0,0,1|1,0,0]=2 766 B10R1.17 O=C\C=C\c1cncnc1 Amb25130263 [0,0,0,0,0,1|2,0,0]=3 767 B10R1.17 O=C\C=C\c1ncccn1 Amb33270347 [0,0,0,0,0,1|1,0,0]=2 768 B10R1.17 OC\C=C/c1ccccn1 Amb26391968 [0,0,0,0,0,1|1,0,2]=4 769 B10R1.17 OC\C=C/c1ccncc1 Amb27617653 [0,0,0,0,0,1|1,0,2]=4 770 B10R1.17 OC\C=C\c1ccccc1 Amb7809230 [0,0,0,0,0,1|1,0,2]=4 771 B10R1.17 OC\C=C\c1ccccn1 Amb22749315 [0,0,0,0,0,1|1,0,2]=4 772 B10R1.17 OC\C=C\c1cccnc1 Amb17619713 [0,0,0,0,0,1|1,0,2]=4 773 B10R1.17 OC\C=C\c1ccncc1 Amb22749186 [0,0,0,0,0,1|1,0,2]=4 774 B10R1.17 OC\C=C\c1ccncn1 Amb27775610 [0,0,0,0,0,1|1,0,2]=4 775 B10R1.17 OC\C=C\c1cnccn1 Amb33429679 [0,0,0,0,0,1|1,0,2]=4 776 B10R1.17 OC\C=C\c1ncccn1 Amb33270341 [0,0,0,0,0,1|1,0,2]=4 777 B10R1.17 SC\C=C\c1ccccc1 Amb6255720 [0,0,0,0,0,1|1,1,1]=4 778 B7R0.1 B\C=C\C=C\C=C\N Amb28068718 [1,0,1,0,0,0|2,0,0]=4 779 B7R0.1 C#C\C=C\C=C\C=O Amb27968252 [1,0,1,0,0,0|0,0,2]=4 780 B7R0.1 C=C\C=C/C=C/C=O Amb27166172 [1,0,1,0,0,0|0,0,0]=2 781 B7R0.1 C=C\C=C\C=C\CBr Amb27659022 [1,0,1,0,0,0|1,0,1]=4 782 B7R0.1 C=C\C=C\CCC=C Amb26026784 [1,0,1,0,0,0|1,0,1]=4 783 B7R0.1 CC\C=C\C=C\C=O Amb8392847 [1,0,1,0,0,0|0,0,2]=4 784 B7R0.1 C\C=C\C\C=C\C=O Amb27202097 [1,0,1,0,0,0|0,0,2]=4 785 B7R0.1 Cl\C=C/C=C/C=C/Br Amb28325602 [1,0,1,0,0,0|2,0,0]=4 786 B7R0.1 Cl\C=C\C=C\C=C\Br Amb27192169 [1,0,1,0,0,0|2,0,0]=4 787 B7R0.1 O=CC\C=C\C=C\Br Amb27222551 [1,0,1,0,0,0|1,0,1]=4 788 B7R0.1 O=C\C=C/C=C/C=O Amb17593128 [1,0,1,0,0,0|0,0,1]=3 789 B7R0.1 O=C\C=C\C=C\C=O Amb25209344 [1,0,1,0,0,0|0,0,1]=3 790 B7R0.1 O=C\C=C\C=C\CCl Amb28292786 [1,0,1,0,0,0|1,0,1]=4 791 B7R0.1 O=C\C=C\C=C\CO Amb27424442 [1,0,1,0,0,0|0,0,1]=3 792 B7R0.3 C=C\C=C\C(=O)C=C Amb27210567 [1,0,1,0,0,0|1,0,1]=4 793 B7R0.3 COC(=O)\C=C\C=O Amb18641759 [1,0,1,0,0,0|1,0,1]=4 794 B7R0.3 O=C\C=C\C(=O)C=O Amb27440015 [1,0,1,0,0,0|1,0,1]=4 795 B7R0.7 C=CCC(=O)OC=C Amb27242220 [1,0,1,0,0,0|1,0,1]=4 796 B7R0.7 C=COC(=O)OC=C Amb27491742 [1,0,1,0,0,0|2,0,0]=4 797 B7R0.7 C=COC(=O)\C=C\C Amb8514531 [1,0,1,0,0,0|1,0,1]=4 798 B7R1.1 BrC=C1C=CC=C1 Amb28118986 [2,0,0,0,0,0|2,0,0]=4 799 B7R1.1 C#Cc1ccco1 Amb24178904 [2,0,0,0,0,0|0,0,2]=4 800 B7R1.1 C=C[c-]1cccc1 Amb34916052 [2,0,0,0,0,0|1,0,1]=4 801 B7R1.1 C=Cc1ccco1 Amb22295842 [2,0,0,0,0,0|0,0,0]=2 802 B7R1.1 C=Cc1cccs1 Amb33542804 [2,0,0,0,0,0|0,1,0]=3 803 B7R1.1 C=Cc1ccns1 Amb26936370 [2,0,0,0,0,0|1,1,0]=4 804 B7R1.1 C=Cc1ccoc1 Amb24056798 [2,0,0,0,0,0|2,0,0]=4 805 B7R1.1 C=Cc1ccon1 Amb33197567 [2,0,0,0,0,0|2,0,0]=4 806 B7R1.1 C=Cc1ccsc1 Amb22263008 [2,0,0,0,0,0|2,0,0]=4 807 B7R1.1 C=Cc1cnco1 Amb26628199 [2,0,0,0,0,0|1,0,0]=3 808 B7R1.1 C=Cc1cncs1 Amb24395972 [2,0,0,0,0,0|1,1,0]=4 809 B7R1.1 C=Cc1nccs1 Amb24056329 [2,0,0,0,0,0|1,1,0]=4 810 B7R1.1 C=Cn1cccc1 Amb25810319 [2,0,0,0,0,0|2,0,0]=4 811 B7R1.1 C=Cn1cccn1 Amb24583489 [2,0,0,0,0,0|2,0,0]=4 812 B7R1.1 CCc1ccco1 Amb8393153 [2,0,0,0,0,0|0,0,2]=4 813 B7R1.1 COc1ccco1 Amb8513561 [2,0,0,0,0,0|1,0,1]=4 814 B7R1.1 CSc1ccco1 Amb21961438 [2,0,0,0,0,0|1,0,1]=4 815 B7R1.1 C[SiH2]c1ccco1 Amb28368539 [2,0,0,0,0,0|0,1,1]=4 816 B7R1.1 N#Cc1ccco1 Amb1694826 [2,0,0,0,0,0|1,0,1]=4 817 B7R1.1 NCc1ccco1 Amb2720356 [2,0,0,0,0,0|1,0,1]=4 818 B7R1.1 NCc1ccco1 Amb29847168 [2,0,0,0,0,0|1,0,1]=4 819 B7R1.1 NNc1ccco1 Amb18203069 [2,0,0,0,0,0|2,0,0]=4 820 B7R1.1 N\C=C1\C=CC=N1 Amb27623643 [2,0,0,0,0,0|2,0,0]=4 821 B7R1.1 O=CC1=CC=CC1 Amb25799627 [2,0,0,0,0,0|1,0,0]=3 822 B7R1.1 O=CC1=CCCO1 Amb18120782 [2,0,0,0,0,0|0,0,2]=4 823 B7R1.1 O=CC1C=CC=C1 Amb27408563 [2,0,0,0,0,0|1,0,1]=4 824 B7R1.1 O=C[c-]1cccc1 Amb22168256 [2,0,0,0,0,0|1,0,1]=4 825 B7R1.1 O=C[c-]1cccc1 Amb33801815 [2,0,0,0,0,0|1,0,1]=4 826 B7R1.1 O=Cc1ccco1 Amb2720358 [2,0,0,0,0,0|0,0,0]=2 827 B7R1.1 O=Cc1cccs1 Amb2690601 [2,0,0,0,0,0|0,1,0]=3 828 B7R1.1 O=Cc1ccno1 Amb33546951 [2,0,0,0,0,0|1,0,0]=3 829 B7R1.1 O=Cc1ccns1 Amb8010934 [2,0,0,0,0,0|1,1,0]=4 830 B7R1.1 O=Cc1ccoc1 Amb2720357 [2,0,0,0,0,0|2,0,0]=4 831 B7R1.1 O=Cc1ccon1 Amb8009575 [2,0,0,0,0,0|2,0,0]=4 832 B7R1.1 O=Cc1ccsc1 Amb2720343 [2,0,0,0,0,0|2,0,0]=4 833 B7R1.1 O=Cc1ccsn1 Amb8010932 [2,0,0,0,0,0|2,0,0]=4 834 B7R1.1 O=Cc1cnco1 Amb8010823 [2,0,0,0,0,0|1,0,0]=3 835 B7R1.1 O=Cc1cncs1 Amb2455730 [2,0,0,0,0,0|1,1,0]=4 836 B7R1.1 O=Cc1cnno1 Amb8010941 [2,0,0,0,0,0|2,0,0]=4 837 B7R1.1 O=Cc1cocn1 Amb8010935 [2,0,0,0,0,0|2,0,0]=4 838 B7R1.1 O=Cc1cscn1 Amb2455729 [2,0,0,0,0,0|2,0,0]=4 839 B7R1.1 O=Cc1ncco1 Amb33544448 [2,0,0,0,0,0|1,0,0]=3 840 B7R1.1 O=Cc1nccs1 Amb2723140 [2,0,0,0,0,0|1,1,0]=4 841 B7R1.1 O=Cc1nnco1 Amb21856468 [2,0,0,0,0,0|2,0,0]=4 842 B7R1.1 OCc1ccco1 Amb837335 [2,0,0,0,0,0|0,0,2]=4 843 B7R1.1 ONc1ccco1 Amb27209570 [2,0,0,0,0,0|1,0,1]=4 844 B7R1.1 S=Cc1ccco1 Amb28368735 [2,0,0,0,0,0|0,1,0]=3 845 B7R1.1 SCc1ccco1 Amb2688612 [2,0,0,0,0,0|0,1,1]=4 846 B7R1.1 [C-]#[N+]c1ccco1 Amb27962733 [2,0,0,0,0,0|1,0,1]=4 847 B9R0.4 CC(=O)OC(=O)\C=C/C=O Amb28049872 [0,1,1,0,0,0|1,0,1]=4 848 B9R0.4 CC(=O)OC(=O)\C=C\C=O Amb27881869 [0,1,1,0,0,0|1,0,1]=4 849 B9R0.4 CC(=O)\C=C(C)/C=C/C=O Amb27471937 [0,1,1,0,0,0|1,0,1]=4 850 B9R0.4 CC(\C=C\C=O)=C/C(=O)O Amb27663875 [0,1,1,0,0,0|2,0,0]=4 851 B9R0.5 C=COC(=O)\C=C\C=C\C Amb17689054 [0,1,1,0,0,0|2,0,0]=4 852 B9R0.18 C\C=C\C=C(C)\C=C\C=O Amb27881777 [0,1,1,0,0,0|1,0,0]=3 853 B9R0.34 C=CC[C@@H](O)\C=C(/C)C=O Amb27257809 [0,1,1,0,0,0|0,0,2]=4 854 B9R0.40 C=C\C=C(C#N)\C=C\C=O Amb27164073 [0,1,1,0,0,0|1,0,0]=3 855 B9R0.40 C=C\C=C(C=O)\C=C\C=O Amb28199113 [0,1,1,0,0,0|0,0,1]=3 856 B9R0.48 C=CCC(O)\C=C\C(=O)O Amb27620632 [0,1,1,0,0,0|0,0,2]=4 857 B9R0.48 C=COC(=O)\C=C/C(=O)O Amb28341819 [0,1,1,0,0,0|1,0,0]=3 858 B9R0.48 C=COC(=O)\C=C/C(N)=O Amb27164316 [0,1,1,0,0,0|1,0,0]=3 859 B9R0.48 CC(=C\C=O)\C=C\C(=O)O Amb27210491 [0,1,1,0,0,0|2,0,0]=4 860 B9R0.48 CC(=O)\C=C\C(C)=C\C=O Amb27445134 [0,1,1,0,0,0|2,0,0]=4 861 B9R0.48 CC(\C=C\C(=O)O)=C/C=O Amb27215348 [0,1,1,0,0,0|2,0,0]=4 862 B9R0.48 NC(\C=C/C(=O)O)=C\C=O Amb27450259 [0,1,1,0,0,0|2,0,0]=4 863 B9R0.2 C=C\C=C\C=C\CC(C)=O Amb27823042 [0,1,1,0,0,0|1,0,1]=4 864 B9R0.2 CC(=O)N\C=C\C=C\C=O Amb27881539 [0,1,1,0,0,0|1,0,1]=4 865 B9R0.2 CC(=O)O\C=C\C=C\CO Amb28453851 [0,1,1,0,0,0|1,0,1]=4 866 B9R0.2 CC(=O)\C=C\C=C/C=C=O Amb27839053 [0,1,1,0,0,0|0,0,2]=4 867 B9R0.2 CC(=O)\C=C\C=C\C=C=O Amb27878921 [0,1,1,0,0,0|0,0,2]=4 868 B9R0.2 CC(=O)\C=C\C=C\C=C\Cl Amb28125315 [0,1,1,0,0,0|1,0,0]=3 869 B9R0.2 CC(C)=C\C=C\C=C\C=O Amb28287071 [0,1,1,0,0,0|1,0,0]=3 870 B9R0.2 CC(O)\C=C\C=C\C=C/Cl Amb27831389 [0,1,1,0,0,0|1,0,1]=4 871 B9R0.2 C\C=C\C=C\C=C\C(=O)O Amb3987814 [0,1,1,0,0,0|1,0,0]=3 872 B9R0.2 C\C=C\C=C\C=C\C(N)=O Amb27202742 [0,1,1,0,0,0|1,0,0]=3 873 B9R0.45 C=C\C=C\C=C\C=C\C=O Amb27841284 [0,1,1,0,0,0|1,0,0]=3 874 B9R0.45 CC\C=C/C=C\C=C\C=O Amb27223181 [0,1,1,0,0,0|1,0,0]=3 875 B9R0.45 CC\C=C\C=C/C=C/C=O Amb27244697 [0,1,1,0,0,0|1,0,0]=3 876 B9R0.45 CC\C=C\C=C\C=C\C=O Amb28458226 [0,1,1,0,0,0|1,0,0]=3 877 B9R0.45 CC\C=C\C=C\C=C\CO Amb28050682 [0,1,1,0,0,0|1,0,1]=4 878 B9R0.45 CO\C=C\C=C\C=C\C=O Amb27169346 [0,1,1,0,0,0|0,0,0]=2 879 B9R0.45 C\C=C\C=C\C=C\C=C\Br Amb27451756 [0,1,1,0,0,0|2,0,0]=4 880 B9R0.45 O=C\C=C\C=C\C=C\C=O Amb18643061 [0,1,1,0,0,0|0,0,1]=3 881 B9R0.45 O=C\C=C\CC\C=C\C=O Amb27837987 [0,1,1,0,0,0|0,0,2]=4 882 B9R0.45 OC\C=C\C=C\C=C\CO Amb27630063 [0,1,1,0,0,0|0,0,2]=4 883 B9R0.46 COC(=O)\C=C\C=C\C=O Amb18643494 [0,1,1,0,0,0|2,0,0]=4 884 B9R0.46 C\C(=C/C=C/C=C/Cl)CO Amb27432930 [0,1,1,0,0,0|1,0,1]=4 885 B9R0.46 C\C=C\C=C\C=C(/C)CO Amb27452066 [0,1,1,0,0,0|1,0,1]=4 886 B9R0.43 C=CC(C=C)=CCC(=O)O Amb28050147 [0,1,1,0,0,0|1,0,1]=4 887 B9R1.7 Br\C=C\c1ccc(Br)o1 Amb27642770 [1,1,0,0,0,0|1,0,0]=3 888 B9R1.7 C=C=Cc1ccc(C)s1 Amb27971127 [1,1,0,0,0,0|0,1,1]=4 889 B9R1.7 C=CCC1C=CC(=O)O1 Amb27453658 [1,1,0,0,0,0|0,0,2]=4 890 B9R1.7 C=CCc1cc(C)co1 Amb27634170 [1,1,0,0,0,0|0,0,1]=3 891 B9R1.7 C=CCc1ccc(C)s1 Amb27461401 [1,1,0,0,0,0|0,1,1]=4 892 B9R1.7 C=C\C=C1\CCC(=O)O1 Amb27488468 [1,1,0,0,0,0|0,0,2]=4 893 B9R1.7 CC1=C\C(=C\C=O)CC1 Amb27792975 [1,1,0,0,0,0|1,0,1]=4 894 B9R1.7 CC\C=C1/C=CC(=O)O1 Amb27185841 [1,1,0,0,0,0|0,0,2]=4 895 B9R1.7 C\C=C\C1=CCC(=O)O1 Amb26429675 [1,1,0,0,0,0|0,0,2]=4 896 B9R1.7 C\C=C\C1C=CC(=O)O1 Amb25238033 [1,1,0,0,0,0|0,0,2]=4 897 B9R1.7 C\C=C\c1cc(C)co1 Amb27209260 [1,1,0,0,0,0|0,0,1]=3 898 B9R1.7 C\C=C\c1ccc(C)o1 Amb27482400 [1,1,0,0,0,0|0,0,1]=3 899 B9R1.7 C\C=C\c1ccc(Cl)s1 Amb27184514 [1,1,0,0,0,0|0,1,1]=4 900 B9R1.7 C\N=C/c1ccc(C)o1 Amb27965230 [1,1,0,0,0,0|1,0,1]=4 901 B9R1.7 C\N=C\c1ccc(C)o1 Amb28140651 [1,1,0,0,0,0|1,0,1]=4 902 B9R1.7 Cc1cc(CC=O)on1 Amb33326733 [1,1,0,0,0,0|1,0,1]=4 903 B9R1.7 Cc1cc(\C=C\Br)on1 Amb33135276 [1,1,0,0,0,0|2,0,0]=4 904 B9R1.7 Cc1ccc(CC=O)o1 Amb26584704 [1,1,0,0,0,0|0,0,1]=3 905 B9R1.7 Cc1ccc(CC=O)s1 Amb24679545 [1,1,0,0,0,0|0,1,1]=4 906 B9R1.7 Cc1ccc(N=C=O)o1 Amb6744837 [1,1,0,0,0,0|1,0,1]=4 907 B9R1.7 Cc1ccc(\C=C\Br)o1 Amb33134842 [1,1,0,0,0,0|1,0,0]=3 908 B9R1.7 Cc1ccc(\C=C\Br)s1 Amb33134881 [1,1,0,0,0,0|1,1,0]=4 909 B9R1.7 Cc1ccc(\C=N/O)o1 Amb25147225 [1,1,0,0,0,0|1,0,1]=4 910 B9R1.7 Cc1ccc(\C=N\O)o1 Amb6384039 [1,1,0,0,0,0|1,0,1]=4 911 B9R1.7 Cc1cnc(\C=C\Br)o1 Amb33135317 [1,1,0,0,0,0|2,0,0]=4 912 B9R1.7 Cc1coc(\C=C\Br)c1 Amb33135438 [1,1,0,0,0,0|1,0,0]=3 913 B9R1.7 Cc1coc(\C=N\O)c1 Amb27945602 [1,1,0,0,0,0|1,0,1]=4 914 B9R1.7 Cc1csc(CC=O)c1 Amb33427149 [1,1,0,0,0,0|0,1,1]=4 915 B9R1.7 Cl\C=C/c1ccc(Cl)s1 Amb27983624 [1,1,0,0,0,0|1,1,0]=4 916 B9R1.7 F\C=C\c1ccc(Br)s1 Amb27438579 [1,1,0,0,0,0|1,1,0]=4 917 B9R1.7 N\C=C\c1cc(Cl)no1 Amb24562459 [1,1,0,0,0,0|2,0,0]=4 918 B9R1.7 O=C1C=C\C(=C/C=S)C1 Amb24577808 [1,1,0,0,0,0|1,1,0]=4 919 B9R1.7 O=C1C=C\C(=C\C=S)C1 Amb27838717 [1,1,0,0,0,0|1,1,0]=4 920 B9R1.7 O=C=Nc1ccc(Br)o1 Amb33532709 [1,1,0,0,0,0|1,0,1]=4 921 B9R1.7 O=CCc1cc(Br)co1 Amb25249614 [1,1,0,0,0,0|0,0,1]=3 922 B9R1.7 O=CCc1cc(Br)cs1 Amb26495921 [1,1,0,0,0,0|0,1,1]=4 923 B9R1.7 O=CCc1cc(Cl)cs1 Amb26982645 [1,1,0,0,0,0|0,1,1]=4 924 B9R1.7 O=CCc1ccc(Br)o1 Amb27870879 [1,1,0,0,0,0|0,0,1]=3 925 B9R1.7 O=CCc1ccc(Br)s1 Amb24433759 [1,1,0,0,0,0|0,1,1]=4 926 B9R1.7 O=CCc1ccc(Cl)o1 Amb25174639 [1,1,0,0,0,0|0,0,1]=3 927 B9R1.7 O=CCc1ccc(Cl)s1 Amb27765092 [1,1,0,0,0,0|0,1,1]=4 928 B9R1.7 O=C\C=C1/C=CC(=O)O1 Amb24334582 [1,1,0,0,0,0|0,0,0]=2 929 B9R1.7 O\N=C\c1ccc(Br)o1 Amb2387512 [1,1,0,0,0,0|1,0,1]=4 930 B9R1.7 O\N=C\c1ccc(Cl)o1 Amb8357988 [1,1,0,0,0,0|1,0,1]=4 931 B9R1.7 O\N=C\c1ccc(I)o1 Amb16239327 [1,1,0,0,0,0|1,0,1]=4 932 B9R1.11 C#CC(=O)c1ccco1 Amb27465291 [1,1,0,0,0,0|0,0,2]=4 933 B9R1.11 C=C(CBr)c1ccco1 Amb33451440 [1,1,0,0,0,0|1,0,1]=4 934 B9R1.11 C=C(CC)c1ccco1 Amb28119044 [1,1,0,0,0,0|0,0,2]=4 935 B9R1.11 C=C(CCl)c1ccco1 Amb28249972 [1,1,0,0,0,0|1,0,1]=4 936 B9R1.11 C=C(CN)c1ccco1 Amb26971270 [1,1,0,0,0,0|1,0,1]=4 937 B9R1.11 C=CC(=O)c1ccco1 Amb16232452 [1,1,0,0,0,0|0,0,0]=2 938 B9R1.11 C=CC(=O)c1cccs1 Amb18562033 [1,1,0,0,0,0|0,1,0]=3 939 B9R1.11 C=CC(=O)c1ccns1 Amb27449528 [1,1,0,0,0,0|1,1,0]=4 940 B9R1.11 C=CC(=O)c1ccoc1 Amb27227609 [1,1,0,0,0,0|2,0,0]=4 941 B9R1.11 C=CC(=O)c1ccon1 Amb26516072 [1,1,0,0,0,0|2,0,0]=4 942 B9R1.11 C=CC(=O)c1ccsc1 Amb24478667 [1,1,0,0,0,0|2,0,0]=4 943 B9R1.11 C=CC(=O)c1cnco1 Amb33415607 [1,1,0,0,0,0|1,0,0]=3 944 B9R1.11 C=CC(=O)c1cncs1 Amb26641774 [1,1,0,0,0,0|1,1,0]=4 945 B9R1.11 C=CC(=O)c1cscn1 Amb25888952 [1,1,0,0,0,0|2,0,0]=4 946 B9R1.11 C=CC(=O)c1nccs1 Amb33313059 [1,1,0,0,0,0|1,1,0]=4 947 B9R1.11 C=CC(=O)n1cccc1 Amb28122830 [1,1,0,0,0,0|2,0,0]=4 948 B9R1.11 C=CC(N)c1ccco1 Amb28073876 [1,1,0,0,0,0|0,0,1]=3 949 B9R1.11 C=CC(N)c1cccs1 Amb28364292 [1,1,0,0,0,0|0,1,1]=4 950 B9R1.11 C=CC(O)c1ccco1 Amb24332569 [1,1,0,0,0,0|0,0,1]=3 951 B9R1.11 C=CC(O)c1cccs1 Amb25123773 [1,1,0,0,0,0|0,1,1]=4 952 B9R1.11 C=CC(O)c1cnco1 Amb26905803 [1,1,0,0,0,0|1,0,1]=4 953 B9R1.11 C=C[C@@H](N)c1ccco1 Amb27221032 [1,1,0,0,0,0|0,0,1]=3 954 B9R1.11 CC(=[N+]=[N-])c1ccco1 Amb28368730 [1,1,0,0,0,0|2,0,0]=4 955 B9R1.11 CC(C=O)c1ccco1 Amb18642174 [1,1,0,0,0,0|0,0,1]=3 956 B9R1.11 CC(C=O)c1cccs1 Amb17138391 [1,1,0,0,0,0|0,1,1]=4 957 B9R1.11 CC(C=O)c1cnco1 Amb33295068 [1,1,0,0,0,0|1,0,1]=4 958 B9R1.11 CCC(=O)c1ccco1 Amb844124 [1,1,0,0,0,0|0,0,2]=4 959 B9R1.11 CNC(=O)c1ccco1 Amb2612183 [1,1,0,0,0,0|1,0,1]=4 960 B9R1.11 COC(=O)c1ccco1 Amb4302709 [1,1,0,0,0,0|1,0,1]=4 961 B9R1.11 C\C(=N/O)c1ccco1 Amb6739803 [1,1,0,0,0,0|1,0,1]=4 962 B9R1.11 C\C(=N\O)c1ccco1 Amb4018078 [1,1,0,0,0,0|1,0,1]=4 963 B9R1.11 C\N=C(/Cl)c1ccco1 Amb30585147 [1,1,0,0,0,0|1,0,1]=4 964 B9R1.11 C\N=C(\Cl)c1ccco1 Amb2371268 [1,1,0,0,0,0|1,0,1]=4 965 B9R1.11 Cl\C=C(\Cl)c1cccs1 Amb27965884 [1,1,0,0,0,0|1,1,0]=4 966 B9R1.11 N#CC(=O)c1ccco1 Amb17231835 [1,1,0,0,0,0|1,0,1]=4 967 B9R1.11 NCC(=O)c1ccco1 Amb18642269 [1,1,0,0,0,0|1,0,1]=4 968 B9R1.11 NCC(=O)c1ccco1 Amb19373982 [1,1,0,0,0,0|1,0,1]=4 969 B9R1.11 NNC(=O)c1ccco1 Amb6364758 [1,1,0,0,0,0|2,0,0]=4 970 B9R1.11 N\C(=N/O)c1ccco1 Amb22587188 [1,1,0,0,0,0|1,0,1]=4 971 B9R1.11 N\C(=N/O)c1ccco1 Amb8831731 [1,1,0,0,0,0|1,0,1]=4 972 B9R1.11 N\C(=N\O)c1ccco1 Amb2696503 [1,1,0,0,0,0|1,0,1]=4 973 B9R1.11 O=C(CBr)c1ccco1 Amb2721798 [1,1,0,0,0,0|1,0,1]=4 974 B9R1.11 O=C(CCl)c1ccco1 Amb17138398 [1,1,0,0,0,0|1,0,1]=4 975 B9R1.11 O=C(CO)c1ccco1 Amb17689139 [1,1,0,0,0,0|0,0,2]=4 976 B9R1.11 O=C(NO)c1ccco1 Amb6270335 [1,1,0,0,0,0|1,0,1]=4 977 B9R1.11 O=CC(=O)c1ccco1 Amb17593264 [1,1,0,0,0,0|0,0,0]=2 978 B9R1.11 O=CC(=O)c1cccs1 Amb10067937 [1,1,0,0,0,0|0,1,0]=3 979 B9R1.11 O=CC(=O)c1cccs1 Amb10607111 [1,1,0,0,0,0|0,1,0]=3 980 B9R1.11 O=CC(Cl)c1cccs1 Amb27246769 [1,1,0,0,0,0|0,1,1]=4 981 B9R1.11 O\C=C(\Cl)c1ccco1 Amb27186090 [1,1,0,0,0,0|0,0,1]=3 982 B9R1.13 BrC(Br)=Cc1ccco1 Amb22228062 [1,1,0,0,0,0|1,0,0]=3 983 B9R1.13 BrC(Br)=Cc1cccs1 Amb26079369 [1,1,0,0,0,0|1,1,0]=4 984 B9R1.13 C=C(Br)Cc1ccco1 Amb24411253 [1,1,0,0,0,0|0,0,1]=3 985 B9R1.13 C=C(Br)Cc1cccs1 Amb25185096 [1,1,0,0,0,0|0,1,1]=4 986 B9R1.13 C=C(C)Cc1ccco1 Amb24673621 [1,1,0,0,0,0|0,0,1]=3 987 B9R1.13 C=C(C)Cc1cccs1 Amb27413817 [1,1,0,0,0,0|0,1,1]=4 988 B9R1.13 C=C(Cl)Cc1ccco1 Amb27881309 [1,1,0,0,0,0|0,0,1]=3 989 B9R1.13 C=C(Cl)Cc1cccs1 Amb24674094 [1,1,0,0,0,0|0,1,1]=4 990 B9R1.13 C=C(Cl)Sc1cccs1 Amb27462347 [1,1,0,0,0,0|1,1,0]=4 991 B9R1.13 CC(=O)Cc1ccco1 Amb5751052 [1,1,0,0,0,0|0,0,1]=3 992 B9R1.13 CC(=O)Cc1cccs1 Amb3429447 [1,1,0,0,0,0|0,1,1]=4 993 B9R1.13 CC(=O)Cc1ccno1 Amb24425365 [1,1,0,0,0,0|1,0,1]=4 994 B9R1.13 CC(=O)Cc1cnco1 Amb33416893 [1,1,0,0,0,0|1,0,1]=4 995 B9R1.13 CC(=O)Nc1ccco1 Amb2611741 [1,1,0,0,0,0|1,0,0]=3 996 B9R1.13 CC(=O)Nc1cccs1 Amb2228309 [1,1,0,0,0,0|1,1,0]=4 997 B9R1.13 CC(=O)Nc1ncco1 Amb27614332 [1,1,0,0,0,0|2,0,0]=4 998 B9R1.13 CC(=O)Oc1ccco1 Amb27614492 [1,1,0,0,0,0|1,0,0]=3 999 B9R1.13 CC(=O)\C=C1/C=CCO1 Amb27186200 [1,1,0,0,0,0|0,0,1]=3 1000 B9R1.13 CC(=O)\C=C1\CC=CO1 Amb28326023 [1,1,0,0,0,0|0,0,1]=3 1001 B9R1.13 F\C(Br)=C\c1ccco1 Amb27847169 [1,1,0,0,0,0|1,0,0]=3 1002 B9R1.13 F\C(Br)=C\c1cccs1 Amb28428694 [1,1,0,0,0,0|1,1,0]=4 1003 B9R1.13 N=C(N)Cc1ccco1 Amb27834673 [1,1,0,0,0,0|1,0,1]=4 1004 B9R1.13 NC(=O)Cc1cccs1 Amb3620365 [1,1,0,0,0,0|0,1,1]=4 1005 B9R1.13 NC(=O)Nc1ccco1 Amb27804619 [1,1,0,0,0,0|1,0,0]=3 1006 B9R1.13 NC(=O)Nc1cccs1 Amb28248962 [1,1,0,0,0,0|1,1,0]=4 1007 B9R1.13 NC(=O)Nc1ncco1 Amb27201421 [1,1,0,0,0,0|2,0,0]=4 1008 B9R1.13 NC(=S)Cc1ccco1 Amb27217977 [1,1,0,0,0,0|0,1,1]=4 1009 B9R1.13 O=C(Cl)Cc1ccco1 Amb25124003 [1,1,0,0,0,0|0,0,1]=3 1010 B9R1.13 O=C(Cl)Cc1cccs1 Amb535730 [1,1,0,0,0,0|0,1,1]=4 1011 B9R1.13 O=C(O)CC1=CC=CC1 Amb28370362 [1,1,0,0,0,0|1,0,1]=4 1012 B9R1.13 O=C(O)Cc1ccco1 Amb2792725 [1,1,0,0,0,0|0,0,1]=3 1013 B9R1.13 O=C(O)Cc1cccs1 Amb6335251 [1,1,0,0,0,0|0,1,1]=4 1014 B9R1.13 O=C(O)Cc1ccno1 Amb8009410 [1,1,0,0,0,0|1,0,1]=4 1015 B9R1.13 O=C(O)Cc1cnco1 Amb8009409 [1,1,0,0,0,0|1,0,1]=4 1016 B9R1.13 O=C(O)Cc1ncco1 Amb8009407 [1,1,0,0,0,0|1,0,1]=4 1017 B9R1.13 O=C([O-])Cc1cnco1 Amb33621239 [1,1,0,0,0,0|1,0,1]=4 1018 B9R1.13 O=[N+]([O-])Cc1ccco1 Amb28240844 [1,1,0,0,0,0|1,0,1]=4 1019 B9R1.33 C=CCc1cccn1C Amb26872959 [1,1,0,0,0,0|1,0,1]=4 1020 B9R1.33 C=CCc1sccc1I Amb27268613 [1,1,0,0,0,0|0,1,1]=4 1021 B9R1.33 Cc1ccoc1CC=O Amb28198051 [1,1,0,0,0,0|0,0,1]=3 1022 B9R1.33 Cc1ccoc1N=C=O Amb6572129 [1,1,0,0,0,0|1,0,1]=4 1023 B9R1.33 Cc1ccsc1CC=O Amb27155654 [1,1,0,0,0,0|0,1,1]=4 1024 B9R1.33 Cc1ccsc1NC=O Amb8439406 [1,1,0,0,0,0|1,1,0]=4 1025 B9R1.33 Cc1ccsc1\C=C\Br Amb33134854 [1,1,0,0,0,0|1,1,0]=4 1026 B9R1.33 Cc1ncoc1\C=C\Br Amb33135378 [1,1,0,0,0,0|2,0,0]=4 1027 B9R1.33 Cn1cccc1CC=O Amb27244764 [1,1,0,0,0,0|1,0,1]=4 1028 B9R1.33 Cn1cccc1OC=O Amb27636461 [1,1,0,0,0,0|2,0,0]=4 1029 B9R1.33 Cn1cccc1\C=C\Br Amb33134919 [1,1,0,0,0,0|2,0,0]=4 1030 B9R1.33 O=C=Nc1occc1Br Amb35675853 [1,1,0,0,0,0|1,0,1]=4 1031 B9R1.33 O=CCc1occc1Br Amb28049072 [1,1,0,0,0,0|0,0,1]=3 1032 B9R1.33 O=CCc1sccc1Br Amb24534254 [1,1,0,0,0,0|0,1,1]=4 1033 B9R1.33 O=CCc1sccc1Cl Amb26509642 [1,1,0,0,0,0|0,1,1]=4 1034 B9R1.33 O\N=C\c1occc1Br Amb27768798 [1,1,0,0,0,0|1,0,1]=4 1035 B9R1.9 O=C\C=C/C1CC(=O)O1 Amb28202384 [0,1,0,0,1,0|0,0,2]=4 1036 B11R1.1 C=C\C=C\c1ccc(Cl)cc1 Amb25260911 [0,1,0,0,0,1|2,0,0]=4 1037 B11R1.1 C=C\C=C\c1ccc(F)cc1 Amb26993814 [0,1,0,0,0,1|2,0,0]=4 1038 B11R1.1 Cc1ccc(\C=C/C=O)cc1 Amb27268490 [0,1,0,0,0,1|1,0,0]=3 1039 B11R1.1 Cc1ccc(\C=C\C=O)cc1 Amb17232009 [0,1,0,0,0,1|1,0,0]=3 1040 B11R1.1 Cc1ccc(\C=C\C=O)cn1 Amb27845226 [0,1,0,0,0,1|1,0,0]=3 1041 B11R1.1 Cc1ccc(\C=C\C=O)nc1 Amb33448753 [0,1,0,0,0,1|1,0,0]=3 1042 B11R1.1 Cc1cnc(\C=C\C=O)cn1 Amb33374304 [0,1,0,0,0,1|1,0,0]=3 1043 B11R1.1 Cc1ncc(\C=C/C=O)cn1 Amb27268009 [0,1,0,0,0,1|2,0,0]=4 1044 B11R1.1 O=C\C=C\c1ccc(Br)cc1 Amb1787168 [0,1,0,0,0,1|1,0,0]=3 1045 B11R1.1 O=C\C=C\c1ccc(Br)cn1 Amb27245473 [0,1,0,0,0,1|1,0,0]=3 1046 B11R1.1 O=C\C=C\c1ccc(Br)nc1 Amb27796539 [0,1,0,0,0,1|1,0,0]=3 1047 B11R1.1 O=C\C=C\c1ccc(Cl)cc1 Amb34005096 [0,1,0,0,0,1|1,0,0]=3 1048 B11R1.1 O=C\C=C\c1ccc(Cl)cn1 Amb33223968 [0,1,0,0,0,1|1,0,0]=3 1049 B11R1.1 O=C\C=C\c1ccc(Cl)nc1 Amb33220743 [0,1,0,0,0,1|1,0,0]=3 1050 B11R1.1 O=C\C=C\c1ccc(F)cc1 Amb6296447 [0,1,0,0,0,1|1,0,0]=3 1051 B11R1.1 O=C\C=C\c1ccc(F)cn1 Amb33317377 [0,1,0,0,0,1|1,0,0]=3 1052 B11R1.1 O=C\C=C\c1ccc(F)nc1 Amb33425820 [0,1,0,0,0,1|1,0,0]=3 1053 B11R1.1 O=C\C=C\c1ccc(O)cc1 Amb6296905 [0,1,0,0,0,1|1,0,0]=3 1054 B11R1.1 O=C\C=C\c1ncc(Br)cn1 Amb33334786 [0,1,0,0,0,1|1,0,0]=3 1055 B11R1.1 O=C\N=C\c1ccc(O)cc1 Amb26557720 [0,1,0,0,0,1|2,0,0]=4 1056 B11R1.16 C=C(NC=O)c1ccccc1 Amb28046518 [0,1,0,0,0,1|2,0,0]=4 1057 B11R1.16 C=C\C=C(\N)c1ccccc1 Amb26578846 [0,1,0,0,0,1|2,0,0]=4 1058 B11R1.16 C=C\C=C(\N)c1ccccn1 Amb24579514 [0,1,0,0,0,1|2,0,0]=4 1059 B11R1.16 C\C(=C/C=O)c1ccccc1 Amb17593660 [0,1,0,0,0,1|1,0,0]=3 1060 B11R1.16 C\C(=C\C=O)c1ccccn1 Amb27848247 [0,1,0,0,0,1|1,0,0]=3 1061 B11R1.16 C\C(=C\C=O)c1cccnc1 Amb28056958 [0,1,0,0,0,1|1,0,0]=3 1062 B11R1.16 C\C(=C\C=O)c1ccncc1 Amb27855013 [0,1,0,0,0,1|1,0,0]=3 1063 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [0,1,0,0,0,1|2,0,0]=4 1064 B11R1.16 C\C=C\C(=O)c1cccnc1 Amb25712944 [0,1,0,0,0,1|2,0,0]=4 1065 B11R1.16 O=C(\C=C/[O-])c1ccccc1 Amb17843402 [0,1,0,0,0,1|1,0,1]=4 1066 B11R1.16 O=C(\C=C/[O-])c1ccccc1 Amb2385893 [0,1,0,0,0,1|1,0,1]=4 1067 B11R1.16 O=C(\C=C\Cl)c1ccccc1 Amb17594153 [0,1,0,0,0,1|2,0,0]=4 1068 B11R1.16 O=C(\C=C\Cl)c1ccccn1 Amb35645311 [0,1,0,0,0,1|2,0,0]=4 1069 B11R1.16 O=C(\C=C\Cl)c1cccnc1 Amb35645317 [0,1,0,0,0,1|2,0,0]=4 1070 B11R1.16 O=C(\C=C\Cl)c1ccncc1 Amb35645314 [0,1,0,0,0,1|2,0,0]=4 1071 B11R1.16 O=C(\C=C\Cl)c1ccncn1 Amb35628814 [0,1,0,0,0,1|2,0,0]=4 1072 B11R1.16 O=C(\C=C\Cl)c1cnccn1 Amb35609471 [0,1,0,0,0,1|2,0,0]=4 1073 B11R1.16 O=C(\C=C\[O-])c1ccccc1 Amb22360915 [0,1,0,0,0,1|1,0,1]=4 1074 B11R1.16 O=C(\C=C\[O-])c1cnccn1 Amb35789121 [0,1,0,0,0,1|1,0,1]=4 1075 B11R1.16 O=CCC(=O)c1ccccc1 Amb8394158 [0,1,0,0,0,1|1,0,1]=4 1076 B11R1.16 O=CCC(=O)c1ccccn1 Amb9204927 [0,1,0,0,0,1|1,0,1]=4 1077 B11R1.16 O=CCC(=O)c1cccnc1 Amb9204929 [0,1,0,0,0,1|1,0,1]=4 1078 B11R1.16 O=CCC(=O)c1ccncc1 Amb9204939 [0,1,0,0,0,1|1,0,1]=4 1079 B11R1.16 O=CCC(=O)c1ccncn1 Amb26967626 [0,1,0,0,0,1|1,0,1]=4 1080 B11R1.16 O=CCC(=O)c1cnccn1 Amb24763812 [0,1,0,0,0,1|1,0,1]=4 1081 B11R1.16 O=CCC(=O)c1ncccn1 Amb27413849 [0,1,0,0,0,1|1,0,1]=4 1082 B11R1.16 O=CNC(=O)c1ccccn1 Amb27831529 [0,1,0,0,0,1|2,0,0]=4 1083 B11R1.16 O=COC(=O)c1ccccc1 Amb27421012 [0,1,0,0,0,1|2,0,0]=4 1084 B11R1.16 O=C[CH-]C(=O)c1ccccc1 Amb24121236 [0,1,0,0,0,1|1,0,1]=4 1085 B11R1.16 O=C[CH-]C(=O)c1cccnc1 Amb27816419 [0,1,0,0,0,1|1,0,1]=4 1086 B11R1.16 O=C\C=C(/Cl)c1ccccc1 Amb17232626 [0,1,0,0,0,1|1,0,0]=3 1087 B11R1.16 O=C\C=C(/Cl)c1cccnc1 Amb24378408 [0,1,0,0,0,1|1,0,0]=3 1088 B11R1.17 C=C\C=C\c1ccccc1C Amb26953331 [0,1,0,0,0,1|2,0,0]=4 1089 B11R1.17 Cc1ccccc1\C=C\C=O Amb17232007 [0,1,0,0,0,1|1,0,0]=3 1090 B11R1.17 Cc1cccnc1\C=C\C=O Amb33428727 [0,1,0,0,0,1|1,0,0]=3 1091 B11R1.17 Cc1ccncc1\C=C\C=O Amb32953945 [0,1,0,0,0,1|1,0,0]=3 1092 B11R1.17 Cc1cnccc1\C=C\C=O Amb33414326 [0,1,0,0,0,1|1,0,0]=3 1093 B11R1.17 Cc1ncccc1\C=C\C=O Amb32878968 [0,1,0,0,0,1|1,0,0]=3 1094 B11R1.17 Cc1nccnc1\C=C\C=O Amb35600874 [0,1,0,0,0,1|1,0,0]=3 1095 B11R1.17 Cc1ncncc1\C=C\C=O Amb33149152 [0,1,0,0,0,1|2,0,0]=4 1096 B11R1.17 N=C\C=C\c1ccccc1O Amb27226996 [0,1,0,0,0,1|2,0,0]=4 1097 B11R1.17 Nc1ccccc1\C=C\C=O Amb24538270 [0,1,0,0,0,1|1,0,0]=3 1098 B11R1.17 Nc1ccncc1\N=C\C=O Amb26637985 [0,1,0,0,0,1|2,0,0]=4 1099 B11R1.17 Nc1cnccc1\N=C\C=O Amb25255524 [0,1,0,0,0,1|2,0,0]=4 1100 B11R1.17 O=C\C=C\c1ccccc1Br Amb17240825 [0,1,0,0,0,1|1,0,0]=3 1101 B11R1.17 O=C\C=C\c1ccccc1Cl Amb17232625 [0,1,0,0,0,1|1,0,0]=3 1102 B11R1.17 O=C\C=C\c1ccccc1F Amb17232062 [0,1,0,0,0,1|1,0,0]=3 1103 B11R1.17 O=C\C=C\c1ccccc1O Amb842565 [0,1,0,0,0,1|1,0,0]=3 1104 B11R1.17 O=C\C=C\c1ccccc1S Amb28422741 [0,1,0,0,0,1|1,0,0]=3 1105 B11R1.17 O=C\C=C\c1cccnc1Br Amb33387808 [0,1,0,0,0,1|1,0,0]=3 1106 B11R1.17 O=C\C=C\c1cccnc1Cl Amb33406391 [0,1,0,0,0,1|1,0,0]=3 1107 B11R1.17 O=C\C=C\c1cccnc1F Amb33224035 [0,1,0,0,0,1|1,0,0]=3 1108 B11R1.17 O=C\C=C\c1ccncc1Br Amb33478364 [0,1,0,0,0,1|1,0,0]=3 1109 B11R1.17 O=C\C=C\c1ccncc1Cl Amb33413767 [0,1,0,0,0,1|1,0,0]=3 1110 B11R1.17 O=C\C=C\c1ccncc1F Amb33317172 [0,1,0,0,0,1|1,0,0]=3 1111 B11R1.17 O=C\C=C\c1ncccc1Br Amb33388586 [0,1,0,0,0,1|1,0,0]=3 1112 B11R1.17 O=C\C=C\c1ncccc1F Amb33418874 [0,1,0,0,0,1|1,0,0]=3 1113 B11R1.17 O=C\N=C\c1ccccc1O Amb24422424 [0,1,0,0,0,1|2,0,0]=4 1114 B11R1.24 Cc1cc(\C=C\C=O)ccn1 Amb33340430 [0,1,0,0,0,1|1,0,0]=3 1115 B11R1.24 Cc1cccc(\C=C\C=O)c1 Amb17232008 [0,1,0,0,0,1|1,0,0]=3 1116 B11R1.24 Cc1cccc(\C=C\C=O)n1 Amb33449582 [0,1,0,0,0,1|1,0,0]=3 1117 B11R1.24 Cc1ccnc(\C=C\C=O)c1 Amb33318077 [0,1,0,0,0,1|1,0,0]=3 1118 B11R1.24 Cc1cncc(\C=C\C=O)c1 Amb33317993 [0,1,0,0,0,1|1,0,0]=3 1119 B11R1.24 O=C\C=C\C1=CC(=O)CCC1 Amb26974514 [0,1,0,0,0,1|1,0,1]=4 1120 B11R1.24 O=C\C=C\c1cc(F)ccn1 Amb33320266 [0,1,0,0,0,1|1,0,0]=3 1121 B11R1.24 O=C\C=C\c1cccc(Br)c1 Amb17240826 [0,1,0,0,0,1|1,0,0]=3 1122 B11R1.24 O=C\C=C\c1cccc(Br)n1 Amb28185081 [0,1,0,0,0,1|1,0,0]=3 1123 B11R1.24 O=C\C=C\c1cccc(Cl)c1 Amb16193215 [0,1,0,0,0,1|1,0,0]=3 1124 B11R1.24 O=C\C=C\c1cccc(Cl)n1 Amb33222389 [0,1,0,0,0,1|1,0,0]=3 1125 B11R1.24 O=C\C=C\c1cccc(F)c1 Amb17232063 [0,1,0,0,0,1|1,0,0]=3 1126 B11R1.24 O=C\C=C\c1cccc(O)c1 Amb17334281 [0,1,0,0,0,1|1,0,0]=3 1127 B11R1.24 O=C\C=C\c1cncc(Br)c1 Amb33450900 [0,1,0,0,0,1|1,0,0]=3 1128 B11R1.24 O=C\C=C\c1cncc(F)c1 Amb33227063 [0,1,0,0,0,1|1,0,0]=3 1129 B11R1.28 Br\C=C\C=C\c1ccccc1 Amb27963876 [0,1,0,0,0,1|2,0,0]=4 1130 B11R1.28 C=CC\C=C\c1ccccc1 Amb8393997 [0,1,0,0,0,1|2,0,0]=4 1131 B11R1.28 C=C\C=C\Sc1ccccc1 Amb28284520 [0,1,0,0,0,1|2,0,0]=4 1132 B11R1.28 C\C=C/N=C/c1cccnc1 Amb24486027 [0,1,0,0,0,1|2,0,0]=4 1133 B11R1.28 C\C=C\C=C\c1ccccc1 Amb27870048 [0,1,0,0,0,1|2,0,0]=4 1134 B11R1.28 C\C=C\N=C\c1cccnc1 Amb26566876 [0,1,0,0,0,1|2,0,0]=4 1135 B11R1.28 Cl\C=C\C=C\c1ccccc1 Amb8392466 [0,1,0,0,0,1|2,0,0]=4 1136 B11R1.28 N\C=C\C=C\c1ccccc1 Amb27393486 [0,1,0,0,0,1|2,0,0]=4 1137 B11R1.28 N\C=C\C=C\c1ccccn1 Amb27961333 [0,1,0,0,0,1|2,0,0]=4 1138 B11R1.28 N\N=C\C=C\c1ccccc1 Amb27764571 [0,1,0,0,0,1|2,0,0]=4 1139 B11R1.28 N\N=C\C=C\c1ccccn1 Amb27768304 [0,1,0,0,0,1|2,0,0]=4 1140 B11R1.28 O=C=C\C=C/c1ccccn1 Amb27434448 [0,1,0,0,0,1|1,0,0]=3 1141 B11R1.28 O=C=C\C=C\c1ccccn1 Amb27622513 [0,1,0,0,0,1|1,0,0]=3 1142 B11R1.28 O=CN\N=C/c1ccccc1 Amb2612268 [0,1,0,0,0,1|2,0,0]=4 1143 B11R1.28 O=C\C=C/Cc1ccccc1 Amb27861231 [0,1,0,0,0,1|1,0,0]=3 1144 B11R1.28 O=C\C=C\Cc1ccccc1 Amb32954519 [0,1,0,0,0,1|1,0,0]=3 1145 B11R1.28 O=C\C=C\Nc1ccccc1 Amb18124821 [0,1,0,0,0,1|1,0,0]=3 1146 B11R1.28 O=C\C=C\Nc1cccnc1 Amb27445449 [0,1,0,0,0,1|1,0,0]=3 1147 B11R1.28 O=C\C=C\Oc1ccccc1 Amb24585165 [0,1,0,0,0,1|1,0,0]=3 1148 B11R1.28 O=C\C=N\Nc1ccccc1 Amb2417721 [0,1,0,0,0,1|2,0,0]=4 1149 B11R1.28 O\C=C\C=C\c1ccccc1 Amb27970649 [0,1,0,0,0,1|1,0,1]=4 1150 B11R1.28 O\N=C\C=C/c1ccccc1 Amb24668019 [0,1,0,0,0,1|1,0,1]=4 1151 B11R1.28 O\N=C\C=C\c1ccccc1 Amb28366863 [0,1,0,0,0,1|1,0,1]=4 1152 B11R1.40 C=C(C=O)Cc1ccccc1 Amb8392633 [0,1,0,0,0,1|1,0,1]=4 1153 B11R1.40 C=C\C(C)=C/c1ccccc1 Amb27428211 [0,1,0,0,0,1|2,0,0]=4 1154 B11R1.40 C=C\C(C)=C\c1ccccc1 Amb27950688 [0,1,0,0,0,1|2,0,0]=4 1155 B11R1.40 C=C\C(C)=C\c1ccccn1 Amb24101881 [0,1,0,0,0,1|2,0,0]=4 1156 B11R1.40 C=C\C(C)=C\c1cccnc1 Amb24085616 [0,1,0,0,0,1|2,0,0]=4 1157 B11R1.40 C=C\C(C)=C\c1ccncc1 Amb24103157 [0,1,0,0,0,1|2,0,0]=4 1158 B11R1.40 C\C(C=O)=C/c1ccccc1 Amb6608709 [0,1,0,0,0,1|1,0,0]=3 1159 B11R1.40 C\C(C=O)=C/c1ccccn1 Amb1014105 [0,1,0,0,0,1|1,0,0]=3 1160 B11R1.40 C\C(C=O)=C/c1cccnc1 Amb17334266 [0,1,0,0,0,1|1,0,0]=3 1161 B11R1.40 C\C(C=O)=C/c1ccncc1 Amb17334268 [0,1,0,0,0,1|1,0,0]=3 1162 B11R1.40 C\C(C=O)=C/c1cncnc1 Amb28058466 [0,1,0,0,0,1|2,0,0]=4 1163 B11R1.40 C\C(C=O)=C\c1cccnc1 Amb28070736 [0,1,0,0,0,1|1,0,0]=3 1164 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,1,0,0,0,1|1,0,1]=4 1165 B11R1.40 O=CC(=O)Nc1ccccc1 Amb27643437 [0,1,0,0,0,1|2,0,0]=4 1166 B11R1.40 O=C\C(Br)=C/c1ccccc1 Amb25047719 [0,1,0,0,0,1|1,0,0]=3 1167 B11R1.40 O=C\C(Br)=C\c1ccccc1 Amb6608679 [0,1,0,0,0,1|1,0,0]=3 1168 B11R1.40 O=C\C(Cl)=C/c1ccccc1 Amb6297306 [0,1,0,0,0,1|1,0,0]=3 1169 B11R1.40 O=C\C(Cl)=C\c1ccccc1 Amb2792752 [0,1,0,0,0,1|1,0,0]=3 1170 B11R1.40 O=C\C(Cl)=C\c1ccccn1 Amb18126489 [0,1,0,0,0,1|1,0,0]=3 1171 B11R1.40 O=C\C(O)=C\c1ccccc1 Amb18124881 [0,1,0,0,0,1|1,0,0]=3 1172 B11R1.40 O=N\C(Br)=C/c1ccccc1 Amb27862869 [0,1,0,0,0,1|2,0,0]=4 1173 B11R1.91 C=C(C)\C=C\c1ccccc1 Amb22546632 [0,1,0,0,0,1|2,0,0]=4 1174 B11R1.91 CC(=O)\C=C\C1CCC=CO1 Amb26463190 [0,1,0,0,0,1|0,0,2]=4 1175 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [0,1,0,0,0,1|1,0,0]=3 1176 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb33716963 [0,1,0,0,0,1|1,0,0]=3 1177 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb17477755 [0,1,0,0,0,1|1,0,0]=3 1178 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb32652097 [0,1,0,0,0,1|1,0,0]=3 1179 B11R1.91 CC(=O)\C=C\c1cccnc1 Amb33223775 [0,1,0,0,0,1|1,0,0]=3 1180 B11R1.91 CC(=O)\C=C\c1ccncc1 Amb33359225 [0,1,0,0,0,1|1,0,0]=3 1181 B11R1.91 CC(=O)\C=C\c1ccncn1 Amb33359235 [0,1,0,0,0,1|1,0,0]=3 1182 B11R1.91 CC(=O)\C=C\c1cnccn1 Amb35601036 [0,1,0,0,0,1|1,0,0]=3 1183 B11R1.91 CC(=O)\C=C\c1cncnc1 Amb32876838 [0,1,0,0,0,1|2,0,0]=4 1184 B11R1.91 CC(=O)\C=C\c1ncccn1 Amb26488880 [0,1,0,0,0,1|1,0,0]=3 1185 B11R1.91 N=C(N)\C=C\c1ccccc1 Amb22756994 [0,1,0,0,0,1|2,0,0]=4 1186 B11R1.91 N=C(N)\C=C\c1cccnc1 Amb25992761 [0,1,0,0,0,1|2,0,0]=4 1187 B11R1.91 NC(=O)\C=C/c1ccccc1 Amb4420621 [0,1,0,0,0,1|1,0,0]=3 1188 B11R1.91 NC(=O)\C=C/c1cccnc1 Amb10552966 [0,1,0,0,0,1|1,0,0]=3 1189 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb33719420 [0,1,0,0,0,1|1,0,0]=3 1190 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb8513084 [0,1,0,0,0,1|1,0,0]=3 1191 B11R1.91 NC(=O)\C=C\c1ccccn1 Amb25887084 [0,1,0,0,0,1|1,0,0]=3 1192 B11R1.91 NC(=O)\C=C\c1cccnc1 Amb33854872 [0,1,0,0,0,1|1,0,0]=3 1193 B11R1.91 NC(=O)\C=C\c1ccncc1 Amb26859260 [0,1,0,0,0,1|1,0,0]=3 1194 B11R1.91 NC(=O)\N=C\c1ccccc1 Amb28364091 [0,1,0,0,0,1|2,0,0]=4 1195 B11R1.91 NC(=S)\C=C\c1ccccc1 Amb18105844 [0,1,0,0,0,1|1,1,0]=4 1196 B11R1.91 NC(=S)\C=C\c1ccccn1 Amb27233532 [0,1,0,0,0,1|1,1,0]=4 1197 B11R1.91 NC(=S)\C=C\c1cccnc1 Amb27232946 [0,1,0,0,0,1|1,1,0]=4 1198 B11R1.91 O=C(Cl)\C=C\c1ccccc1 Amb2792900 [0,1,0,0,0,1|1,0,0]=3 1199 B11R1.91 O=C(Cl)\C=C\c1cccnc1 Amb6307270 [0,1,0,0,0,1|1,0,0]=3 1200 B11R1.91 O=C(O)\C=C/c1ccccc1 Amb26880208 [0,1,0,0,0,1|1,0,0]=3 1201 B11R1.91 O=C(O)\C=C/c1ccccn1 Amb10071558 [0,1,0,0,0,1|1,0,0]=3 1202 B11R1.91 O=C(O)\C=C/c1cccnc1 Amb25378742 [0,1,0,0,0,1|1,0,0]=3 1203 B11R1.91 O=C(O)\C=C/c1ccncc1 Amb20622011 [0,1,0,0,0,1|1,0,0]=3 1204 B11R1.91 O=C(O)\C=C/c1cncnc1 Amb27975406 [0,1,0,0,0,1|2,0,0]=4 1205 B11R1.91 O=C(O)\C=C\C1CCC=CO1 Amb25145804 [0,1,0,0,0,1|0,0,2]=4 1206 B11R1.91 O=C(O)\C=C\N1C=CC=CC1 Amb22015329 [0,1,0,0,0,1|2,0,0]=4 1207 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb33719192 [0,1,0,0,0,1|1,0,0]=3 1208 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb6456608 [0,1,0,0,0,1|1,0,0]=3 1209 B11R1.91 O=C(O)\C=C\c1ccccn1 Amb2690432 [0,1,0,0,0,1|1,0,0]=3 1210 B11R1.91 O=C(O)\C=C\c1cccnc1 Amb2690433 [0,1,0,0,0,1|1,0,0]=3 1211 B11R1.91 O=C(O)\C=C\c1cccnc1 Amb33718815 [0,1,0,0,0,1|1,0,0]=3 1212 B11R1.91 O=C(O)\C=C\c1cccnn1 Amb18125070 [0,1,0,0,0,1|1,0,0]=3 1213 B11R1.91 O=C(O)\C=C\c1ccncc1 Amb1107607 [0,1,0,0,0,1|1,0,0]=3 1214 B11R1.91 O=C(O)\C=C\c1ccncn1 Amb25337419 [0,1,0,0,0,1|1,0,0]=3 1215 B11R1.91 O=C(O)\C=C\c1ccnnc1 Amb18125071 [0,1,0,0,0,1|2,0,0]=4 1216 B11R1.91 O=C(O)\C=C\c1cnccn1 Amb24082749 [0,1,0,0,0,1|1,0,0]=3 1217 B11R1.91 O=C(O)\C=C\c1cncnc1 Amb9780324 [0,1,0,0,0,1|2,0,0]=4 1218 B11R1.91 O=C(O)\C=C\c1ncccn1 Amb17593721 [0,1,0,0,0,1|1,0,0]=3 1219 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb33513073 [0,1,0,0,0,1|1,0,0]=3 1220 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb6383246 [0,1,0,0,0,1|1,0,0]=3 1221 B11R1.91 O=C([O-])\C=C\c1cccnc1 Amb33512942 [0,1,0,0,0,1|1,0,0]=3 1222 B11R1.91 O=S(O)\C=C\c1ccccc1 Amb32753683 [0,1,0,0,0,1|2,0,0]=4 1223 B11R1.91 O=S([O-])\C=C\c1ccccc1 Amb26016414 [0,1,0,0,0,1|2,0,0]=4 1224 B11R1.91 O=[N+]([O-])\C=C/c1ccccc1 Amb4066298 [0,1,0,0,0,1|2,0,0]=4 1225 B11R1.91 O=[N+]([O-])\C=C/c1ccncc1 Amb1054083 [0,1,0,0,0,1|2,0,0]=4 1226 B11R1.91 O=[N+]([O-])\C=C\c1ccccc1 Amb33719275 [0,1,0,0,0,1|2,0,0]=4 1227 B11R1.91 O=[N+]([O-])\C=C\c1ccccc1 Amb8396046 [0,1,0,0,0,1|2,0,0]=4 1228 B11R1.91 O=[N+]([O-])\C=C\c1ccccn1 Amb19373998 [0,1,0,0,0,1|2,0,0]=4 1229 B11R1.91 O=[N+]([O-])\C=C\c1ccccn1 Amb24106744 [0,1,0,0,0,1|2,0,0]=4 1230 B11R1.91 O=[N+]([O-])\C=C\c1cccnc1 Amb19515469 [0,1,0,0,0,1|2,0,0]=4 1231 B11R1.91 O=[N+]([O-])\C=C\c1cccnc1 Amb33512945 [0,1,0,0,0,1|2,0,0]=4 1232 B11R1.91 O=[N+]([O-])\C=C\c1ccncc1 Amb19374504 [0,1,0,0,0,1|2,0,0]=4 1233 B11R1.91 O=[N+]([O-])\C=C\c1ccncc1 Amb24096963 [0,1,0,0,0,1|2,0,0]=4 1234 B11R1.91 O=[N+]([O-])\C=C\c1ccncn1 Amb33171845 [0,1,0,0,0,1|2,0,0]=4 1235 B11R1.91 O=[N+]([O-])\C=C\c1cnccn1 Amb26880363 [0,1,0,0,0,1|2,0,0]=4 1236 B11R1.91 O=[N+]([O-])\C=C\c1ncccn1 Amb27968261 [0,1,0,0,0,1|2,0,0]=4 1237 B11R1.2 O=C\C=C(/C=O)c1cccs1 Amb18126437 [0,2,0,0,0,0|0,1,0]=3 1238 B11R1.2 O=C\C=C(\C=O)c1ccco1 Amb25830502 [0,2,0,0,0,0|0,0,0]=2 1239 B11R1.2 O=C\C=C(\C=O)c1cccs1 Amb25992115 [0,2,0,0,0,0|0,1,0]=3 1240 B11R1.15 C=CCC(=O)c1ccc(Br)o1 Amb28284933 [0,2,0,0,0,0|1,0,1]=4 1241 B11R1.15 C=COC(=O)c1ccc(C)o1 Amb27851994 [0,2,0,0,0,0|2,0,0]=4 1242 B11R1.15 C\C(=C/CN)c1ccc(C)o1 Amb31161557 [0,2,0,0,0,0|1,0,1]=4 1243 B11R1.15 C\C(=C\C#N)c1ccc(C)o1 Amb27600588 [0,2,0,0,0,0|1,0,1]=4 1244 B11R1.15 C\C(=C\C=O)c1ccc(C)o1 Amb18125133 [0,2,0,0,0,0|0,0,0]=2 1245 B11R1.15 C\C(=C\CN)c1ccc(Br)o1 Amb27601696 [0,2,0,0,0,0|1,0,1]=4 1246 B11R1.15 C\C(=C\CN)c1ccc(C)o1 Amb27823085 [0,2,0,0,0,0|1,0,1]=4 1247 B11R1.15 C\C=C\C(=O)c1cc(Br)cs1 Amb28065902 [0,2,0,0,0,0|1,1,0]=4 1248 B11R1.15 C\C=C\C(=O)c1ccc(Br)s1 Amb27835104 [0,2,0,0,0,0|1,1,0]=4 1249 B11R1.15 C\C=C\C(=O)c1ccc(C)s1 Amb27602882 [0,2,0,0,0,0|1,1,0]=4 1250 B11R1.15 C\C=C\C(=O)c1ccc(Cl)s1 Amb28124272 [0,2,0,0,0,0|1,1,0]=4 1251 B11R1.15 Cc1cc(C(=O)\C=C\Cl)on1 Amb29880150 [0,2,0,0,0,0|2,0,0]=4 1252 B11R1.15 Cc1ccc(C(=O)C=[N+]=[N-])o1 Amb25721267 [0,2,0,0,0,0|2,0,0]=4 1253 B11R1.15 Cc1ccc(C(=O)CC=O)o1 Amb9204923 [0,2,0,0,0,0|0,0,1]=3 1254 B11R1.15 Cc1ccc(C(=O)CC=O)s1 Amb9204920 [0,2,0,0,0,0|0,1,1]=4 1255 B11R1.15 Cc1ccc(C(=O)\C=C\Cl)o1 Amb35609121 [0,2,0,0,0,0|1,0,0]=3 1256 B11R1.15 Cc1ccc(C(=O)\C=C\Cl)s1 Amb35609454 [0,2,0,0,0,0|1,1,0]=4 1257 B11R1.15 Cc1ccc(C(=O)\C=C\[O-])s1 Amb28365543 [0,2,0,0,0,0|0,1,1]=4 1258 B11R1.15 Cc1ccc(C(C)CC=O)o1 Amb3941709 [0,2,0,0,0,0|0,0,2]=4 1259 B11R1.15 Cc1ccc(\C(N)=C\C#N)o1 Amb28064247 [0,2,0,0,0,0|1,0,1]=4 1260 B11R1.15 Cc1csc(C(=O)\C=C\Cl)c1 Amb29880467 [0,2,0,0,0,0|1,1,0]=4 1261 B11R1.15 N#C\C=C(\N)c1ccc(Br)o1 Amb27479128 [0,2,0,0,0,0|1,0,1]=4 1262 B11R1.15 O=C(\C=C\Cl)c1ccc(Br)o1 Amb35609474 [0,2,0,0,0,0|1,0,0]=3 1263 B11R1.15 O=C(\C=C\Cl)c1ccc(Br)s1 Amb35609112 [0,2,0,0,0,0|1,1,0]=4 1264 B11R1.15 O=C(\C=C\Cl)c1ccc(Cl)o1 Amb35609156 [0,2,0,0,0,0|1,0,0]=3 1265 B11R1.15 O=C(\C=C\Cl)c1ccc(Cl)s1 Amb35609110 [0,2,0,0,0,0|1,1,0]=4 1266 B11R1.15 O=C(\C=C\[O-])c1cc(Br)cs1 Amb27770886 [0,2,0,0,0,0|0,1,1]=4 1267 B11R1.15 O=C(\C=C\[O-])c1ccc(Br)o1 Amb27656671 [0,2,0,0,0,0|0,0,1]=3 1268 B11R1.15 O=C(\C=C\[O-])c1ccc(Br)s1 Amb27223715 [0,2,0,0,0,0|0,1,1]=4 1269 B11R1.15 O=CCC(=O)c1cc(Br)cs1 Amb18228012 [0,2,0,0,0,0|0,1,1]=4 1270 B11R1.15 O=CCC(=O)c1ccc(Br)o1 Amb24623460 [0,2,0,0,0,0|0,0,1]=3 1271 B11R1.15 O=CCC(=O)c1ccc(Br)s1 Amb25118336 [0,2,0,0,0,0|0,1,1]=4 1272 B11R1.15 O=CCC(=O)c1ccc(Cl)s1 Amb9297638 [0,2,0,0,0,0|0,1,1]=4 1273 B11R1.15 O=C\C=C(/Cl)c1ccc(Br)s1 Amb17262459 [0,2,0,0,0,0|0,1,0]=3 1274 B11R1.15 O=C\C=C(/Cl)c1ccc(Cl)s1 Amb17239159 [0,2,0,0,0,0|0,1,0]=3 1275 B11R1.15 O=C\C=C(\Cl)c1ccc(Br)s1 Amb28386570 [0,2,0,0,0,0|0,1,0]=3 1276 B11R1.29 C=CCCC(=O)c1ccco1 Amb27271593 [0,2,0,0,0,0|1,0,1]=4 1277 B11R1.29 C=CCNC(=O)c1ccco1 Amb9788891 [0,2,0,0,0,0|1,0,1]=4 1278 B11R1.29 C=CO\N=C(/C)c1ccco1 Amb9805976 [0,2,0,0,0,0|2,0,0]=4 1279 B11R1.29 CS\C=C\C(=O)c1ccco1 Amb24740161 [0,2,0,0,0,0|0,1,0]=3 1280 B11R1.29 C\C(=C\CCBr)c1ccco1 Amb27982243 [0,2,0,0,0,0|1,0,1]=4 1281 B11R1.29 C\C(=N\NC=O)c1ccco1 Amb27829579 [0,2,0,0,0,0|1,0,0]=3 1282 B11R1.29 C\C=C\CC(O)c1ccco1 Amb27660844 [0,2,0,0,0,0|1,0,1]=4 1283 B11R1.29 C\C=C\NC(=O)c1cccs1 Amb28123137 [0,2,0,0,0,0|1,1,0]=4 1284 B11R1.29 C\C=N\NC(=O)c1ccco1 Amb4431675 [0,2,0,0,0,0|2,0,0]=4 1285 B11R1.29 O=CCNC(=O)c1ccco1 Amb17102063 [0,2,0,0,0,0|0,0,1]=3 1286 B11R1.29 O=CCNC(=O)c1cccs1 Amb17102064 [0,2,0,0,0,0|0,1,1]=4 1287 B11R1.29 O=CNNC(=O)c1ccco1 Amb28125504 [0,2,0,0,0,0|1,0,0]=3 1288 B11R1.29 O=CNNC(=O)c1cccs1 Amb28248938 [0,2,0,0,0,0|1,1,0]=4 1289 B11R1.29 O=COCC(=O)c1cccs1 Amb27672689 [0,2,0,0,0,0|0,1,1]=4 1290 B11R1.31 C=C(OC)C(=O)c1ccco1 Amb27854925 [0,2,0,0,0,0|2,0,0]=4 1291 B11R1.31 CC(C=O)C(=O)c1ccco1 Amb18181706 [0,2,0,0,0,0|0,0,1]=3 1292 B11R1.31 CC(C=O)C(=O)c1cccs1 Amb18788808 [0,2,0,0,0,0|0,1,1]=4 1293 B11R1.31 CC(c1ccco1)N(O)C=O Amb10606571 [0,2,0,0,0,0|1,0,1]=4 1294 B11R1.31 CCC(=O)C(=O)c1ccco1 Amb27861480 [0,2,0,0,0,0|1,0,1]=4 1295 B11R1.31 COC(=O)C(=O)c1ccco1 Amb10766373 [0,2,0,0,0,0|2,0,0]=4 1296 B11R1.31 C\C(=C\[O-])C(=O)c1ccco1 Amb27225761 [0,2,0,0,0,0|0,0,1]=3 1297 B11R1.31 C\C(C=O)=C(/Cl)c1cccs1 Amb20670063 [0,2,0,0,0,0|0,1,0]=3 1298 B11R1.31 C\C(C=O)=C(\Cl)c1cccs1 Amb20670062 [0,2,0,0,0,0|0,1,0]=3 1299 B11R1.31 N=C(C=O)C(=O)c1cccs1 Amb28201032 [0,2,0,0,0,0|0,1,0]=3 1300 B11R1.31 O=C(\C(Cl)=N/O)c1ccco1 Amb28054324 [0,2,0,0,0,0|1,0,1]=4 1301 B11R1.33 CC(O)(CC=O)c1ccco1 Amb28352343 [0,2,0,0,0,0|0,0,2]=4 1302 B11R1.77 C=C(C)CC(=O)c1ccco1 Amb18065315 [0,2,0,0,0,0|1,0,1]=4 1303 B11R1.77 C=C(CC(=O)O)c1cccs1 Amb27607726 [0,2,0,0,0,0|0,1,1]=4 1304 B11R1.77 CC(=O)CC(=O)c1ccco1 Amb6298873 [0,2,0,0,0,0|0,0,1]=3 1305 B11R1.77 CC(=O)CC(=O)c1cccs1 Amb6752515 [0,2,0,0,0,0|0,1,1]=4 1306 B11R1.77 CC(=O)CC(O)c1ccco1 Amb26055659 [0,2,0,0,0,0|0,0,2]=4 1307 B11R1.77 CC(=O)N[C@H](C)c1ccco1 Amb27834225 [0,2,0,0,0,0|1,0,1]=4 1308 B11R1.77 CC(=O)O[C@H](C)c1ccco1 Amb8515980 [0,2,0,0,0,0|1,0,1]=4 1309 B11R1.77 CC(=O)\C=C(/C)c1cccs1 Amb27227102 [0,2,0,0,0,0|0,1,0]=3 1310 B11R1.77 CC(=O)\C=C(/N)c1cccs1 Amb27823651 [0,2,0,0,0,0|0,1,0]=3 1311 B11R1.77 CC(=O)\C=C(\C)c1nccs1 Amb27951091 [0,2,0,0,0,0|1,1,0]=4 1312 B11R1.77 CC(=O)\C=C(\N)c1ccco1 Amb27251384 [0,2,0,0,0,0|0,0,0]=2 1313 B11R1.77 CC(=S)\C=C(\N)c1ccco1 Amb27398070 [0,2,0,0,0,0|0,1,0]=3 1314 B11R1.77 CC(CC(=O)O)c1ccco1 Amb33533316 [0,2,0,0,0,0|0,0,2]=4 1315 B11R1.77 CC(NC(=O)Cl)c1ccco1 Amb35625513 [0,2,0,0,0,0|1,0,1]=4 1316 B11R1.77 CS(C)=CC(=O)c1ccco1 Amb27486114 [0,2,0,0,0,0|2,0,0]=4 1317 B11R1.77 C\C(=C/C(=O)O)c1ccco1 Amb6749111 [0,2,0,0,0,0|0,0,0]=2 1318 B11R1.77 C\C(=C/C(=O)O)c1cccs1 Amb5738383 [0,2,0,0,0,0|0,1,0]=3 1319 B11R1.77 C\C(=C/C(=O)O)c1ccsc1 Amb32663912 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.77 C\C(=C\C(=O)O)c1ccco1 Amb24668653 [0,2,0,0,0,0|0,0,0]=2 1321 B11R1.77 C\C(=C\C(=O)O)c1ccoc1 Amb28050877 [0,2,0,0,0,0|2,0,0]=4 1322 B11R1.77 C\C(=C\C(=O)O)c1ccsc1 Amb18284471 [0,2,0,0,0,0|2,0,0]=4 1323 B11R1.77 C\C(=N\S(C)=O)c1ccco1 Amb29858771 [0,2,0,0,0,0|2,0,0]=4 1324 B11R1.77 NC(=O)CC(N)c1ccco1 Amb7800615 [0,2,0,0,0,0|0,0,2]=4 1325 B11R1.77 NC(=O)C[C@@H](N)c1ccco1 Amb18179504 [0,2,0,0,0,0|0,0,2]=4 1326 B11R1.77 NC(=O)C[C@H](N)c1ccco1 Amb25702198 [0,2,0,0,0,0|0,0,2]=4 1327 B11R1.77 NC(=O)\C=C(/O)c1ccco1 Amb27441744 [0,2,0,0,0,0|0,0,0]=2 1328 B11R1.77 NC(=O)\C=C(\O)c1cccs1 Amb27962881 [0,2,0,0,0,0|0,1,0]=3 1329 B11R1.77 NC(=O)\C=C(\O)c1ccoc1 Amb27202324 [0,2,0,0,0,0|2,0,0]=4 1330 B11R1.77 NC(=S)NC(=O)c1ccco1 Amb27477957 [0,2,0,0,0,0|1,1,0]=4 1331 B11R1.77 NC(CC(=O)O)c1ccco1 Amb2583027 [0,2,0,0,0,0|0,0,2]=4 1332 B11R1.77 NC(CC(=O)O)c1ccco1 Amb33295176 [0,2,0,0,0,0|0,0,2]=4 1333 B11R1.77 N[C@@H](CC(=O)O)c1ccco1 Amb18179572 [0,2,0,0,0,0|0,0,2]=4 1334 B11R1.77 N[C@H](CC(=O)O)c1ccco1 Amb25319193 [0,2,0,0,0,0|0,0,2]=4 1335 B11R1.77 O=C(NC(=S)S)c1ccco1 Amb27873321 [0,2,0,0,0,0|1,1,0]=4 1336 B11R1.77 O=C(O)CC(=O)c1ccco1 Amb18125632 [0,2,0,0,0,0|0,0,1]=3 1337 B11R1.77 O=C(O)CC(O)c1ccco1 Amb17232169 [0,2,0,0,0,0|0,0,2]=4 1338 B11R1.77 O=C(O)C[C@@H](O)c1ccco1 Amb33360966 [0,2,0,0,0,0|0,0,2]=4 1339 B11R1.77 O=C(O)C[C@H](O)c1ccco1 Amb33360969 [0,2,0,0,0,0|0,0,2]=4 1340 B11R1.77 O=C(O)\C=C(\Cl)c1cccs1 Amb27985827 [0,2,0,0,0,0|0,1,0]=3 1341 B11R1.77 O=C(O)\C=C(\Cl)c1ccsc1 Amb27657300 [0,2,0,0,0,0|2,0,0]=4 1342 B11R1.199 C\C=C\C(O)c1occc1C Amb27768548 [0,2,0,0,0,0|1,0,1]=4 1343 B11R1.199 Cc1ccoc1C(=O)\C=C\Cl Amb29880169 [0,2,0,0,0,0|1,0,0]=3 1344 B11R1.199 Cc1ccsc1C(=O)CC=O Amb27754191 [0,2,0,0,0,0|0,1,1]=4 1345 B11R1.199 Cc1ccsc1C(=O)\C=C\Cl Amb35609453 [0,2,0,0,0,0|1,1,0]=4 1346 B11R1.199 Cc1ccsc1C(=O)\C=C\[O-] Amb28365736 [0,2,0,0,0,0|0,1,1]=4 1347 B11R1.199 Cc1ncoc1C(=O)\C=C\Cl Amb35628823 [0,2,0,0,0,0|2,0,0]=4 1348 B11R1.199 Cn1cccc1C(=O)CC=O Amb27954066 [0,2,0,0,0,0|1,0,1]=4 1349 B11R1.199 N#C\C=C(\Cl)c1occc1Br Amb35674829 [0,2,0,0,0,0|1,0,1]=4 1350 B11R1.199 N#C\C=C(\N)c1occc1Br Amb35596049 [0,2,0,0,0,0|1,0,1]=4 1351 B11R1.199 O=C(\C=C\Cl)c1occc1Br Amb35628811 [0,2,0,0,0,0|1,0,0]=3 1352 B11R1.199 O=C(\C=C\Cl)c1sccc1Br Amb29880241 [0,2,0,0,0,0|1,1,0]=4 1353 B11R1.199 O=C(\C=C\Cl)c1sccc1Cl Amb35628635 [0,2,0,0,0,0|1,1,0]=4 1354 B11R1.199 O=C(\C=C\Cl)c1sccc1F Amb35628852 [0,2,0,0,0,0|1,1,0]=4 1355 B11R1.199 O=C(\C=C\Cl)c1sccc1I Amb35628807 [0,2,0,0,0,0|1,1,0]=4 1356 B11R1.199 O=C=NC(=O)c1occc1Br Amb35675854 [0,2,0,0,0,0|1,0,1]=4 1357 B11R1.27 CNC\C=C\c1ccc(C)o1 Amb27963467 [0,2,0,0,0,0|1,0,1]=4 1358 B11R1.27 CNC\C=C\c1ccc(Cl)o1 Amb27864701 [0,2,0,0,0,0|1,0,1]=4 1359 B11R1.27 Cc1ccc(CCCC=O)o1 Amb24766702 [0,2,0,0,0,0|0,0,2]=4 1360 B11R1.27 Cc1ccc(CCNC=O)o1 Amb29857354 [0,2,0,0,0,0|0,0,2]=4 1361 B11R1.27 Cc1ccc(\C=C\CCN)o1 Amb26928782 [0,2,0,0,0,0|1,0,1]=4 1362 B11R1.27 Cc1ccc(\C=C\N=C=O)o1 Amb24391577 [0,2,0,0,0,0|0,0,1]=3 1363 B11R1.27 NCC\C=C\c1ccc(Br)o1 Amb27233224 [0,2,0,0,0,0|1,0,1]=4 1364 B11R1.27 NCC\C=C\c1ccc(Cl)o1 Amb28120944 [0,2,0,0,0,0|1,0,1]=4 1365 B11R1.27 O=CCCCc1cc(Br)co1 Amb33431959 [0,2,0,0,0,0|0,0,2]=4 1366 B11R1.27 O=CCCCc1ccc(Br)o1 Amb28387943 [0,2,0,0,0,0|0,0,2]=4 1367 B11R1.27 O=CCCCc1ccc(Cl)o1 Amb33263151 [0,2,0,0,0,0|0,0,2]=4 1368 B11R1.27 O=CCSCc1ccc(Cl)o1 Amb32788962 [0,2,0,0,0,0|0,0,2]=4 1369 B11R1.27 O=CN\N=C\c1cc(Br)cs1 Amb27806218 [0,2,0,0,0,0|1,1,0]=4 1370 B11R1.27 O=CN\N=C\c1ccc(Cl)s1 Amb28350903 [0,2,0,0,0,0|1,1,0]=4 1371 B11R1.27 O=C\C=C\C=C1/C=CC(=O)O1 Amb27852087 [0,2,0,0,0,0|0,0,0]=2 1372 B11R1.27 O=C\C=C\C=C1\C=CC(=O)O1 Amb27257892 [0,2,0,0,0,0|0,0,0]=2 1373 B11R1.39 C\C(=C/c1ccc(C)o1)CO Amb5494054 [0,2,0,0,0,0|0,0,2]=4 1374 B11R1.39 C\C(=C\c1ccc(Br)o1)CCl Amb28143924 [0,2,0,0,0,0|1,0,1]=4 1375 B11R1.39 C\C(=C\c1ccc(Br)o1)CN Amb27837315 [0,2,0,0,0,0|1,0,1]=4 1376 B11R1.39 C\C(=C\c1ccc(C)o1)CBr Amb27644264 [0,2,0,0,0,0|1,0,1]=4 1377 B11R1.39 C\C(=C\c1ccc(C)o1)CO Amb27752591 [0,2,0,0,0,0|0,0,2]=4 1378 B11R1.39 C\C(=C\c1ccc(Cl)o1)CBr Amb27169721 [0,2,0,0,0,0|1,0,1]=4 1379 B11R1.39 C\C(=C\c1ccc(Cl)o1)CN Amb28423983 [0,2,0,0,0,0|1,0,1]=4 1380 B11R1.39 C\C(=C\c1ccc(Cl)o1)CO Amb27494211 [0,2,0,0,0,0|0,0,2]=4 1381 B11R1.39 C\C(C=O)=C/c1cc(C)no1 Amb27808055 [0,2,0,0,0,0|1,0,0]=3 1382 B11R1.39 C\C(C=O)=C/c1cc(C)ns1 Amb35719816 [0,2,0,0,0,0|1,1,0]=4 1383 B11R1.39 C\C(C=O)=C/c1ccc(Br)s1 Amb32655890 [0,2,0,0,0,0|0,1,0]=3 1384 B11R1.39 C\C(C=O)=C/c1ccc(Cl)s1 Amb32655885 [0,2,0,0,0,0|0,1,0]=3 1385 B11R1.39 C\C(C=O)=C/c1cn(C)cn1 Amb27404773 [0,2,0,0,0,0|2,0,0]=4 1386 B11R1.39 C\C(C=O)=C/c1cnc(C)s1 Amb28251837 [0,2,0,0,0,0|1,1,0]=4 1387 B11R1.39 C\C(C=O)=C/c1coc(C)n1 Amb8384847 [0,2,0,0,0,0|2,0,0]=4 1388 B11R1.39 C\C(C=O)=C/c1csc(Br)c1 Amb28454438 [0,2,0,0,0,0|2,0,0]=4 1389 B11R1.39 C\C(C=O)=C/c1csc(C)c1 Amb28062026 [0,2,0,0,0,0|2,0,0]=4 1390 B11R1.39 C\C(C=O)=C\c1csc(C)n1 Amb27432576 [0,2,0,0,0,0|2,0,0]=4 1391 B11R1.39 C\C(C=O)=C\c1ncc(C)s1 Amb27475282 [0,2,0,0,0,0|1,1,0]=4 1392 B11R1.39 C\C(C=O)=C\c1ncc(I)s1 Amb28119379 [0,2,0,0,0,0|1,1,0]=4 1393 B11R1.39 Cc1nc(\C=C(\Cl)C=O)cs1 Amb27204788 [0,2,0,0,0,0|2,0,0]=4 1394 B11R1.75 CC(=O)CCc1cc(Br)co1 Amb33431947 [0,2,0,0,0,0|0,0,2]=4 1395 B11R1.75 CC(=O)CCc1ccc(Br)o1 Amb25358774 [0,2,0,0,0,0|0,0,2]=4 1396 B11R1.75 CC(=O)CCc1ccc(C)o1 Amb2794107 [0,2,0,0,0,0|0,0,2]=4 1397 B11R1.75 CC(=O)CCc1ccc(Cl)o1 Amb33258674 [0,2,0,0,0,0|0,0,2]=4 1398 B11R1.75 CC(=O)OCc1cc(C)co1 Amb28410173 [0,2,0,0,0,0|1,0,1]=4 1399 B11R1.75 CC(=O)OCc1ccc(Br)o1 Amb25868496 [0,2,0,0,0,0|1,0,1]=4 1400 B11R1.75 CC(=O)OCc1ccc(Cl)o1 Amb27868505 [0,2,0,0,0,0|1,0,1]=4 1401 B11R1.75 CC(=O)SCc1ccc(C)o1 Amb27794255 [0,2,0,0,0,0|1,0,1]=4 1402 B11R1.75 CC(=O)\C=C/C1=CC(=O)CC1 Amb28351395 [0,2,0,0,0,0|1,0,1]=4 1403 B11R1.75 CC(=O)\C=C\c1cc(Br)co1 Amb33431943 [0,2,0,0,0,0|0,0,0]=2 1404 B11R1.75 CC(=O)\C=C\c1cc(Br)cs1 Amb28322767 [0,2,0,0,0,0|0,1,0]=3 1405 B11R1.75 CC(=O)\C=C\c1cc(C)cs1 Amb33373479 [0,2,0,0,0,0|0,1,0]=3 1406 B11R1.75 CC(=O)\C=C\c1cc(C)no1 Amb26021563 [0,2,0,0,0,0|1,0,0]=3 1407 B11R1.75 CC(=O)\C=C\c1cc(C)ns1 Amb35720408 [0,2,0,0,0,0|1,1,0]=4 1408 B11R1.75 CC(=O)\C=C\c1cc(C)on1 Amb33315992 [0,2,0,0,0,0|2,0,0]=4 1409 B11R1.75 CC(=O)\C=C\c1cc(Cl)cs1 Amb33220768 [0,2,0,0,0,0|0,1,0]=3 1410 B11R1.75 CC(=O)\C=C\c1ccc(Br)o1 Amb33241034 [0,2,0,0,0,0|0,0,0]=2 1411 B11R1.75 CC(=O)\C=C\c1ccc(Br)s1 Amb33451169 [0,2,0,0,0,0|0,1,0]=3 1412 B11R1.75 CC(=O)\C=C\c1ccc(C)o1 Amb3484427 [0,2,0,0,0,0|0,0,0]=2 1413 B11R1.75 CC(=O)\C=C\c1ccc(C)s1 Amb33171945 [0,2,0,0,0,0|0,1,0]=3 1414 B11R1.75 CC(=O)\C=C\c1ccc(Cl)o1 Amb33052107 [0,2,0,0,0,0|0,0,0]=2 1415 B11R1.75 CC(=O)\C=C\c1ccc(Cl)s1 Amb33406786 [0,2,0,0,0,0|0,1,0]=3 1416 B11R1.75 CC(=O)\C=C\c1ccn(C)n1 Amb32726634 [0,2,0,0,0,0|2,0,0]=4 1417 B11R1.75 CC(=O)\C=C\c1cn(C)cn1 Amb33079480 [0,2,0,0,0,0|2,0,0]=4 1418 B11R1.75 CC(=O)\C=C\c1cnc(C)s1 Amb33358435 [0,2,0,0,0,0|1,1,0]=4 1419 B11R1.75 CC(=O)\C=C\c1cnc(Cl)s1 Amb33221355 [0,2,0,0,0,0|1,1,0]=4 1420 B11R1.75 CC(=O)\C=C\c1csc(Br)c1 Amb33451086 [0,2,0,0,0,0|2,0,0]=4 1421 B11R1.75 CC(=O)\C=C\c1csc(Br)n1 Amb33335508 [0,2,0,0,0,0|2,0,0]=4 1422 B11R1.75 CC(=O)\C=C\c1csc(C)n1 Amb33360384 [0,2,0,0,0,0|2,0,0]=4 1423 B11R1.75 CC(=O)\C=C\c1ncc(Br)s1 Amb33436103 [0,2,0,0,0,0|1,1,0]=4 1424 B11R1.75 CC(=O)\C=C\c1ncc(C)s1 Amb28244939 [0,2,0,0,0,0|1,1,0]=4 1425 B11R1.75 CC(Br)\C=C\c1ccc(Br)o1 Amb27589272 [0,2,0,0,0,0|1,0,1]=4 1426 B11R1.75 CC(Cl)\C=C\c1ccc(Cl)o1 Amb28454556 [0,2,0,0,0,0|1,0,1]=4 1427 B11R1.75 CC(N)\C=C\c1cc(Br)co1 Amb33431976 [0,2,0,0,0,0|1,0,1]=4 1428 B11R1.75 CC(N)\C=C\c1ccc(Br)o1 Amb33451031 [0,2,0,0,0,0|1,0,1]=4 1429 B11R1.75 CC(N)\C=C\c1ccc(Cl)o1 Amb33220562 [0,2,0,0,0,0|1,0,1]=4 1430 B11R1.75 CC(O)\C=C\c1ccc(Cl)o1 Amb28284821 [0,2,0,0,0,0|0,0,2]=4 1431 B11R1.75 CS(=O)\N=C\c1ccc(Br)o1 Amb35718872 [0,2,0,0,0,0|2,0,0]=4 1432 B11R1.75 CS(=O)\N=C\c1ccc(Cl)o1 Amb35718873 [0,2,0,0,0,0|2,0,0]=4 1433 B11R1.75 Cc1cc(\C=C/C(N)=O)on1 Amb28254231 [0,2,0,0,0,0|1,0,0]=3 1434 B11R1.75 Cc1cc(\C=C\C(=O)O)co1 Amb25893070 [0,2,0,0,0,0|2,0,0]=4 1435 B11R1.75 Cc1cc(\C=C\C(=O)O)cs1 Amb25300336 [0,2,0,0,0,0|2,0,0]=4 1436 B11R1.75 Cc1cc(\C=C\C(=O)O)no1 Amb18125519 [0,2,0,0,0,0|2,0,0]=4 1437 B11R1.75 Cc1cc(\C=C\C(=O)O)on1 Amb33079891 [0,2,0,0,0,0|1,0,0]=3 1438 B11R1.75 Cc1cc(\C=C\C(=O)O)sn1 Amb25975414 [0,2,0,0,0,0|1,1,0]=4 1439 B11R1.75 Cc1cc(\C=C\[N+](=O)[O-])on1 Amb33359055 [0,2,0,0,0,0|2,0,0]=4 1440 B11R1.75 Cc1ccc(C#CC(=O)O)o1 Amb25361971 [0,2,0,0,0,0|0,0,2]=4 1441 B11R1.75 Cc1ccc(CCC(=O)O)o1 Amb6336472 [0,2,0,0,0,0|0,0,2]=4 1442 B11R1.75 Cc1ccc(CCC(N)=O)o1 Amb4055592 [0,2,0,0,0,0|0,0,2]=4 1443 B11R1.75 Cc1ccc(CNC(=O)Cl)o1 Amb35625549 [0,2,0,0,0,0|1,0,1]=4 1444 B11R1.75 Cc1ccc(OCC(=O)O)o1 Amb33317586 [0,2,0,0,0,0|1,0,1]=4 1445 B11R1.75 Cc1ccc(SCC(N)=O)o1 Amb28385570 [0,2,0,0,0,0|1,0,1]=4 1446 B11R1.75 Cc1ccc(\C=C\C(=O)Cl)o1 Amb16230249 [0,2,0,0,0,0|0,0,0]=2 1447 B11R1.75 Cc1ccc(\C=C\C(=O)O)o1 Amb34915176 [0,2,0,0,0,0|0,0,0]=2 1448 B11R1.75 Cc1ccc(\C=C\C(=O)O)s1 Amb33714764 [0,2,0,0,0,0|0,1,0]=3 1449 B11R1.75 Cc1ccc(\C=C\C(=O)O)s1 Amb425405 [0,2,0,0,0,0|0,1,0]=3 1450 B11R1.75 Cc1ccc(\C=C\C(C)N)o1 Amb33429718 [0,2,0,0,0,0|1,0,1]=4 1451 B11R1.75 Cc1ccc(\C=C\C(N)=O)o1 Amb6514414 [0,2,0,0,0,0|0,0,0]=2 1452 B11R1.75 Cc1ccc(\C=C\[N+](=O)[O-])o1 Amb1878176 [0,2,0,0,0,0|1,0,0]=3 1453 B11R1.75 Cc1ccc(\C=C\[N+](=O)[O-])s1 Amb27589980 [0,2,0,0,0,0|1,1,0]=4 1454 B11R1.75 Cc1ccc(\C=N\S(C)=O)o1 Amb35681718 [0,2,0,0,0,0|2,0,0]=4 1455 B11R1.75 Cc1coc(\C=C\C(=O)O)c1 Amb25958503 [0,2,0,0,0,0|0,0,0]=2 1456 B11R1.75 Cc1coc(\C=C\C(=O)O)n1 Amb32941829 [0,2,0,0,0,0|1,0,0]=3 1457 B11R1.75 Cc1csc(\C=C\C(=O)O)c1 Amb33171868 [0,2,0,0,0,0|0,1,0]=3 1458 B11R1.75 Cc1csc(\C=C\C(=O)O)n1 Amb28458378 [0,2,0,0,0,0|1,1,0]=4 1459 B11R1.75 Cc1csc(\C=C\[N+](=O)[O-])c1 Amb33427130 [0,2,0,0,0,0|1,1,0]=4 1460 B11R1.75 Cc1nc(\C=C\C(=O)O)co1 Amb27632440 [0,2,0,0,0,0|2,0,0]=4 1461 B11R1.75 Cc1nc(\C=C\C(=O)O)cs1 Amb501605 [0,2,0,0,0,0|2,0,0]=4 1462 B11R1.75 Cc1nc(\C=C\C(N)=O)cs1 Amb8858724 [0,2,0,0,0,0|2,0,0]=4 1463 B11R1.75 Cc1ncc(\C=C\C(=O)O)s1 Amb18255512 [0,2,0,0,0,0|1,1,0]=4 1464 B11R1.75 Cc1nnc(\C=C\C(=O)O)o1 Amb18065407 [0,2,0,0,0,0|2,0,0]=4 1465 B11R1.75 Cn1ccc(\C=C\C(=O)O)c1 Amb33473125 [0,2,0,0,0,0|2,0,0]=4 1466 B11R1.75 Cn1ccc(\C=C\C(=O)O)n1 Amb33249590 [0,2,0,0,0,0|2,0,0]=4 1467 B11R1.75 Cn1cnc(\C=C/C(=O)O)c1 Amb28066706 [0,2,0,0,0,0|2,0,0]=4 1468 B11R1.75 Cn1cnc(\C=C\C(=O)O)c1 Amb18125373 [0,2,0,0,0,0|2,0,0]=4 1469 B11R1.75 Cn1cnc(\C=C\C(=O)O)c1 Amb34914982 [0,2,0,0,0,0|2,0,0]=4 1470 B11R1.75 NC(=O)NCc1ccc(Br)o1 Amb28125378 [0,2,0,0,0,0|1,0,1]=4 1471 B11R1.75 NC(=O)\C=C\c1cc(Br)cs1 Amb27255914 [0,2,0,0,0,0|0,1,0]=3 1472 B11R1.75 NC(=O)\C=C\c1ccc(Br)s1 Amb8997709 [0,2,0,0,0,0|0,1,0]=3 1473 B11R1.75 NC(=O)\C=C\c1cnc(Br)s1 Amb27843443 [0,2,0,0,0,0|1,1,0]=4 1474 B11R1.75 Nc1ncc(\C=C\C(=O)O)s1 Amb26505818 [0,2,0,0,0,0|1,1,0]=4 1475 B11R1.75 O=C(Cl)NCc1ccc(Br)o1 Amb35633454 [0,2,0,0,0,0|1,0,1]=4 1476 B11R1.75 O=C(Cl)NCc1ccc(Cl)o1 Amb35625508 [0,2,0,0,0,0|1,0,1]=4 1477 B11R1.75 O=C(Cl)\C=C\c1ccc(Cl)s1 Amb25149043 [0,2,0,0,0,0|0,1,0]=3 1478 B11R1.75 O=C(O)C#Cc1ccc(Br)o1 Amb27466662 [0,2,0,0,0,0|0,0,2]=4 1479 B11R1.75 O=C(O)CCc1cc(Br)co1 Amb33332934 [0,2,0,0,0,0|0,0,2]=4 1480 B11R1.75 O=C(O)CCc1ccc(Br)o1 Amb9175389 [0,2,0,0,0,0|0,0,2]=4 1481 B11R1.75 O=C(O)CCc1ccc(Cl)o1 Amb27235080 [0,2,0,0,0,0|0,0,2]=4 1482 B11R1.75 O=C(O)CCc1ccc(F)o1 Amb27428994 [0,2,0,0,0,0|0,0,2]=4 1483 B11R1.75 O=C(O)COc1cc(Br)co1 Amb33383653 [0,2,0,0,0,0|1,0,1]=4 1484 B11R1.75 O=C(O)COc1ccc(Br)o1 Amb33452237 [0,2,0,0,0,0|1,0,1]=4 1485 B11R1.75 O=C(O)COc1ccc(Cl)o1 Amb33259048 [0,2,0,0,0,0|1,0,1]=4 1486 B11R1.75 O=C(O)\C=C/c1cc(Br)cs1 Amb10069468 [0,2,0,0,0,0|0,1,0]=3 1487 B11R1.75 O=C(O)\C=C\C1=CNC(=S)N1 Amb24726371 [0,2,0,0,0,0|2,0,0]=4 1488 B11R1.75 O=C(O)\C=C\C1=NC(=O)CO1 Amb27231808 [0,2,0,0,0,0|1,0,1]=4 1489 B11R1.75 O=C(O)\C=C\c1cc(Br)co1 Amb33451300 [0,2,0,0,0,0|0,0,0]=2 1490 B11R1.75 O=C(O)\C=C\c1cc(Br)cs1 Amb7764677 [0,2,0,0,0,0|0,1,0]=3 1491 B11R1.75 O=C(O)\C=C\c1cc(Cl)cs1 Amb33052706 [0,2,0,0,0,0|0,1,0]=3 1492 B11R1.75 O=C(O)\C=C\c1cc(Cl)no1 Amb18127135 [0,2,0,0,0,0|1,0,0]=3 1493 B11R1.75 O=C(O)\C=C\c1ccc(Br)o1 Amb1102780 [0,2,0,0,0,0|0,0,0]=2 1494 B11R1.75 O=C(O)\C=C\c1ccc(Br)s1 Amb30296 [0,2,0,0,0,0|0,1,0]=3 1495 B11R1.75 O=C(O)\C=C\c1ccc(Cl)o1 Amb1107531 [0,2,0,0,0,0|0,0,0]=2 1496 B11R1.75 O=C(O)\C=C\c1ccc(Cl)s1 Amb501590 [0,2,0,0,0,0|0,1,0]=3 1497 B11R1.75 O=C(O)\C=C\c1ccc(F)o1 Amb26070880 [0,2,0,0,0,0|0,0,0]=2 1498 B11R1.75 O=C(O)\C=C\c1ccc(I)o1 Amb33578339 [0,2,0,0,0,0|0,0,0]=2 1499 B11R1.75 O=C(O)\C=C\c1cnc(Br)s1 Amb27794323 [0,2,0,0,0,0|1,1,0]=4 1500 B11R1.75 O=C(O)\C=C\c1cnc(Cl)s1 Amb26845257 [0,2,0,0,0,0|1,1,0]=4 1501 B11R1.75 O=C(O)\C=C\c1coc(Br)c1 Amb33470081 [0,2,0,0,0,0|2,0,0]=4 1502 B11R1.75 O=C(O)\C=C\c1csc(Br)c1 Amb34185909 [0,2,0,0,0,0|2,0,0]=4 1503 B11R1.75 O=C(O)\C=C\c1csc(Br)n1 Amb28130054 [0,2,0,0,0,0|2,0,0]=4 1504 B11R1.75 O=C(O)\C=C\c1csc(Cl)c1 Amb33051987 [0,2,0,0,0,0|2,0,0]=4 1505 B11R1.75 O=C(O)\C=C\c1csc(I)c1 Amb33470063 [0,2,0,0,0,0|2,0,0]=4 1506 B11R1.75 O=C(O)\C=C\c1ncc(Cl)s1 Amb27207876 [0,2,0,0,0,0|1,1,0]=4 1507 B11R1.75 O=[N+]([O-])\C=C\c1cc(Br)co1 Amb33431909 [0,2,0,0,0,0|1,0,0]=3 1508 B11R1.75 O=[N+]([O-])\C=C\c1cc(Br)cs1 Amb2725407 [0,2,0,0,0,0|1,1,0]=4 1509 B11R1.75 O=[N+]([O-])\C=C\c1cc(Cl)co1 Amb28059813 [0,2,0,0,0,0|1,0,0]=3 1510 B11R1.75 O=[N+]([O-])\C=C\c1cc(Cl)cs1 Amb33262415 [0,2,0,0,0,0|1,1,0]=4 1511 B11R1.75 O=[N+]([O-])\C=C\c1ccc(Br)o1 Amb20671638 [0,2,0,0,0,0|1,0,0]=3 1512 B11R1.75 O=[N+]([O-])\C=C\c1ccc(Cl)o1 Amb18180419 [0,2,0,0,0,0|1,0,0]=3 1513 B11R1.75 O=[N+]([O-])\C=C\c1ccc(Cl)s1 Amb2611498 [0,2,0,0,0,0|1,1,0]=4 1514 B11R1.212 CC1=CC\C(=C/CC=O)C1=O Amb27439981 [0,2,0,0,0,0|1,0,1]=4 1515 B11R1.212 Cc1csc(\C=C\C=O)c1Br Amb33434269 [0,2,0,0,0,0|0,1,0]=3 1516 B11R1.212 Cc1ncc(\C=C\C=O)n1C Amb35652861 [0,2,0,0,0,0|2,0,0]=4 1517 B11R1.214 CCc1ccc(\C=C\CO)o1 Amb27245983 [0,2,0,0,0,0|0,0,2]=4 1518 B11R1.214 CCn1ccc(\C=C\C=O)c1 Amb27951892 [0,2,0,0,0,0|2,0,0]=4 1519 B11R1.214 CCn1ccc(\C=C\C=O)n1 Amb33147556 [0,2,0,0,0,0|2,0,0]=4 1520 B11R1.214 COc1cc(\C=C\C=O)on1 Amb32727388 [0,2,0,0,0,0|1,0,0]=3 1521 B11R1.214 COc1cc(\C=C\C=O)sn1 Amb27435713 [0,2,0,0,0,0|1,1,0]=4 1522 B11R1.214 COc1ncc(\C=C\C=O)s1 Amb33474173 [0,2,0,0,0,0|1,1,0]=4 1523 B11R1.214 N#Cc1ccc(\C=C\C=O)s1 Amb32953499 [0,2,0,0,0,0|0,1,0]=3 1524 B11R1.214 N#Cc1csc(\C=C\C=O)c1 Amb33149219 [0,2,0,0,0,0|0,1,0]=3 1525 B11R1.214 O=C\C=C\c1ccc(C=O)o1 Amb25724026 [0,2,0,0,0,0|0,0,0]=2 1526 B11R1.214 O=C\C=C\c1ccc(C=O)s1 Amb27176436 [0,2,0,0,0,0|0,1,0]=3 1527 B11R1.230 Cc1cc(Br)c(\C=C\C=O)s1 Amb33434351 [0,2,0,0,0,0|0,1,0]=3 1528 B11R1.230 Cc1cc(Br)oc1CCC=O Amb33387183 [0,2,0,0,0,0|0,0,2]=4 1529 B11R1.230 Cc1cc(Br)oc1\C=C\C=O Amb33387150 [0,2,0,0,0,0|0,0,0]=2 1530 B11R1.230 Cc1cc(Br)oc1\C=C\CN Amb33450825 [0,2,0,0,0,0|1,0,1]=4 1531 B11R1.230 Cc1cc(Br)oc1\C=C\CO Amb33450823 [0,2,0,0,0,0|0,0,2]=4 1532 B11R1.230 Cc1cc(\C=C\C=O)c(C)o1 Amb33292849 [0,2,0,0,0,0|2,0,0]=4 1533 B11R1.230 Cc1cc(\C=C\C=O)c(C)s1 Amb27464939 [0,2,0,0,0,0|2,0,0]=4 1534 B11R1.230 Cc1cc(\C=C\C=O)n(C)n1 Amb33418170 [0,2,0,0,0,0|2,0,0]=4 1535 B11R1.230 Cc1cn(C)nc1\C=C\C=O Amb32724793 [0,2,0,0,0,0|2,0,0]=4 1536 B11R1.230 Cn1nc(Br)cc1\C=C\C=O Amb35672822 [0,2,0,0,0,0|2,0,0]=4 1537 B11R1.230 O=C\C=C\C1=CC(=O)OC1O Amb28457571 [0,2,0,0,0,0|2,0,0]=4 1538 B11R1.231 Cc1cc(\C=C\C=O)nn1C Amb33143998 [0,2,0,0,0,0|2,0,0]=4 1539 B11R1.231 Cc1nc(\C=C\C=O)oc1C Amb33267201 [0,2,0,0,0,0|1,0,0]=3 1540 B11R1.231 Cc1sc(\C=C\C=O)cc1Br Amb33451371 [0,2,0,0,0,0|0,1,0]=3 1541 B11R1.231 N#C\C=C\c1cc(Br)c(Br)o1 Amb27400963 [0,2,0,0,0,0|1,0,1]=4 1542 B11R1.231 NC\C=C\c1cc(Br)c(Br)o1 Amb27823086 [0,2,0,0,0,0|1,0,1]=4 1543 B11R1.231 O=CCCc1cc(Br)c(Br)o1 Amb33435829 [0,2,0,0,0,0|0,0,2]=4 1544 B11R1.231 O=C\C=C\c1cc(Br)c(Br)o1 Amb28320939 [0,2,0,0,0,0|0,0,0]=2 1545 B11R1.231 O=C\C=C\c1cc(Br)c(Cl)s1 Amb33451175 [0,2,0,0,0,0|0,1,0]=3 1546 B11R1.231 OC\C=C\c1cc(Br)c(Br)o1 Amb33240383 [0,2,0,0,0,0|0,0,2]=4 1547 B11R1.4 BrCCC\C=C/c1ccco1 Amb27673526 [0,2,0,0,0,0|1,0,1]=4 1548 B11R1.4 BrCCC\C=C\c1ccco1 Amb27672061 [0,2,0,0,0,0|1,0,1]=4 1549 B11R1.4 C=CCN\N=C\c1ccco1 Amb27270344 [0,2,0,0,0,0|1,0,1]=4 1550 B11R1.4 CCNC\C=C\c1ccco1 Amb27271367 [0,2,0,0,0,0|1,0,1]=4 1551 B11R1.4 CNCC\C=C\c1ccco1 Amb27987208 [0,2,0,0,0,0|1,0,1]=4 1552 B11R1.4 CN\N=C\C=C\c1ccco1 Amb27836578 [0,2,0,0,0,0|1,0,0]=3 1553 B11R1.4 C\C=C\CNCc1ccco1 Amb17872669 [0,2,0,0,0,0|1,0,1]=4 1554 B11R1.4 Cl\C=C\CNCc1ccco1 Amb27492451 [0,2,0,0,0,0|1,0,1]=4 1555 B11R1.4 O=CCC\C=C\c1ccco1 Amb24766684 [0,2,0,0,0,0|0,0,0]=2 1556 B11R1.4 O=C\C=C\C#Cc1cccs1 Amb27184115 [0,2,0,0,0,0|0,1,0]=3 1557 B11R1.4 O=C\C=C\C=C\c1ccco1 Amb17593685 [0,2,0,0,0,0|0,0,0]=2 1558 B11R1.4 O=C\C=C\C=C\c1ccno1 Amb27966652 [0,2,0,0,0,0|1,0,0]=3 1559 B11R1.4 O=C\C=C\C=C\c1ccsc1 Amb27880699 [0,2,0,0,0,0|2,0,0]=4 1560 B11R1.4 O=C\C=C\CCc1ccsc1 Amb33321201 [0,2,0,0,0,0|2,0,0]=4 1561 B11R1.4 O=C\C=C\CCn1cccn1 Amb32726903 [0,2,0,0,0,0|2,0,0]=4 1562 B11R1.25 C=CC(=O)CCc1ccco1 Amb27988543 [0,2,0,0,0,0|0,0,2]=4 1563 B11R1.25 CC(C=O)CCc1ccco1 Amb28080204 [0,2,0,0,0,0|0,0,2]=4 1564 B11R1.25 CC(\C=C\c1ccco1)=N/O Amb32662875 [0,2,0,0,0,0|0,0,1]=3 1565 B11R1.25 CC(\C=C\c1ccco1)CO Amb28281798 [0,2,0,0,0,0|0,0,2]=4 1566 B11R1.25 CCC(=O)CCc1ccco1 Amb18177203 [0,2,0,0,0,0|0,0,2]=4 1567 B11R1.25 CCC(=O)NCc1ccco1 Amb3097296 [0,2,0,0,0,0|1,0,1]=4 1568 B11R1.25 CCC(=O)SCc1ccco1 Amb9786684 [0,2,0,0,0,0|1,0,1]=4 1569 B11R1.25 CCC(=O)\C=C\c1ccco1 Amb25233726 [0,2,0,0,0,0|0,0,0]=2 1570 B11R1.25 CCS(=O)\N=C\c1ccco1 Amb35726565 [0,2,0,0,0,0|2,0,0]=4 1571 B11R1.25 CNC(=O)CCc1ccco1 Amb8328018 [0,2,0,0,0,0|0,0,2]=4 1572 B11R1.25 COC(=N)\C=C\c1ccco1 Amb27201924 [0,2,0,0,0,0|0,0,1]=3 1573 B11R1.25 COC(=O)C#Cc1ccco1 Amb27855944 [0,2,0,0,0,0|0,0,2]=4 1574 B11R1.25 COC(=O)NCc1ccco1 Amb3363702 [0,2,0,0,0,0|1,0,1]=4 1575 B11R1.25 COC(=O)\C=C\c1ccco1 Amb26473604 [0,2,0,0,0,0|0,0,0]=2 1576 B11R1.25 COC(=O)\C=C\c1cccs1 Amb2724557 [0,2,0,0,0,0|0,1,0]=3 1577 B11R1.25 COC(=O)\C=C\c1cccs1 Amb33714728 [0,2,0,0,0,0|0,1,0]=3 1578 B11R1.25 COC(=O)\C=C\c1ccno1 Amb27782507 [0,2,0,0,0,0|1,0,0]=3 1579 B11R1.25 COC(=O)\C=C\c1ccns1 Amb30013692 [0,2,0,0,0,0|1,1,0]=4 1580 B11R1.25 COC(=O)\C=C\c1ccsc1 Amb8630327 [0,2,0,0,0,0|2,0,0]=4 1581 B11R1.25 COC(=O)\C=C\c1cncs1 Amb25909810 [0,2,0,0,0,0|1,1,0]=4 1582 B11R1.25 COC(=O)\C=C\c1cocn1 Amb25208802 [0,2,0,0,0,0|2,0,0]=4 1583 B11R1.25 COC(=O)\C=C\c1cscn1 Amb24409150 [0,2,0,0,0,0|2,0,0]=4 1584 B11R1.25 COC(=O)\C=C\c1ncco1 Amb27398431 [0,2,0,0,0,0|1,0,0]=3 1585 B11R1.25 COC(=O)\C=C\c1nccs1 Amb25758463 [0,2,0,0,0,0|1,1,0]=4 1586 B11R1.25 C[C@@H](C=O)\C=C\c1ccco1 Amb27854650 [0,2,0,0,0,0|0,0,0]=2 1587 B11R1.25 N#CC(=O)\C=C\c1ccco1 Amb26627118 [0,2,0,0,0,0|0,0,0]=2 1588 B11R1.25 N#CC(=O)\C=C\c1cccs1 Amb24372667 [0,2,0,0,0,0|0,1,0]=3 1589 B11R1.25 N=C(\C=C\c1ccno1)NO Amb26053488 [0,2,0,0,0,0|1,0,1]=4 1590 B11R1.25 NCC(=O)NCc1ccco1 Amb10609039 [0,2,0,0,0,0|1,0,1]=4 1591 B11R1.25 NCC(=O)NCc1ccco1 Amb444976 [0,2,0,0,0,0|1,0,1]=4 1592 B11R1.25 NNC(=O)CCc1ccco1 Amb6744507 [0,2,0,0,0,0|0,0,2]=4 1593 B11R1.25 NNC(=O)NCc1ccco1 Amb33552055 [0,2,0,0,0,0|1,0,1]=4 1594 B11R1.25 NNC(=O)\C=C\c1ccco1 Amb27211757 [0,2,0,0,0,0|0,0,0]=2 1595 B11R1.25 NNC(=O)\C=C\c1nccs1 Amb28043750 [0,2,0,0,0,0|1,1,0]=4 1596 B11R1.25 O=C(CBr)NCc1ccco1 Amb2221075 [0,2,0,0,0,0|1,0,1]=4 1597 B11R1.25 O=C(CCl)CCc1ccco1 Amb27672907 [0,2,0,0,0,0|0,0,2]=4 1598 B11R1.25 O=C(CCl)NCc1ccco1 Amb6334831 [0,2,0,0,0,0|1,0,1]=4 1599 B11R1.25 O=C(CI)NCc1ccco1 Amb26943751 [0,2,0,0,0,0|1,0,1]=4 1600 B11R1.25 O=C(CO)CCc1ccco1 Amb18065408 [0,2,0,0,0,0|0,0,2]=4 1601 B11R1.25 O=C(CO)NCc1ccco1 Amb5798115 [0,2,0,0,0,0|1,0,1]=4 1602 B11R1.25 O=C(CO)OCc1ccco1 Amb27988703 [0,2,0,0,0,0|1,0,1]=4 1603 B11R1.25 O=C(\C=C\c1ccco1)CCl Amb26476618 [0,2,0,0,0,0|0,0,0]=2 1604 B11R1.25 O=C(\C=C\c1cccs1)CCl Amb28347537 [0,2,0,0,0,0|0,1,0]=3 1605 B11R1.25 O=C(\C=C\c1cccs1)NO Amb27479337 [0,2,0,0,0,0|0,1,0]=3 1606 B11R1.25 O=C(\C=C\c1nccs1)NO Amb28078450 [0,2,0,0,0,0|1,1,0]=4 1607 B11R1.25 O=CC(=O)\C=C\c1ccco1 Amb26331989 [0,2,0,0,0,0|0,0,0]=2 1608 B11R1.30 C#CC\C(C)=C\c1ccco1 Amb33311314 [0,2,0,0,0,0|1,0,1]=4 1609 B11R1.30 CNC\C(C)=C\c1ccco1 Amb27241573 [0,2,0,0,0,0|1,0,1]=4 1610 B11R1.30 C\C(=C/c1ccco1)CC#N Amb27839918 [0,2,0,0,0,0|1,0,1]=4 1611 B11R1.30 C\C(=C/c1ccco1)CC=O Amb33311310 [0,2,0,0,0,0|0,0,0]=2 1612 B11R1.30 C\C(=C/c1ccco1)CCBr Amb33333144 [0,2,0,0,0,0|1,0,1]=4 1613 B11R1.30 C\C(=C/c1ccco1)CCN Amb33429464 [0,2,0,0,0,0|1,0,1]=4 1614 B11R1.30 C\C(=C/c1ccco1)CCO Amb33311632 [0,2,0,0,0,0|0,0,2]=4 1615 B11R1.30 C\C(=C/c1ccco1)CCS Amb33197524 [0,2,0,0,0,0|0,1,1]=4 1616 B11R1.30 C\C(=C/c1ccco1)CNN Amb33311596 [0,2,0,0,0,0|1,0,1]=4 1617 B11R1.30 C\C(=C/c1ccco1)CNO Amb33311991 [0,2,0,0,0,0|0,0,2]=4 1618 B11R1.30 C\C(=C/c1ccco1)CON Amb33311594 [0,2,0,0,0,0|0,0,2]=4 1619 B11R1.30 C\C(=C\CN)Cc1ccco1 Amb27984481 [0,2,0,0,0,0|1,0,1]=4 1620 B11R1.30 C\C=C\C(=O)Cc1cccs1 Amb27640841 [0,2,0,0,0,0|1,1,0]=4 1621 B11R1.30 O=C(\C=C\Cl)Cc1cccs1 Amb35645318 [0,2,0,0,0,0|1,1,0]=4 1622 B11R1.30 [C-]#[N+]C\C(C)=C\c1ccco1 Amb33311616 [0,2,0,0,0,0|1,0,1]=4 1623 B11R1.172 CC(=O)C=C=Cc1ccco1 Amb24689517 [0,2,0,0,0,0|0,0,0]=2 1624 B11R1.172 CC(=O)CCCc1ccco1 Amb17232099 [0,2,0,0,0,0|0,0,2]=4 1625 B11R1.172 CC(=O)CCSc1ccco1 Amb27672627 [0,2,0,0,0,0|0,0,2]=4 1626 B11R1.172 CC(=O)CSCc1ccco1 Amb6357577 [0,2,0,0,0,0|0,0,2]=4 1627 B11R1.172 CC(=O)NCCc1ccco1 Amb8336373 [0,2,0,0,0,0|0,0,2]=4 1628 B11R1.172 CC(=O)N\C=C\c1ccco1 Amb28143852 [0,2,0,0,0,0|0,0,0]=2 1629 B11R1.172 CC(=O)N\N=C\c1ccco1 Amb6883602 [0,2,0,0,0,0|1,0,0]=3 1630 B11R1.172 CC(=O)N\N=C\c1cccs1 Amb3359974 [0,2,0,0,0,0|1,1,0]=4 1631 B11R1.172 CC(=O)OCCc1ccco1 Amb27272289 [0,2,0,0,0,0|0,0,2]=4 1632 B11R1.172 CC(C)=CCCc1ccco1 Amb35709490 [0,2,0,0,0,0|1,0,1]=4 1633 B11R1.172 N=C(N)N\N=C\c1ccco1 Amb1032313 [0,2,0,0,0,0|2,0,0]=4 1634 B11R1.172 N=C(S)N\N=C\c1ccco1 Amb4270363 [0,2,0,0,0,0|1,1,0]=4 1635 B11R1.172 NC(=O)CNCc1ccco1 Amb1131866 [0,2,0,0,0,0|0,0,2]=4 1636 B11R1.172 NC(=O)N\N=C/c1cccs1 Amb30622475 [0,2,0,0,0,0|1,1,0]=4 1637 B11R1.172 NC(=O)N\N=C\c1ccco1 Amb27399961 [0,2,0,0,0,0|1,0,0]=3 1638 B11R1.172 NC(=S)N\N=C\c1ccco1 Amb6739781 [0,2,0,0,0,0|1,1,0]=4 1639 B11R1.172 O=C(Cl)NCCc1ccco1 Amb35625501 [0,2,0,0,0,0|0,0,2]=4 1640 B11R1.172 O=C(O)CC#Cc1ccco1 Amb25229145 [0,2,0,0,0,0|0,0,2]=4 1641 B11R1.172 O=C(O)CCCc1ccco1 Amb18125675 [0,2,0,0,0,0|0,0,2]=4 1642 B11R1.172 O=C(O)CNCc1ccco1 Amb2592332 [0,2,0,0,0,0|0,0,2]=4 1643 B11R1.172 O=C(O)CSCc1ccco1 Amb2721897 [0,2,0,0,0,0|0,0,2]=4 1644 B11R1.172 O=C(O)C\C=C\c1cccs1 Amb18563846 [0,2,0,0,0,0|0,1,0]=3 1645 B11R1.172 O=C(O)C\C=C\c1ccns1 Amb26570699 [0,2,0,0,0,0|1,1,0]=4 1646 B11R1.172 O=C(O)C\N=C\c1cccs1 Amb27983815 [0,2,0,0,0,0|0,1,1]=4 1647 B11R1.172 O=C(O)\C=C\Cc1ccco1 Amb25060755 [0,2,0,0,0,0|0,0,0]=2 1648 B11R1.172 O=C(O)\C=C\Cc1cccs1 Amb25989107 [0,2,0,0,0,0|0,1,0]=3 1649 B11R1.172 O=C(O)\C=C\Cc1ccsc1 Amb33470057 [0,2,0,0,0,0|2,0,0]=4 1650 B11R1.172 O=C(O)\C=C\Nc1nccs1 Amb2525886 [0,2,0,0,0,0|1,1,0]=4 1651 B11R1.172 O=C([O-])COCc1ccco1 Amb10610157 [0,2,0,0,0,0|0,0,2]=4 1652 B11R1.180 Cc1ccoc1CCCC=O Amb33343118 [0,2,0,0,0,0|0,0,2]=4 1653 B11R1.180 Cc1ccoc1CSCC=O Amb32987861 [0,2,0,0,0,0|0,0,2]=4 1654 B11R1.35 C=C(Cc1ccco1)C(=O)O Amb27985009 [0,2,0,0,0,0|0,0,1]=3 1655 B11R1.35 CC(=O)C(=O)Cc1ccco1 Amb25177671 [0,2,0,0,0,0|0,0,1]=3 1656 B11R1.35 CC(=O)C(=O)Cc1cccs1 Amb24456858 [0,2,0,0,0,0|0,1,1]=4 1657 B11R1.35 CC(=O)C(C)Cc1ccco1 Amb17939894 [0,2,0,0,0,0|0,0,2]=4 1658 B11R1.35 CC(=O)N(C)Cc1ccco1 Amb8336371 [0,2,0,0,0,0|1,0,1]=4 1659 B11R1.35 CC(=O)\C(C)=C\c1ccco1 Amb33079023 [0,2,0,0,0,0|0,0,0]=2 1660 B11R1.35 CC(=O)\C(C)=C\c1ccns1 Amb35720407 [0,2,0,0,0,0|1,1,0]=4 1661 B11R1.35 CC(=O)\C(C)=C\c1ccoc1 Amb27985419 [0,2,0,0,0,0|2,0,0]=4 1662 B11R1.35 CC(=O)\C(C)=C\c1ccsc1 Amb24434611 [0,2,0,0,0,0|2,0,0]=4 1663 B11R1.35 CC(Cc1ccco1)C(=O)O Amb33540750 [0,2,0,0,0,0|0,0,2]=4 1664 B11R1.35 CN(Cc1ccco1)C(=O)Cl Amb33296643 [0,2,0,0,0,0|1,0,1]=4 1665 B11R1.35 CS(=O)\C(Cl)=C\c1cccs1 Amb24309139 [0,2,0,0,0,0|1,1,0]=4 1666 B11R1.35 C\C(=C/c1ccco1)C(=N)N Amb32953924 [0,2,0,0,0,0|1,0,0]=3 1667 B11R1.35 C\C(=C/c1ccco1)C(=O)O Amb5743924 [0,2,0,0,0,0|0,0,0]=2 1668 B11R1.35 C\C(=C/c1ccco1)C(C)N Amb33449110 [0,2,0,0,0,0|1,0,1]=4 1669 B11R1.35 C\C(=C/c1ccco1)C(N)=O Amb27231811 [0,2,0,0,0,0|0,0,0]=2 1670 B11R1.35 C\C(=C/c1ccco1)C(N)=S Amb33197985 [0,2,0,0,0,0|0,1,0]=3 1671 B11R1.35 C\C(=C/c1ccco1)[C@@H](C)N Amb33311660 [0,2,0,0,0,0|1,0,1]=4 1672 B11R1.35 C\C(=C/c1ccco1)[C@@H](C)O Amb33311658 [0,2,0,0,0,0|0,0,2]=4 1673 B11R1.35 C\C(=C/c1ccco1)[C@H](C)N Amb33311600 [0,2,0,0,0,0|1,0,1]=4 1674 B11R1.35 C\C(=C/c1ccco1)[C@H](C)O Amb33474941 [0,2,0,0,0,0|0,0,2]=4 1675 B11R1.35 C\C(=C/c1ccco1)[N+](=O)[O-] Amb31267735 [0,2,0,0,0,0|1,0,0]=3 1676 B11R1.35 C\C(=C/c1cccs1)C(=O)O Amb5743925 [0,2,0,0,0,0|0,1,0]=3 1677 B11R1.35 C\C(=C/c1cccs1)[N+](=O)[O-] Amb2609400 [0,2,0,0,0,0|1,1,0]=4 1678 B11R1.35 C\C(=C/c1ccns1)C(=O)O Amb30013782 [0,2,0,0,0,0|1,1,0]=4 1679 B11R1.35 C\C(=C/c1ccoc1)C(=O)O Amb27975673 [0,2,0,0,0,0|2,0,0]=4 1680 B11R1.35 C\C(=C/c1cncs1)C(=O)O Amb27803283 [0,2,0,0,0,0|1,1,0]=4 1681 B11R1.35 C\C(=C/c1cscn1)C(=O)O Amb27453159 [0,2,0,0,0,0|2,0,0]=4 1682 B11R1.35 C\C(=C\c1ccco1)C(=N)N Amb27789869 [0,2,0,0,0,0|1,0,0]=3 1683 B11R1.35 C\C(=C\c1ccco1)C(=O)O Amb4010273 [0,2,0,0,0,0|0,0,0]=2 1684 B11R1.35 C\C(=C\c1ccco1)[N+](=O)[O-] Amb6374135 [0,2,0,0,0,0|1,0,0]=3 1685 B11R1.35 C\C(=C\c1cccs1)C(=O)Cl Amb27952877 [0,2,0,0,0,0|0,1,0]=3 1686 B11R1.35 C\C(=C\c1cccs1)[N+](=O)[O-] Amb26359545 [0,2,0,0,0,0|1,1,0]=4 1687 B11R1.35 C\C(=C\c1ccsc1)C(=O)O Amb28069074 [0,2,0,0,0,0|2,0,0]=4 1688 B11R1.35 C\C(=C\c1nccs1)C(=O)O Amb27250230 [0,2,0,0,0,0|1,1,0]=4 1689 B11R1.35 NC(=O)C(N)Cc1ccco1 Amb33066014 [0,2,0,0,0,0|0,0,2]=4 1690 B11R1.35 NC(Cc1ccco1)C(=O)O Amb9724188 [0,2,0,0,0,0|0,0,2]=4 1691 B11R1.35 N[C@@H](Cc1ccco1)C(=O)O Amb10068214 [0,2,0,0,0,0|0,0,2]=4 1692 B11R1.35 N[C@@H](Cc1ccco1)C(=O)O Amb31291682 [0,2,0,0,0,0|0,0,2]=4 1693 B11R1.35 N[C@H](Cc1ccco1)C(=O)O Amb10068215 [0,2,0,0,0,0|0,0,2]=4 1694 B11R1.35 N\C(=C/c1ccns1)C(=O)O Amb27883195 [0,2,0,0,0,0|1,1,0]=4 1695 B11R1.35 N\C(=C/c1cncs1)C(=O)O Amb35608674 [0,2,0,0,0,0|1,1,0]=4 1696 B11R1.35 N\C(=C\c1ccco1)C(=O)O Amb27493744 [0,2,0,0,0,0|0,0,0]=2 1697 B11R1.35 O=C(Cc1ccco1)C(O)=S Amb25871308 [0,2,0,0,0,0|0,0,2]=4 1698 B11R1.35 O=C(O)C(=O)Cc1ccco1 Amb1137668 [0,2,0,0,0,0|0,0,1]=3 1699 B11R1.35 O=C(O)C(=O)Cc1cccs1 Amb1135982 [0,2,0,0,0,0|0,1,1]=4 1700 B11R1.35 O=C(O)C(=O)Cc1cnco1 Amb33415275 [0,2,0,0,0,0|1,0,1]=4 1701 B11R1.35 O=C(O)C(=O)Nc1cccs1 Amb27450757 [0,2,0,0,0,0|1,1,0]=4 1702 B11R1.35 O=C(O)C(=S)Cc1ccco1 Amb4026925 [0,2,0,0,0,0|0,0,1]=3 1703 B11R1.35 O=C(O)C(O)Cc1ccco1 Amb17138461 [0,2,0,0,0,0|0,0,2]=4 1704 B11R1.35 O=C(O)\C(F)=C\c1cccs1 Amb27470240 [0,2,0,0,0,0|0,1,0]=3 1705 B11R1.35 O=C(O)\C(F)=C\c1ccns1 Amb30013797 [0,2,0,0,0,0|1,1,0]=4 1706 B11R1.35 O=C([O-])C(=O)Cc1cccs1 Amb33512939 [0,2,0,0,0,0|0,1,1]=4 1707 B11R1.84 CCN(C=O)Cc1ccco1 Amb27986964 [0,2,0,0,0,0|1,0,1]=4 1708 B11R1.84 CC\C(=C\c1ccco1)CBr Amb27949870 [0,2,0,0,0,0|1,0,1]=4 1709 B11R1.84 CC\C(C=O)=C/c1ccco1 Amb17334296 [0,2,0,0,0,0|0,0,0]=2 1710 B11R1.84 CC\C(C=O)=C/c1cccs1 Amb17334687 [0,2,0,0,0,0|0,1,0]=3 1711 B11R1.84 CC\C(C=O)=C/c1ccns1 Amb35719813 [0,2,0,0,0,0|1,1,0]=4 1712 B11R1.84 CC\C(C=O)=C/c1ccsc1 Amb32656159 [0,2,0,0,0,0|2,0,0]=4 1713 B11R1.84 CC\C(C=O)=C/c1cscn1 Amb27170549 [0,2,0,0,0,0|2,0,0]=4 1714 B11R1.84 CC\C(C=O)=C\c1ccoc1 Amb28320938 [0,2,0,0,0,0|2,0,0]=4 1715 B11R1.84 N#CC(C#N)=Cc1ccco1 Amb6358155 [0,2,0,0,0,0|1,0,1]=4 1716 B11R1.84 N#C\C(=C/c1ccco1)CCl Amb28040900 [0,2,0,0,0,0|1,0,1]=4 1717 B11R1.84 N#C\C(C=O)=C/c1ccco1 Amb3429788 [0,2,0,0,0,0|0,0,0]=2 1718 B11R1.84 N#C\C(C=O)=C/c1cccs1 Amb22339606 [0,2,0,0,0,0|0,1,0]=3 1719 B11R1.84 O=CC(C=O)=Cc1cccs1 Amb18126436 [0,2,0,0,0,0|0,1,0]=3 1720 B11R1.136 CC(C)(C=O)Cc1ccco1 Amb25277015 [0,2,0,0,0,0|0,0,2]=4 1721 B11R1.228 C=CC(=O)Oc1occc1C Amb27468728 [0,2,0,0,0,0|2,0,0]=4 1722 B11R1.228 C\C(=C\c1occc1C)CO Amb27823475 [0,2,0,0,0,0|0,0,2]=4 1723 B11R1.228 C\C(C=O)=C/c1cncn1C Amb27208832 [0,2,0,0,0,0|2,0,0]=4 1724 B11R1.228 C\C(C=O)=C\c1ccoc1C Amb27666282 [0,2,0,0,0,0|2,0,0]=4 1725 B11R1.228 C\C(C=O)=C\c1ccsc1C Amb28347813 [0,2,0,0,0,0|2,0,0]=4 1726 B11R1.228 C\C(C=O)=C\c1ccsc1Cl Amb27472447 [0,2,0,0,0,0|2,0,0]=4 1727 B11R1.228 C\C(C=O)=C\c1cscc1Br Amb27768352 [0,2,0,0,0,0|2,0,0]=4 1728 B11R1.228 C\C(C=O)=C\c1occc1Br Amb27594912 [0,2,0,0,0,0|0,0,0]=2 1729 B11R1.228 C\C(C=O)=C\c1sccc1C Amb27647200 [0,2,0,0,0,0|0,1,0]=3 1730 B11R1.18 CCc1ccsc1\C=C\C=O Amb32729066 [0,2,0,0,0,0|0,1,0]=3 1731 B11R1.18 CCn1ccnc1\C=C\C=O Amb27184913 [0,2,0,0,0,0|2,0,0]=4 1732 B11R1.18 CCn1cncc1\C=C\C=O Amb33473934 [0,2,0,0,0,0|2,0,0]=4 1733 B11R1.18 CCn1nccc1\C=C\C=O Amb27831082 [0,2,0,0,0,0|2,0,0]=4 1734 B11R1.18 O=CC1=CC=C\C1=C/C=C/O Amb28457480 [0,2,0,0,0,0|1,0,1]=4 1735 B11R1.18 O=CC1=CC=C\C1=C\C=C\O Amb27830141 [0,2,0,0,0,0|1,0,1]=4 1736 B11R1.90 CC(=O)CCc1occc1C Amb26853347 [0,2,0,0,0,0|0,0,2]=4 1737 B11R1.90 CC(=O)OCc1occc1C Amb27272698 [0,2,0,0,0,0|1,0,1]=4 1738 B11R1.90 CC(=O)\C=C\c1cccn1C Amb33079842 [0,2,0,0,0,0|1,0,0]=3 1739 B11R1.90 CC(=O)\C=C\c1ccnn1C Amb25326986 [0,2,0,0,0,0|2,0,0]=4 1740 B11R1.90 CC(=O)\C=C\c1ccoc1C Amb33445886 [0,2,0,0,0,0|2,0,0]=4 1741 B11R1.90 CC(=O)\C=C\c1cncn1C Amb33359224 [0,2,0,0,0,0|2,0,0]=4 1742 B11R1.90 CC(=O)\C=C\c1cscc1C Amb33145217 [0,2,0,0,0,0|2,0,0]=4 1743 B11R1.90 CC(=O)\C=C\c1nccn1C Amb33360388 [0,2,0,0,0,0|2,0,0]=4 1744 B11R1.90 CC(=O)\C=C\c1occc1C Amb33358518 [0,2,0,0,0,0|0,0,0]=2 1745 B11R1.90 CC(=O)\C=C\c1sccc1Br Amb27176258 [0,2,0,0,0,0|0,1,0]=3 1746 B11R1.90 CC(=O)\C=C\c1sccc1C Amb33448507 [0,2,0,0,0,0|0,1,0]=3 1747 B11R1.90 CC(=O)\C=C\c1sccc1Cl Amb33259263 [0,2,0,0,0,0|0,1,0]=3 1748 B11R1.90 CC(=O)\C=C\c1scnc1C Amb33172563 [0,2,0,0,0,0|1,1,0]=4 1749 B11R1.90 CC(C)=C\C=C1/SC=CC1=O Amb5719927 [0,2,0,0,0,0|1,1,0]=4 1750 B11R1.90 CC(N)\C=C\c1occc1Br Amb28070225 [0,2,0,0,0,0|1,0,1]=4 1751 B11R1.90 CS(=O)\N=C\c1occc1Br Amb29865962 [0,2,0,0,0,0|2,0,0]=4 1752 B11R1.90 Cc1ccoc1CCC(=O)O Amb18200842 [0,2,0,0,0,0|0,0,2]=4 1753 B11R1.90 Cc1ccoc1CNC(=O)Cl Amb35625874 [0,2,0,0,0,0|1,0,1]=4 1754 B11R1.90 Cc1ccoc1OCC(=O)O Amb33342797 [0,2,0,0,0,0|1,0,1]=4 1755 B11R1.90 Cc1ccoc1\C=C\C(=O)O Amb28456772 [0,2,0,0,0,0|0,0,0]=2 1756 B11R1.90 Cc1ccoc1\C=C\C(C)N Amb33359753 [0,2,0,0,0,0|1,0,1]=4 1757 B11R1.90 Cc1ccoc1\C=C\C(C)O Amb28284828 [0,2,0,0,0,0|0,0,2]=4 1758 B11R1.90 Cc1ccoc1\C=C\[N+](=O)[O-] Amb33079958 [0,2,0,0,0,0|1,0,0]=3 1759 B11R1.90 Cc1ccoc1\C=N\S(C)=O Amb29865965 [0,2,0,0,0,0|2,0,0]=4 1760 B11R1.90 Cc1ccsc1\C=C/C(N)=O Amb27203317 [0,2,0,0,0,0|0,1,0]=3 1761 B11R1.90 Cc1ccsc1\C=C\C(=O)O Amb1153084 [0,2,0,0,0,0|0,1,0]=3 1762 B11R1.90 Cc1ccsc1\C=C\[N+](=O)[O-] Amb27975166 [0,2,0,0,0,0|1,1,0]=4 1763 B11R1.90 Cc1cnoc1\C=C\C(=O)O Amb28130063 [0,2,0,0,0,0|1,0,0]=3 1764 B11R1.90 Cc1cocc1\C=C\C(=O)O Amb24617450 [0,2,0,0,0,0|2,0,0]=4 1765 B11R1.90 Cc1conc1\C=C\C(=O)O Amb33470110 [0,2,0,0,0,0|2,0,0]=4 1766 B11R1.90 Cc1cscc1\C=C\C(=O)O Amb26421314 [0,2,0,0,0,0|2,0,0]=4 1767 B11R1.90 Cc1ncsc1\C=C\C(=O)O Amb33292464 [0,2,0,0,0,0|1,1,0]=4 1768 B11R1.90 Cc1ncsc1\C=C\C(N)=O Amb25964597 [0,2,0,0,0,0|1,1,0]=4 1769 B11R1.90 Cc1occc1\C=C\C(=O)O Amb33171665 [0,2,0,0,0,0|2,0,0]=4 1770 B11R1.90 Cn1cccc1\C=C/[N+](=O)[O-] Amb24309345 [0,2,0,0,0,0|2,0,0]=4 1771 B11R1.90 Cn1cccc1\C=C\C(=O)O Amb2371137 [0,2,0,0,0,0|1,0,0]=3 1772 B11R1.90 Cn1cccc1\C=C\N(=O)=O Amb20621706 [0,2,0,0,0,0|2,0,0]=4 1773 B11R1.90 Cn1cccc1\C=C\[N+](=O)[O-] Amb33249588 [0,2,0,0,0,0|2,0,0]=4 1774 B11R1.90 Cn1ccnc1\C=C/C(=O)O Amb27470158 [0,2,0,0,0,0|2,0,0]=4 1775 B11R1.90 Cn1ccnc1\C=C\C(=O)O Amb33171846 [0,2,0,0,0,0|2,0,0]=4 1776 B11R1.90 Cn1cncc1\C=C/C(N)=O Amb27252026 [0,2,0,0,0,0|2,0,0]=4 1777 B11R1.90 Cn1cncc1\C=C\C(=O)O Amb32663974 [0,2,0,0,0,0|2,0,0]=4 1778 B11R1.90 Cn1cncc1\C=C\C(=O)O Amb33276186 [0,2,0,0,0,0|2,0,0]=4 1779 B11R1.90 Cn1cncc1\C=C\C(N)=O Amb27843447 [0,2,0,0,0,0|2,0,0]=4 1780 B11R1.90 Cn1nccc1\C=C\C(=O)O Amb6889931 [0,2,0,0,0,0|2,0,0]=4 1781 B11R1.90 O=C(O)C#Cc1occc1Br Amb27605486 [0,2,0,0,0,0|0,0,2]=4 1782 B11R1.90 O=C(O)CCc1occc1F Amb27823334 [0,2,0,0,0,0|0,0,2]=4 1783 B11R1.90 O=C(O)\C=C\c1ccoc1Br Amb33470062 [0,2,0,0,0,0|2,0,0]=4 1784 B11R1.90 O=C(O)\C=C\c1ccoc1Cl Amb33470060 [0,2,0,0,0,0|2,0,0]=4 1785 B11R1.90 O=C(O)\C=C\c1ccsc1Br Amb33470113 [0,2,0,0,0,0|2,0,0]=4 1786 B11R1.90 O=C(O)\C=C\c1cscc1Br Amb25075327 [0,2,0,0,0,0|2,0,0]=4 1787 B11R1.90 O=C(O)\C=C\c1cscc1Cl Amb25700973 [0,2,0,0,0,0|2,0,0]=4 1788 B11R1.90 O=C(O)\C=C\c1nccn1O Amb27751831 [0,2,0,0,0,0|2,0,0]=4 1789 B11R1.90 O=C(O)\C=C\c1ncsc1Br Amb33470114 [0,2,0,0,0,0|2,0,0]=4 1790 B11R1.90 O=C(O)\C=C\c1nscc1Br Amb33470111 [0,2,0,0,0,0|2,0,0]=4 1791 B11R1.90 O=C(O)\C=C\c1sccc1Br Amb26004966 [0,2,0,0,0,0|0,1,0]=3 1792 B11R1.90 O=C(O)\C=C\c1sccc1Cl Amb24100812 [0,2,0,0,0,0|0,1,0]=3 1793 B11R1.90 O=C(O)\C=C\c1sccc1F Amb33470058 [0,2,0,0,0,0|0,1,0]=3 1794 B11R1.90 O=C(O)\C=C\c1sccc1I Amb33470064 [0,2,0,0,0,0|0,1,0]=3 1795 B11R1.90 O=C(O)\C=C\c1sncc1Br Amb33470128 [0,2,0,0,0,0|1,1,0]=4 1796 B11R1.90 O=[N+]([O-])\C=C\c1sccc1Br Amb33452091 [0,2,0,0,0,0|1,1,0]=4 1797 B11R1.90 O=[N+]([O-])\C=C\c1sccc1Cl Amb33258827 [0,2,0,0,0,0|1,1,0]=4 1798 B11R1.465 Cc1cnn(C)c1\C=C\C=O Amb27847715 [0,2,0,0,0,0|2,0,0]=4 1799 B11R1.465 Cn1cnc(Cl)c1\C=C\C=O Amb33057497 [0,2,0,0,0,0|2,0,0]=4 1800 B11R1.465 Cn1ncc(Br)c1\C=C\C=O Amb27834007 [0,2,0,0,0,0|2,0,0]=4 1801 B11R1.510 O=S(=O)(F)\C=C\c1ccco1 Amb33276659 [0,2,0,0,0,0|1,0,0]=3 1802 B11R1.510 O=S(=O)(F)\C=C\c1cccs1 Amb33456402 [0,2,0,0,0,0|1,1,0]=4 1803 B9R1.2 C#Cc1cccc(O)c1 Amb2720491 [0,0,1,1,0,0|1,0,1]=4 1804 B9R1.2 C=Cc1cc(O)ccn1 Amb26981946 [0,0,1,1,0,0|2,0,0]=4 1805 B9R1.2 C=Cc1cccc(Br)c1 Amb2685487 [0,0,1,1,0,0|2,0,0]=4 1806 B9R1.2 C=Cc1cccc(C)c1 Amb3940473 [0,0,1,1,0,0|2,0,0]=4 1807 B9R1.2 C=Cc1cccc(Cl)c1 Amb3941483 [0,0,1,1,0,0|2,0,0]=4 1808 B9R1.2 C=Cc1cccc(F)c1 Amb3940225 [0,0,1,1,0,0|2,0,0]=4 1809 B9R1.2 C=Cc1cccc(I)c1 Amb22295906 [0,0,1,1,0,0|2,0,0]=4 1810 B9R1.2 C=Cc1cccc(N)c1 Amb21857034 [0,0,1,1,0,0|2,0,0]=4 1811 B9R1.2 C=Cc1cccc(O)c1 Amb17593228 [0,0,1,1,0,0|1,0,0]=3 1812 B9R1.2 C=Cc1cncc(O)c1 Amb26899030 [0,0,1,1,0,0|2,0,0]=4 1813 B9R1.2 CCc1cccc(O)c1 Amb3938975 [0,0,1,1,0,0|1,0,1]=4 1814 B9R1.2 CNc1cccc(O)c1 Amb18281003 [0,0,1,1,0,0|2,0,0]=4 1815 B9R1.2 COc1cccc(O)c1 Amb3939549 [0,0,1,1,0,0|2,0,0]=4 1816 B9R1.2 CSc1cccc(O)c1 Amb8845207 [0,0,1,1,0,0|2,0,0]=4 1817 B9R1.2 Cc1cc(C=O)ccn1 Amb16231936 [0,0,1,1,0,0|1,0,1]=4 1818 B9R1.2 Cc1cc(C=O)ccn1 Amb9701813 [0,0,1,1,0,0|1,0,1]=4 1819 B9R1.2 Cc1cccc(C=O)c1 Amb2690615 [0,0,1,1,0,0|1,0,0]=3 1820 B9R1.2 Cc1cccc(C=O)n1 Amb2689678 [0,0,1,1,0,0|2,0,0]=4 1821 B9R1.2 Cc1cccc(N=O)c1 Amb25843313 [0,0,1,1,0,0|2,0,0]=4 1822 B9R1.2 Cc1cccc([IH2]=O)c1 Amb25312202 [0,0,1,1,0,0|2,0,0]=4 1823 B9R1.2 Cc1ccnc(C=O)c1 Amb6307702 [0,0,1,1,0,0|2,0,0]=4 1824 B9R1.2 Cc1cncc(C=O)c1 Amb8396131 [0,0,1,1,0,0|2,0,0]=4 1825 B9R1.2 N#Cc1cccc(O)c1 Amb1649098 [0,0,1,1,0,0|1,0,1]=4 1826 B9R1.2 N#[N+]c1cccc(O)c1 Amb27768731 [0,0,1,1,0,0|2,0,0]=4 1827 B9R1.2 NCc1cccc(O)c1 Amb10609577 [0,0,1,1,0,0|1,0,1]=4 1828 B9R1.2 NCc1cccc(O)c1 Amb1133156 [0,0,1,1,0,0|1,0,1]=4 1829 B9R1.2 NNc1cccc(O)c1 Amb25327903 [0,0,1,1,0,0|2,0,0]=4 1830 B9R1.2 NNc1cccc(O)c1 Amb32661662 [0,0,1,1,0,0|2,0,0]=4 1831 B9R1.2 NNc1cccc(O)c1 Amb32667594 [0,0,1,1,0,0|2,0,0]=4 1832 B9R1.2 Nc1cc(C=O)ccn1 Amb16231973 [0,0,1,1,0,0|2,0,0]=4 1833 B9R1.2 Nc1cccc(C=O)c1 Amb2697309 [0,0,1,1,0,0|1,0,0]=3 1834 B9R1.2 Nc1cccc(C=O)c1 Amb2697312 [0,0,1,1,0,0|1,0,0]=3 1835 B9R1.2 Nc1cccc(C=O)n1 Amb16231443 [0,0,1,1,0,0|2,0,0]=4 1836 B9R1.2 Nc1ccnc(C=O)c1 Amb25072810 [0,0,1,1,0,0|2,0,0]=4 1837 B9R1.2 Nc1cncc(C=O)c1 Amb26600938 [0,0,1,1,0,0|2,0,0]=4 1838 B9R1.2 O=CC1=CC=CC(=O)N1 Amb19882313 [0,0,1,1,0,0|1,0,1]=4 1839 B9R1.2 O=CC1=CC=CC(=O)O1 Amb27481476 [0,0,1,1,0,0|1,0,1]=4 1840 B9R1.2 O=Cc1cc(Br)ccn1 Amb10602645 [0,0,1,1,0,0|2,0,0]=4 1841 B9R1.2 O=Cc1cc(Cl)ccn1 Amb6752031 [0,0,1,1,0,0|2,0,0]=4 1842 B9R1.2 O=Cc1cc(F)ccn1 Amb21963126 [0,0,1,1,0,0|2,0,0]=4 1843 B9R1.2 O=Cc1cc(O)ccn1 Amb30982669 [0,0,1,1,0,0|1,0,0]=3 1844 B9R1.2 O=Cc1ccc[n+]([O-])c1 Amb22263067 [0,0,1,1,0,0|1,0,1]=4 1845 B9R1.2 O=Cc1cccc(Br)c1 Amb1232086 [0,0,1,1,0,0|1,0,0]=3 1846 B9R1.2 O=Cc1cccc(Br)n1 Amb535786 [0,0,1,1,0,0|2,0,0]=4 1847 B9R1.2 O=Cc1cccc(Cl)c1 Amb2725499 [0,0,1,1,0,0|1,0,0]=3 1848 B9R1.2 O=Cc1cccc(Cl)n1 Amb8383544 [0,0,1,1,0,0|2,0,0]=4 1849 B9R1.2 O=Cc1cccc(F)c1 Amb535197 [0,0,1,1,0,0|1,0,0]=3 1850 B9R1.2 O=Cc1cccc(F)n1 Amb8386828 [0,0,1,1,0,0|2,0,0]=4 1851 B9R1.2 O=Cc1cccc(I)c1 Amb1033003 [0,0,1,1,0,0|1,0,0]=3 1852 B9R1.2 O=Cc1cccc(O)c1 Amb1880871 [0,0,1,1,0,0|0,0,0]=2 1853 B9R1.2 O=Cc1cccc(O)n1 Amb20247934 [0,0,1,1,0,0|1,0,0]=3 1854 B9R1.2 O=Cc1cccc(S)c1 Amb13952077 [0,0,1,1,0,0|0,1,0]=3 1855 B9R1.2 O=Cc1ccnc(Br)c1 Amb2455911 [0,0,1,1,0,0|2,0,0]=4 1856 B9R1.2 O=Cc1ccnc(Cl)c1 Amb22831477 [0,0,1,1,0,0|2,0,0]=4 1857 B9R1.2 O=Cc1ccnc(Cl)c1 Amb2447585 [0,0,1,1,0,0|2,0,0]=4 1858 B9R1.2 O=Cc1ccnc(F)c1 Amb8396130 [0,0,1,1,0,0|2,0,0]=4 1859 B9R1.2 O=Cc1ccnc(O)c1 Amb2695333 [0,0,1,1,0,0|1,0,0]=3 1860 B9R1.2 O=Cc1cncc(Br)c1 Amb2447305 [0,0,1,1,0,0|2,0,0]=4 1861 B9R1.2 O=Cc1cncc(Cl)c1 Amb6565107 [0,0,1,1,0,0|2,0,0]=4 1862 B9R1.2 O=Cc1cncc(F)c1 Amb2447593 [0,0,1,1,0,0|2,0,0]=4 1863 B9R1.2 O=Cc1cncc(F)c1 Amb33292547 [0,0,1,1,0,0|2,0,0]=4 1864 B9R1.2 O=Cc1cncc(I)c1 Amb6565106 [0,0,1,1,0,0|2,0,0]=4 1865 B9R1.2 O=Cc1cncc(O)c1 Amb19895145 [0,0,1,1,0,0|1,0,0]=3 1866 B9R1.2 O=Cc1cncc(O)n1 Amb28077078 [0,0,1,1,0,0|2,0,0]=4 1867 B9R1.2 O=Nc1cccc(Br)c1 Amb28061595 [0,0,1,1,0,0|2,0,0]=4 1868 B9R1.2 O=Nc1cccc(Cl)c1 Amb28429156 [0,0,1,1,0,0|2,0,0]=4 1869 B9R1.2 OCc1cccc(O)c1 Amb2688734 [0,0,1,1,0,0|0,0,2]=4 1870 B9R1.2 ONc1cccc(O)c1 Amb28144169 [0,0,1,1,0,0|1,0,1]=4 1871 B9R1.2 Oc1cccc(CBr)c1 Amb5719379 [0,0,1,1,0,0|1,0,1]=4 1872 B9R1.2 Oc1cccc(CCl)c1 Amb8391842 [0,0,1,1,0,0|1,0,1]=4 1873 B9R1.2 Oc1cccc(CS)c1 Amb18643580 [0,0,1,1,0,0|0,1,1]=4 1874 B9R1.2 [NH3+]Cc1cccc(O)c1 Amb22547663 [0,0,1,1,0,0|1,0,1]=4 1875 B9R1.8 C=CCc1ccccc1 Amb2599341 [0,0,1,1,0,0|2,0,0]=4 1876 B9R1.8 C=CCc1cccnc1 Amb24477831 [0,0,1,1,0,0|2,0,0]=4 1877 B9R1.8 C=COc1ccccc1 Amb10564213 [0,0,1,1,0,0|1,0,0]=3 1878 B9R1.8 C=COc1cccnc1 Amb24085952 [0,0,1,1,0,0|1,0,0]=3 1879 B9R1.8 C=CSc1ccccc1 Amb8387516 [0,0,1,1,0,0|1,1,0]=4 1880 B9R1.8 O=COc1ccccc1 Amb22002710 [0,0,1,1,0,0|2,0,0]=4 1881 B9R1.15 C=Cc1ccccc1Br Amb6365618 [0,0,1,1,0,0|2,0,0]=4 1882 B9R1.15 C=Cc1ccccc1C Amb2695476 [0,0,1,1,0,0|2,0,0]=4 1883 B9R1.15 C=Cc1ccccc1Cl Amb3940227 [0,0,1,1,0,0|2,0,0]=4 1884 B9R1.15 C=Cc1ccccc1F Amb3940550 [0,0,1,1,0,0|2,0,0]=4 1885 B9R1.15 C=Cc1ccccc1I Amb8384620 [0,0,1,1,0,0|2,0,0]=4 1886 B9R1.15 C=Cc1ccccc1N Amb17593221 [0,0,1,1,0,0|2,0,0]=4 1887 B9R1.15 C=Cc1ccccc1N Amb21857764 [0,0,1,1,0,0|2,0,0]=4 1888 B9R1.15 C=Cc1ccccc1O Amb17593227 [0,0,1,1,0,0|1,0,0]=3 1889 B9R1.15 C=Cc1ccncc1O Amb25358569 [0,0,1,1,0,0|2,0,0]=4 1890 B9R1.15 C=Cc1ncccc1C Amb28120463 [0,0,1,1,0,0|2,0,0]=4 1891 B9R1.15 C=Cc1ncccc1F Amb26991382 [0,0,1,1,0,0|2,0,0]=4 1892 B9R1.15 N=Cc1ccccc1O Amb28382612 [0,0,1,1,0,0|2,0,0]=4 1893 B9R1.15 O=Cc1ccccc1O Amb2792756 [0,0,1,1,0,0|2,0,0]=4 1894 B9R1.15 O=Cc1ncccc1O Amb22495285 [0,0,1,1,0,0|2,0,0]=4 1895 B9R1.15 O=Cc1ncccc1O Amb2691308 [0,0,1,1,0,0|2,0,0]=4 1896 B9R1.20 C=CC1OC1\C=C\C=O Amb27434216 [0,0,1,1,0,0|0,0,2]=4 1897 B9R1.20 C=C[C@H]1O[C@H]1\C=C/C=O Amb27446645 [0,0,1,1,0,0|0,0,2]=4 1898 B9R1.20 C=C[C@H]1O[C@H]1\C=C\C=O Amb27782400 [0,0,1,1,0,0|0,0,2]=4 1899 B9R1.22 Cc1cc(C=O)c(C)o1 Amb3680124 [0,0,1,1,0,0|0,0,2]=4 1900 B9R1.22 Cc1cc(C=O)c(F)o1 Amb18832649 [0,0,1,1,0,0|1,0,1]=4 1901 B9R1.22 Cc1cc(C=O)c(N)o1 Amb18832838 [0,0,1,1,0,0|1,0,1]=4 1902 B9R1.22 Cc1oc(Br)cc1C=O Amb18187311 [0,0,1,1,0,0|1,0,1]=4 1903 B9R1.22 Cc1oc(N)cc1C=O Amb18832842 [0,0,1,1,0,0|1,0,1]=4 1904 B9R1.22 O=Cc1cc(Cl)oc1Cl Amb27433156 [0,0,1,1,0,0|2,0,0]=4 1905 B9R1.27 C=CN1C(=O)C=CC1=O Amb28343954 [0,0,1,1,0,0|1,0,1]=4 1906 B9R1.49 O=C1C=CC=C(O)C=C1 Amb18048395 [0,0,1,1,0,0|0,0,0]=2 1907 B9R1.69 CC1=CC(=N)C=CC1=O Amb28386642 [0,0,1,1,0,0|1,0,1]=4 1908 B9R1.69 CC1=CC(=O)C(=O)C=C1 Amb17593242 [0,0,1,1,0,0|2,0,0]=4 1909 B9R1.69 CC1=CC(=O)C=CC1=O Amb6386415 [0,0,1,1,0,0|0,0,2]=4 1910 B9R1.69 CC1=CC(O)C=CC1=O Amb27954124 [0,0,1,1,0,0|0,0,2]=4 1911 B9R1.69 CN1C=C(O)C=CC1=O Amb22371453 [0,0,1,1,0,0|1,0,1]=4 1912 B9R1.69 Cc1cc(O)ccc1Br Amb2554775 [0,0,1,1,0,0|1,0,1]=4 1913 B9R1.69 Cc1cc(O)ccc1Cl Amb3939554 [0,0,1,1,0,0|1,0,1]=4 1914 B9R1.69 Cc1cc(O)ccc1F Amb2688209 [0,0,1,1,0,0|1,0,1]=4 1915 B9R1.69 Cc1cc(O)ccc1I Amb8388185 [0,0,1,1,0,0|1,0,1]=4 1916 B9R1.69 Cc1cc(O)ccc1N Amb4037027 [0,0,1,1,0,0|1,0,1]=4 1917 B9R1.69 Cc1cc(O)ccc1O Amb4037056 [0,0,1,1,0,0|0,0,2]=4 1918 B9R1.69 Cc1ccc(O)cc1Br Amb16185697 [0,0,1,1,0,0|2,0,0]=4 1919 B9R1.69 Cc1ccc(O)cc1C Amb3939551 [0,0,1,1,0,0|1,0,1]=4 1920 B9R1.69 Cc1ccc(O)cc1Cl Amb2686223 [0,0,1,1,0,0|2,0,0]=4 1921 B9R1.69 Cc1ccc(O)cc1F Amb6297931 [0,0,1,1,0,0|2,0,0]=4 1922 B9R1.69 Cc1ccc(O)cc1I Amb24105676 [0,0,1,1,0,0|2,0,0]=4 1923 B9R1.69 Cc1ccc(O)cc1N Amb2697316 [0,0,1,1,0,0|2,0,0]=4 1924 B9R1.69 Cc1ccc(O)cc1O Amb9871491 [0,0,1,1,0,0|2,0,0]=4 1925 B9R1.69 NC1=CC(=O)C=CC1=O Amb25727299 [0,0,1,1,0,0|1,0,1]=4 1926 B9R1.69 Nc1cc(O)ccc1Br Amb6298305 [0,0,1,1,0,0|2,0,0]=4 1927 B9R1.69 Nc1cc(O)ccc1Cl Amb8393748 [0,0,1,1,0,0|2,0,0]=4 1928 B9R1.69 Nc1cc(O)ccc1F Amb7172534 [0,0,1,1,0,0|2,0,0]=4 1929 B9R1.69 Nc1ccc(O)cc1Br Amb8439593 [0,0,1,1,0,0|2,0,0]=4 1930 B9R1.69 Nc1ccc(O)cc1Cl Amb2720182 [0,0,1,1,0,0|2,0,0]=4 1931 B9R1.69 Nc1ccc(O)cc1Cl Amb33548106 [0,0,1,1,0,0|2,0,0]=4 1932 B9R1.69 Nc1ccc(O)cc1F Amb2684426 [0,0,1,1,0,0|2,0,0]=4 1933 B9R1.69 Nc1ccc(O)cc1F Amb33717235 [0,0,1,1,0,0|2,0,0]=4 1934 B9R1.69 Nc1ccc(O)cc1F Amb8629991 [0,0,1,1,0,0|2,0,0]=4 1935 B9R1.69 Nc1ccc(O)cc1I Amb28555354 [0,0,1,1,0,0|2,0,0]=4 1936 B9R1.69 Nc1ccc(O)cc1N Amb30585167 [0,0,1,1,0,0|2,0,0]=4 1937 B9R1.69 Nc1ccc(O)cc1N Amb5544650 [0,0,1,1,0,0|2,0,0]=4 1938 B9R1.69 Nc1ccc(O)cc1O Amb18553675 [0,0,1,1,0,0|2,0,0]=4 1939 B9R1.69 Nc1ccc(O)cc1O Amb21858039 [0,0,1,1,0,0|2,0,0]=4 1940 B9R1.69 O=C1C=CC(=O)C(Br)=C1 Amb6297942 [0,0,1,1,0,0|1,0,1]=4 1941 B9R1.69 O=C1C=CC(=O)C(Cl)=C1 Amb8515758 [0,0,1,1,0,0|1,0,1]=4 1942 B9R1.69 O=C1C=CC(=O)C(F)=C1 Amb10841415 [0,0,1,1,0,0|1,0,1]=4 1943 B9R1.69 O=C1C=CC(=O)C(O)=C1 Amb17593265 [0,0,1,1,0,0|1,0,1]=4 1944 B9R1.69 Oc1ccc(Br)c(Br)c1 Amb6297318 [0,0,1,1,0,0|2,0,0]=4 1945 B9R1.69 Oc1ccc(Br)c(Cl)c1 Amb33548806 [0,0,1,1,0,0|2,0,0]=4 1946 B9R1.69 Oc1ccc(Br)c(F)c1 Amb2685234 [0,0,1,1,0,0|2,0,0]=4 1947 B9R1.69 Oc1ccc(Br)c(I)c1 Amb22735788 [0,0,1,1,0,0|2,0,0]=4 1948 B9R1.69 Oc1ccc(Br)c(O)c1 Amb3939307 [0,0,1,1,0,0|2,0,0]=4 1949 B9R1.69 Oc1ccc(Br)c(S)c1 Amb28369358 [0,0,1,1,0,0|2,0,0]=4 1950 B9R1.69 Oc1ccc(Cl)c(Br)c1 Amb6296736 [0,0,1,1,0,0|2,0,0]=4 1951 B9R1.69 Oc1ccc(Cl)c(Cl)c1 Amb3939548 [0,0,1,1,0,0|2,0,0]=4 1952 B9R1.69 Oc1ccc(Cl)c(F)c1 Amb2686046 [0,0,1,1,0,0|2,0,0]=4 1953 B9R1.69 Oc1ccc(Cl)c(I)c1 Amb10069351 [0,0,1,1,0,0|2,0,0]=4 1954 B9R1.69 Oc1ccc(Cl)c(O)c1 Amb3941632 [0,0,1,1,0,0|2,0,0]=4 1955 B9R1.69 Oc1ccc(F)c(Br)c1 Amb6298647 [0,0,1,1,0,0|2,0,0]=4 1956 B9R1.69 Oc1ccc(F)c(Cl)c1 Amb2686045 [0,0,1,1,0,0|2,0,0]=4 1957 B9R1.69 Oc1ccc(F)c(F)c1 Amb1152988 [0,0,1,1,0,0|2,0,0]=4 1958 B9R1.69 Oc1ccc(F)c(I)c1 Amb24478755 [0,0,1,1,0,0|2,0,0]=4 1959 B9R1.69 Oc1ccc(F)c(O)c1 Amb16185891 [0,0,1,1,0,0|2,0,0]=4 1960 B9R1.69 Oc1ccc(F)c(S)c1 Amb27166571 [0,0,1,1,0,0|2,0,0]=4 1961 B9R1.69 Oc1ccc(I)c(Br)c1 Amb22735960 [0,0,1,1,0,0|2,0,0]=4 1962 B9R1.69 Oc1ccc(I)c(Cl)c1 Amb24082687 [0,0,1,1,0,0|2,0,0]=4 1963 B9R1.69 Oc1ccc(I)c(F)c1 Amb20670870 [0,0,1,1,0,0|2,0,0]=4 1964 B9R1.69 Oc1ccc(I)c(I)c1 Amb21963846 [0,0,1,1,0,0|2,0,0]=4 1965 B9R1.69 Oc1ccc(I)c(S)c1 Amb25692167 [0,0,1,1,0,0|2,0,0]=4 1966 B9R1.69 Oc1ccc(O)c(Cl)c1 Amb6297198 [0,0,1,1,0,0|1,0,1]=4 1967 B9R1.69 Oc1ccc(O)c(F)c1 Amb20240579 [0,0,1,1,0,0|1,0,1]=4 1968 B9R1.69 Oc1ccc(O)c(O)c1 Amb6296031 [0,0,1,1,0,0|1,0,1]=4 1969 B9R1.69 Oc1ccc(O)c(S)c1 Amb10070964 [0,0,1,1,0,0|1,0,1]=4 1970 B9R1.69 Oc1ccc(S)c(Br)c1 Amb27851065 [0,0,1,1,0,0|1,1,0]=4 1971 B9R1.69 Oc1ccc(S)c(Cl)c1 Amb18645433 [0,0,1,1,0,0|1,1,0]=4 1972 B9R1.69 Oc1ccc(S)c(F)c1 Amb24642779 [0,0,1,1,0,0|1,1,0]=4 1973 B9R1.69 Oc1ccc(S)c(I)c1 Amb24404961 [0,0,1,1,0,0|1,1,0]=4 1974 B9R1.69 Oc1ccc(S)c(O)c1 Amb18643824 [0,0,1,1,0,0|1,1,0]=4 1975 B9R1.5 NC1=CC=CC=CC1=O Amb22295786 [0,0,1,1,0,0|1,0,0]=3 1976 B9R1.5 O=C1C=CC=CC=C1Br Amb24465155 [0,0,1,1,0,0|1,0,0]=3 1977 B9R1.5 O=C1C=CC=CC=C1Cl Amb22731598 [0,0,1,1,0,0|1,0,0]=3 1978 B9R1.5 O=C1C=CC=CC=C1F Amb28202065 [0,0,1,1,0,0|1,0,0]=3 1979 B9R1.5 O=C1C=CC=CC=C1O Amb20242380 [0,0,1,1,0,0|0,0,0]=2 1980 B9R1.5 O=C1C=CC=CC=C1[S-] Amb26515940 [0,0,1,1,0,0|0,1,0]=3 1981 B9R1.5 O=C1C=CC=CCC1=O Amb25319856 [0,0,1,1,0,0|0,0,2]=4 1982 B9R1.14 C=Cc1ccsc1C=O Amb25920583 [0,0,1,1,0,0|2,0,0]=4 1983 B9R1.14 C=Cc1cscc1C=O Amb27209813 [0,0,1,1,0,0|2,0,0]=4 1984 B9R1.14 C=Cn1nccc1C=O Amb25940730 [0,0,1,1,0,0|2,0,0]=4 1985 B9R1.14 CCc1occc1C=O Amb18832921 [0,0,1,1,0,0|0,0,2]=4 1986 B9R1.14 N#Cc1occc1C=O Amb18833004 [0,0,1,1,0,0|1,0,1]=4 1987 B9R1.14 O=CC1=CC=CC1C=O Amb27827381 [0,0,1,1,0,0|0,0,2]=4 1988 B9R1.14 O=CC1=CCC=C1C=O Amb27949629 [0,0,1,1,0,0|0,0,2]=4 1989 B9R1.14 O=Cc1ccsc1C=O Amb2611501 [0,0,1,1,0,0|1,0,1]=4 1990 B9R1.14 O=Cc1ccsc1CO Amb24665662 [0,0,1,1,0,0|1,0,1]=4 1991 B9R1.14 O=Cc1cocc1CO Amb2610310 [0,0,1,1,0,0|1,0,1]=4 1992 B9R1.14 O=Cc1cscc1C=O Amb8394153 [0,0,1,1,0,0|1,0,1]=4 1993 B9R1.89 O=CC1=CC=CC=CC1 Amb17593229 [0,0,1,1,0,0|1,0,0]=3 1994 B9R1.89 O=CC1=CCC=CC=C1 Amb27955933 [0,0,1,1,0,0|1,0,1]=4 1995 B9R1.1 Bc1ccc(OC)cc1 Amb26633014 [0,0,1,1,0,0|1,0,1]=4 1996 B9R1.1 C=Cc1ccc(Br)cc1 Amb3940196 [0,0,1,1,0,0|2,0,0]=4 1997 B9R1.1 C=Cc1ccc(Br)cn1 Amb21857299 [0,0,1,1,0,0|2,0,0]=4 1998 B9R1.1 C=Cc1ccc(C)cc1 Amb3940476 [0,0,1,1,0,0|2,0,0]=4 1999 B9R1.1 C=Cc1ccc(C)cn1 Amb8388023 [0,0,1,1,0,0|2,0,0]=4 2000 B9R1.1 C=Cc1ccc(Cl)cc1 Amb2686460 [0,0,1,1,0,0|2,0,0]=4 2001 B9R1.1 C=Cc1ccc(Cl)cn1 Amb24071183 [0,0,1,1,0,0|2,0,0]=4 2002 B9R1.1 C=Cc1ccc(F)cc1 Amb6297757 [0,0,1,1,0,0|2,0,0]=4 2003 B9R1.1 C=Cc1ccc(F)cn1 Amb26483914 [0,0,1,1,0,0|2,0,0]=4 2004 B9R1.1 C=Cc1ccc(I)cc1 Amb22736012 [0,0,1,1,0,0|2,0,0]=4 2005 B9R1.1 C=Cc1ccc(N)cc1 Amb2684524 [0,0,1,1,0,0|2,0,0]=4 2006 B9R1.1 C=Cc1ccc(O)cc1 Amb10603802 [0,0,1,1,0,0|1,0,1]=4 2007 B9R1.1 C=Cc1ccc(O)cn1 Amb26512884 [0,0,1,1,0,0|1,0,1]=4 2008 B9R1.1 C=Cc1ccc(S)cc1 Amb27801943 [0,0,1,1,0,0|1,1,0]=4 2009 B9R1.1 C=Nc1ccc(Cl)cc1 Amb28049234 [0,0,1,1,0,0|2,0,0]=4 2010 B9R1.1 C=Nc1ccc(O)cc1 Amb17593237 [0,0,1,1,0,0|1,0,1]=4 2011 B9R1.1 CC=C1C=CC(=O)C=C1 Amb28285289 [0,0,1,1,0,0|1,0,1]=4 2012 B9R1.1 COc1ccc(Br)cc1 Amb3939303 [0,0,1,1,0,0|1,0,1]=4 2013 B9R1.1 COc1ccc(C)cc1 Amb6608865 [0,0,1,1,0,0|1,0,1]=4 2014 B9R1.1 COc1ccc(Cl)cc1 Amb8386699 [0,0,1,1,0,0|1,0,1]=4 2015 B9R1.1 COc1ccc(F)cc1 Amb2688016 [0,0,1,1,0,0|1,0,1]=4 2016 B9R1.1 COc1ccc(I)cc1 Amb6296024 [0,0,1,1,0,0|1,0,1]=4 2017 B9R1.1 COc1ccc(N)cc1 Amb6364740 [0,0,1,1,0,0|1,0,1]=4 2018 B9R1.1 COc1ccc(O)cc1 Amb2725498 [0,0,1,1,0,0|0,0,2]=4 2019 B9R1.1 COc1ccc(S)cc1 Amb2689088 [0,0,1,1,0,0|0,1,1]=4 2020 B9R1.1 COc1ccc([Mg+])cc1 Amb22053738 [0,0,1,1,0,0|1,0,1]=4 2021 B9R1.1 NOc1ccc(Br)cc1 Amb18649721 [0,0,1,1,0,0|2,0,0]=4 2022 B9R1.1 NOc1ccc(Br)cc1 Amb32683285 [0,0,1,1,0,0|2,0,0]=4 2023 B9R1.1 NOc1ccc(Cl)cc1 Amb18644043 [0,0,1,1,0,0|2,0,0]=4 2024 B9R1.1 NOc1ccc(Cl)cc1 Amb32667495 [0,0,1,1,0,0|2,0,0]=4 2025 B9R1.1 NOc1ccc(F)cc1 Amb18642489 [0,0,1,1,0,0|2,0,0]=4 2026 B9R1.1 NOc1ccc(F)cc1 Amb32662914 [0,0,1,1,0,0|2,0,0]=4 2027 B9R1.1 O=C1C=CC(=NCl)C=C1 Amb22732649 [0,0,1,1,0,0|2,0,0]=4 2028 B9R1.1 O=C1C=CC(=NO)C=C1 Amb17608819 [0,0,1,1,0,0|2,0,0]=4 2029 B9R1.21 C=Cc1cc(C=O)cs1 Amb25830217 [0,0,1,1,0,0|0,1,0]=3 2030 B9R1.21 C=Cc1ccc(C=O)s1 Amb18643293 [0,0,1,1,0,0|2,0,0]=4 2031 B9R1.21 C=Cc1csc(C=O)c1 Amb28129936 [0,0,1,1,0,0|2,0,0]=4 2032 B9R1.21 C=Cn1cc(C=O)cn1 Amb10608110 [0,0,1,1,0,0|2,0,0]=4 2033 B9R1.21 C=Cn1ccc(C=O)c1 Amb27409922 [0,0,1,1,0,0|2,0,0]=4 2034 B9R1.21 COc1cc(C=O)cs1 Amb18643873 [0,0,1,1,0,0|1,0,1]=4 2035 B9R1.21 COc1ccc(C=O)o1 Amb18832781 [0,0,1,1,0,0|1,0,1]=4 2036 B9R1.21 COc1ccc(C=O)s1 Amb17593592 [0,0,1,1,0,0|1,0,1]=4 2037 B9R1.21 COc1coc(C=O)c1 Amb18832782 [0,0,1,1,0,0|1,0,1]=4 2038 B9R1.21 COc1csc(C=O)c1 Amb18202589 [0,0,1,1,0,0|1,0,1]=4 2039 B9R1.21 N#Cc1cc(C=O)co1 Amb18833001 [0,0,1,1,0,0|1,0,1]=4 2040 B9R1.21 O=Cc1coc(C=O)c1 Amb22170483 [0,0,1,1,0,0|1,0,0]=3 2041 B9R1.21 O=Cc1csc(C=O)c1 Amb1102128 [0,0,1,1,0,0|1,1,0]=4 2042 B9R2.3 c1cc2ccnc2n1 Amb27881525 [1,0,0,1,0,0|2,0,0]=4 2043 B9R2.3 c1cc2cscc2o1 Amb27817005 [1,0,0,1,0,0|1,0,0]=3 2044 B9R2.3 c1cc2cscc2s1 Amb9790317 [1,0,0,1,0,0|1,1,0]=4 2045 B9R2.3 c1cc2sccc2s1 Amb2611506 [1,0,0,1,0,0|0,2,0]=4 2046 B9R2.3 c1cc2sccn2c1 Amb28312857 [1,0,0,1,0,0|1,1,0]=4 2047 B9R2.3 c1cc2scnc2o1 Amb23412528 [1,0,0,1,0,0|1,1,0]=4 2048 B9R2.50 C1=Cc2ccccc21 Amb19515942 [0,0,0,1,1,0|1,0,0]=3 2049 B11R2.1 Brc1ccc2ccccn12 Amb18061677 [0,0,0,1,0,1|2,0,0]=4 2050 B11R2.1 Brc1ccc2cccnn12 Amb18188207 [0,0,0,1,0,1|2,0,0]=4 2051 B11R2.1 Brc1ccc2ccncn12 Amb25082520 [0,0,0,1,0,1|2,0,0]=4 2052 B11R2.1 Brc1ccc2cnccn12 Amb18188551 [0,0,0,1,0,1|2,0,0]=4 2053 B11R2.1 Cc1ccc2ccccn12 Amb28126713 [0,0,0,1,0,1|2,0,0]=4 2054 B11R2.1 Clc1ccc2ccccn12 Amb27618437 [0,0,0,1,0,1|2,0,0]=4 2055 B11R2.1 Nc1ccc2ccccn12 Amb18061678 [0,0,0,1,0,1|2,0,0]=4 2056 B11R2.1 O=C1C=CC2=NCC=CN12 Amb28254538 [0,0,0,1,0,1|1,0,1]=4 2057 B11R2.1 O=C1C=Cc2ccccc21 Amb10603436 [0,0,0,1,0,1|1,0,0]=3 2058 B11R2.1 O=C1N=Cc2ccccc21 Amb25265062 [0,0,0,1,0,1|2,0,0]=4 2059 B11R2.1 O=C1N=Cc2ccncc21 Amb28252569 [0,0,0,1,0,1|2,0,0]=4 2060 B11R2.1 O=C1NC=C2C=CC=CN12 Amb26008108 [0,0,0,1,0,1|2,0,0]=4 2061 B11R2.1 O=s1ccc2ccccc21 Amb24078341 [0,0,0,1,0,1|2,0,0]=4 2062 B11R2.1 Oc1ccc2cnccn12 Amb28201971 [0,0,0,1,0,1|1,0,1]=4 2063 B11R2.20 C1=CCc2ccccc2C1 Amb8392372 [0,0,0,1,0,1|2,0,0]=4 2064 B11R2.20 C1=CCc2ncccc2C1 Amb28146039 [0,0,0,1,0,1|2,0,0]=4 2065 B11R2.20 C1=COC2=CN=CNC2=C1 Amb24564703 [0,0,0,1,0,1|1,0,1]=4 2066 B11R2.20 C1=COc2ccccc2N1 Amb27828258 [0,0,0,1,0,1|1,0,0]=3 2067 B11R2.20 C1=COc2cccnc2C1 Amb27860347 [0,0,0,1,0,1|1,0,0]=3 2068 B11R2.20 C1=COc2cccnc2N1 Amb27403264 [0,0,0,1,0,1|1,0,0]=3 2069 B11R2.20 C1=COc2ccncc2C1 Amb28050276 [0,0,0,1,0,1|2,0,0]=4 2070 B11R2.20 C1=COc2ncncc2O1 Amb25966010 [0,0,0,1,0,1|2,0,0]=4 2071 B11R2.20 C1=CSC2=CN=CNC2=C1 Amb27245769 [0,0,0,1,0,1|1,1,0]=4 2072 B11R2.20 C1=CSc2ncccc2N1 Amb27954664 [0,0,0,1,0,1|2,0,0]=4 2073 B11R2.20 C1=Cc2ccccc2CC1 Amb1162229 [0,0,0,1,0,1|2,0,0]=4 2074 B11R2.20 C1=Cc2ccccc2CN1 Amb25999205 [0,0,0,1,0,1|2,0,0]=4 2075 B11R2.20 C1=Cc2ccccc2CO1 Amb27473263 [0,0,0,1,0,1|1,0,0]=3 2076 B11R2.20 C1=Cc2ccccc2NC1 Amb17593383 [0,0,0,1,0,1|2,0,0]=4 2077 B11R2.20 C1=Cc2ccccc2OC1 Amb17844055 [0,0,0,1,0,1|1,0,0]=3 2078 B11R2.20 C1=Cc2ccccc2SC1 Amb27494059 [0,0,0,1,0,1|1,1,0]=4 2079 B11R2.20 C1=NOCc2cccnc21 Amb28322768 [0,0,0,1,0,1|2,0,0]=4 2080 B11R2.20 C1=Nc2ccccc2OC1 Amb28456926 [0,0,0,1,0,1|1,0,1]=4 2081 B11R2.20 C1=Nc2ncccc2CO1 Amb27950837 [0,0,0,1,0,1|2,0,0]=4 2082 B11R2.20 c1cc[n+]2cccnc2c1 Amb2603162 [0,0,0,1,0,1|2,0,0]=4 2083 B11R2.20 c1ccc2[nH+]cccc2c1 Amb10839799 [0,0,0,1,0,1|2,0,0]=4 2084 B11R2.20 c1ccc2ccccc2c1 Amb6608803 [0,0,0,1,0,1|2,0,0]=4 2085 B11R2.20 c1ccc2cnccc2c1 Amb2609970 [0,0,0,1,0,1|2,0,0]=4 2086 B11R2.20 c1ccc2ncccc2c1 Amb22002632 [0,0,0,1,0,1|2,0,0]=4 2087 B11R2.20 c1ccc2ncccc2c1 Amb2610545 [0,0,0,1,0,1|2,0,0]=4 2088 B11R2.20 c1ccc2nccnc2c1 Amb2099438 [0,0,0,1,0,1|2,0,0]=4 2089 B11R2.20 c1ccc2ncncc2c1 Amb2609962 [0,0,0,1,0,1|2,0,0]=4 2090 B11R2.20 c1ccc2nnccc2c1 Amb21858429 [0,0,0,1,0,1|2,0,0]=4 2091 B11R2.20 c1ccc2nnccc2c1 Amb22001549 [0,0,0,1,0,1|2,0,0]=4 2092 B11R2.20 c1cnc2cccnc2c1 Amb1106274 [0,0,0,1,0,1|2,0,0]=4 2093 B11R2.20 c1cnc2ccncc2c1 Amb6565155 [0,0,0,1,0,1|2,0,0]=4 2094 B11R2.20 c1cnc2ccnnc2c1 Amb27470418 [0,0,0,1,0,1|2,0,0]=4 2095 B11R2.20 c1cnc2cnccc2c1 Amb4560929 [0,0,0,1,0,1|2,0,0]=4 2096 B11R2.20 c1cnc2ncccc2c1 Amb15692873 [0,0,0,1,0,1|2,0,0]=4 2097 B11R2.20 c1cnc2nccnc2c1 Amb33544339 [0,0,0,1,0,1|2,0,0]=4 2098 B11R2.2 C1=C(c2ccco2)N[CH+]C1 Amb27876498 [0,1,0,1,0,0|1,0,1]=4 2099 B11R2.2 C1=CC(c2ccco2)NC1 Amb27243147 [0,1,0,1,0,0|1,0,1]=4 2100 B11R2.2 c1cc(-c2ccsc2)on1 Amb8384697 [0,1,0,1,0,0|1,1,0]=4 2101 B11R2.2 c1cc(-c2cnco2)co1 Amb23437039 [0,1,0,1,0,0|1,0,1]=4 2102 B11R2.2 c1cc(-c2cnco2)no1 Amb35652269 [0,1,0,1,0,0|1,0,1]=4 2103 B11R2.2 c1coc(-c2ccco2)c1 Amb10559843 [0,1,0,1,0,0|0,0,1]=3 2104 B11R2.2 c1coc(-c2ccno2)c1 Amb28382212 [0,1,0,1,0,0|0,0,1]=3 2105 B11R2.2 c1coc(-c2ccon2)c1 Amb27754602 [0,1,0,1,0,0|0,0,1]=3 2106 B11R2.2 c1coc(-c2cnco2)c1 Amb591268 [0,1,0,1,0,0|0,0,1]=3 2107 B11R2.2 c1coc(-c2ncco2)n1 Amb27209912 [0,1,0,1,0,0|1,0,1]=4 2108 B11R2.2 c1coc(-c2nccs2)c1 Amb2735633 [0,1,0,1,0,0|0,1,0]=3 2109 B11R2.2 c1coc(-c2nccs2)n1 Amb27193383 [0,1,0,1,0,0|1,1,0]=4 2110 B11R2.2 c1coc(-c2ncon2)c1 Amb28133293 [0,1,0,1,0,0|1,0,1]=4 2111 B11R2.2 c1coc(-c2nnco2)c1 Amb27467994 [0,1,0,1,0,0|1,0,1]=4 2112 B11R2.2 c1coc(-c2nncs2)c1 Amb28050210 [0,1,0,1,0,0|1,1,0]=4 2113 B11R2.2 c1coc(-n2cccc2)c1 Amb27862431 [0,1,0,1,0,0|1,0,0]=3 2114 B11R2.2 c1coc(-n2ccnc2)c1 Amb28250047 [0,1,0,1,0,0|2,0,0]=4 2115 B11R2.2 c1csc(-c2cccs2)c1 Amb597256 [0,1,0,1,0,0|0,2,0]=4 2116 B11R2.2 c1csc(-c2ccno2)c1 Amb8384800 [0,1,0,1,0,0|0,1,1]=4 2117 B11R2.2 c1csc(-c2cnco2)c1 Amb2725746 [0,1,0,1,0,0|0,1,1]=4 2118 B11R2.2 c1csc(-c2cnco2)n1 Amb22736193 [0,1,0,1,0,0|1,1,0]=4 2119 B11R2.2 c1csc(-c2cocn2)c1 Amb17399918 [0,1,0,1,0,0|1,1,0]=4 2120 B11R2.2 c1csc(-c2cscn2)c1 Amb17400243 [0,1,0,1,0,0|1,1,0]=4 2121 B11R2.2 c1csc(-c2nccs2)c1 Amb10601016 [0,1,0,1,0,0|0,2,0]=4 2122 B11R2.2 c1csc(-n2cccn2)c1 Amb20242320 [0,1,0,1,0,0|1,1,0]=4 2123 B11R2.2 c1nc(-c2cnco2)co1 Amb23437037 [0,1,0,1,0,0|2,0,0]=4 2124 B11R2.2 c1ncc(-c2ccsc2)o1 Amb23437042 [0,1,0,1,0,0|1,1,0]=4 2125 B11R2.2 c1ncc(-c2cnco2)o1 Amb23437038 [0,1,0,1,0,0|1,0,1]=4 2126 B11R2.2 c1ncc(-c2cncs2)o1 Amb23402877 [0,1,0,1,0,0|1,1,0]=4 2127 B11R2.2 c1ncc(-c2cscn2)o1 Amb23402875 [0,1,0,1,0,0|2,0,0]=4 2128 B11R2.11 O=C1CC(c2ccco2)N1 Amb27230866 [0,1,0,1,0,0|0,0,2]=4 2129 B11R2.106 Brc1cccc2c1CC=C2 Amb20247104 [0,1,0,1,0,0|2,0,0]=4 2130 B11R2.106 Brc1cccc2ccoc12 Amb10069261 [0,1,0,1,0,0|1,0,0]=3 2131 B11R2.106 Brc1cccc2ccsc12 Amb6572040 [0,1,0,1,0,0|1,1,0]=4 2132 B11R2.106 Brc1cccc2cnoc12 Amb19149301 [0,1,0,1,0,0|2,0,0]=4 2133 B11R2.106 Brc1cccc2ncoc12 Amb17570811 [0,1,0,1,0,0|2,0,0]=4 2134 B11R2.106 Brc1cccc2occc12 Amb16192002 [0,1,0,1,0,0|1,0,0]=3 2135 B11R2.106 Brc1cccc2ocnc12 Amb16185763 [0,1,0,1,0,0|2,0,0]=4 2136 B11R2.106 Brc1cccc2oncc12 Amb18187792 [0,1,0,1,0,0|2,0,0]=4 2137 B11R2.106 Brc1cccc2sccc12 Amb2447607 [0,1,0,1,0,0|1,1,0]=4 2138 B11R2.106 Brc1ccnc2ccoc12 Amb27419817 [0,1,0,1,0,0|1,0,0]=3 2139 B11R2.106 Brc1ccnc2ccsc12 Amb33526913 [0,1,0,1,0,0|1,1,0]=4 2140 B11R2.106 Brc1ccnc2cnoc12 Amb18187627 [0,1,0,1,0,0|2,0,0]=4 2141 B11R2.106 Brc1ccnc2ncoc12 Amb22723444 [0,1,0,1,0,0|2,0,0]=4 2142 B11R2.106 Brc1ccnc2oncc12 Amb22496305 [0,1,0,1,0,0|2,0,0]=4 2143 B11R2.106 Brc1ccnc2sccc12 Amb26893931 [0,1,0,1,0,0|1,1,0]=4 2144 B11R2.106 Brc1cncc2cccn12 Amb27180650 [0,1,0,1,0,0|2,0,0]=4 2145 B11R2.106 Brc1cncc2ccoc12 Amb18187811 [0,1,0,1,0,0|2,0,0]=4 2146 B11R2.106 Brc1cncc2sccc12 Amb27482692 [0,1,0,1,0,0|1,1,0]=4 2147 B11R2.106 Brc1nccc2ccoc12 Amb27823558 [0,1,0,1,0,0|2,0,0]=4 2148 B11R2.106 Brc1nccc2occc12 Amb18187770 [0,1,0,1,0,0|1,0,0]=3 2149 B11R2.106 Brc1nccc2ocnc12 Amb23400102 [0,1,0,1,0,0|2,0,0]=4 2150 B11R2.106 Brc1nccc2sccc12 Amb18771319 [0,1,0,1,0,0|1,1,0]=4 2151 B11R2.106 Cc1cccc2c1C=CC2 Amb22232331 [0,1,0,1,0,0|2,0,0]=4 2152 B11R2.106 Cc1cccc2c1CC=C2 Amb22406488 [0,1,0,1,0,0|2,0,0]=4 2153 B11R2.106 Cc1cccc2cccn12 Amb25887580 [0,1,0,1,0,0|2,0,0]=4 2154 B11R2.106 Cc1cccc2ccoc12 Amb2444982 [0,1,0,1,0,0|1,0,0]=3 2155 B11R2.106 Cc1cccc2ccsc12 Amb19419751 [0,1,0,1,0,0|1,1,0]=4 2156 B11R2.106 Cc1cccc2ncoc12 Amb17569953 [0,1,0,1,0,0|2,0,0]=4 2157 B11R2.106 Cc1cccc2sccc12 Amb21856961 [0,1,0,1,0,0|1,1,0]=4 2158 B11R2.106 Cc1cccn2cccc12 Amb28050188 [0,1,0,1,0,0|2,0,0]=4 2159 B11R2.106 Cc1ccnc2ccsc12 Amb27208137 [0,1,0,1,0,0|1,1,0]=4 2160 B11R2.106 Cc1ccnc2occc12 Amb23437177 [0,1,0,1,0,0|1,0,0]=3 2161 B11R2.106 Cc1ccnc2ocnc12 Amb18100554 [0,1,0,1,0,0|2,0,0]=4 2162 B11R2.106 Cc1nccc2cccn12 Amb26021699 [0,1,0,1,0,0|2,0,0]=4 2163 B11R2.106 Cc1nccc2occc12 Amb23585452 [0,1,0,1,0,0|1,0,0]=3 2164 B11R2.106 Clc1cccc2c1C=CC2 Amb27237036 [0,1,0,1,0,0|2,0,0]=4 2165 B11R2.106 Clc1cccc2c1CC=C2 Amb2383766 [0,1,0,1,0,0|2,0,0]=4 2166 B11R2.106 Clc1cccc2ccoc12 Amb21856195 [0,1,0,1,0,0|1,0,0]=3 2167 B11R2.106 Clc1cccc2ccsc12 Amb19516069 [0,1,0,1,0,0|1,1,0]=4 2168 B11R2.106 Clc1cccc2cnoc12 Amb22751081 [0,1,0,1,0,0|2,0,0]=4 2169 B11R2.106 Clc1cccc2ncoc12 Amb17570018 [0,1,0,1,0,0|2,0,0]=4 2170 B11R2.106 Clc1cccc2oncc12 Amb22497808 [0,1,0,1,0,0|2,0,0]=4 2171 B11R2.106 Clc1cccc2sccc12 Amb22586109 [0,1,0,1,0,0|1,1,0]=4 2172 B11R2.106 Clc1ccnc2ccoc12 Amb21960750 [0,1,0,1,0,0|1,0,0]=3 2173 B11R2.106 Clc1ccnc2ccsc12 Amb10067240 [0,1,0,1,0,0|1,1,0]=4 2174 B11R2.106 Clc1ccnc2ccsc12 Amb19958507 [0,1,0,1,0,0|1,1,0]=4 2175 B11R2.106 Clc1ccnc2ncoc12 Amb27958531 [0,1,0,1,0,0|2,0,0]=4 2176 B11R2.106 Clc1ccnc2occc12 Amb22002181 [0,1,0,1,0,0|1,0,0]=3 2177 B11R2.106 Clc1ccnc2sccc12 Amb22495454 [0,1,0,1,0,0|1,1,0]=4 2178 B11R2.106 Clc1cncc2sccc12 Amb25146335 [0,1,0,1,0,0|1,1,0]=4 2179 B11R2.106 Clc1nccc2cccn12 Amb25679656 [0,1,0,1,0,0|2,0,0]=4 2180 B11R2.106 Clc1nccc2ccoc12 Amb10067872 [0,1,0,1,0,0|2,0,0]=4 2181 B11R2.106 Clc1nccc2occc12 Amb19958464 [0,1,0,1,0,0|1,0,0]=3 2182 B11R2.106 Clc1nccc2occc12 Amb2724787 [0,1,0,1,0,0|1,0,0]=3 2183 B11R2.106 Clc1nccc2ocnc12 Amb23400113 [0,1,0,1,0,0|2,0,0]=4 2184 B11R2.106 Clc1nccc2sccc12 Amb8630210 [0,1,0,1,0,0|1,1,0]=4 2185 B11R2.106 Clc1ncnc2ccoc12 Amb19957778 [0,1,0,1,0,0|2,0,0]=4 2186 B11R2.106 Clc1ncnc2occc12 Amb10602706 [0,1,0,1,0,0|2,0,0]=4 2187 B11R2.106 Clc1nncc2occc12 Amb23454526 [0,1,0,1,0,0|2,0,0]=4 2188 B11R2.106 Fc1cccc2c1CC=C2 Amb2383767 [0,1,0,1,0,0|2,0,0]=4 2189 B11R2.106 Fc1cccc2ccoc12 Amb22372186 [0,1,0,1,0,0|1,0,0]=3 2190 B11R2.106 Fc1cccc2ccsc12 Amb22234737 [0,1,0,1,0,0|1,1,0]=4 2191 B11R2.106 Fc1cccc2cnoc12 Amb33493352 [0,1,0,1,0,0|2,0,0]=4 2192 B11R2.106 Fc1cccc2ncoc12 Amb17569957 [0,1,0,1,0,0|2,0,0]=4 2193 B11R2.106 Fc1cccc2occc12 Amb20241435 [0,1,0,1,0,0|1,0,0]=3 2194 B11R2.106 Fc1cccc2ocnc12 Amb28050333 [0,1,0,1,0,0|2,0,0]=4 2195 B11R2.106 Fc1cccc2oncc12 Amb22497809 [0,1,0,1,0,0|2,0,0]=4 2196 B11R2.106 Fc1cccc2sccc12 Amb20171578 [0,1,0,1,0,0|1,1,0]=4 2197 B11R2.106 Fc1cncc2ccoc12 Amb27444117 [0,1,0,1,0,0|2,0,0]=4 2198 B11R2.106 Fc1cncc2sccc12 Amb27624915 [0,1,0,1,0,0|1,1,0]=4 2199 B11R2.106 Fc1nccc2occc12 Amb33621245 [0,1,0,1,0,0|1,0,0]=3 2200 B11R2.106 Ic1cccc2ccoc12 Amb23401835 [0,1,0,1,0,0|1,0,0]=3 2201 B11R2.106 Ic1cccc2ccsc12 Amb26974076 [0,1,0,1,0,0|1,1,0]=4 2202 B11R2.106 Ic1cccc2ocnc12 Amb22736067 [0,1,0,1,0,0|2,0,0]=4 2203 B11R2.106 Ic1ccnc2ccsc12 Amb25686647 [0,1,0,1,0,0|1,1,0]=4 2204 B11R2.106 Ic1ccnc2occc12 Amb30869427 [0,1,0,1,0,0|1,0,0]=3 2205 B11R2.106 Ic1ccnc2sccc12 Amb28051587 [0,1,0,1,0,0|1,1,0]=4 2206 B11R2.106 Ic1nccc2sccc12 Amb22500106 [0,1,0,1,0,0|1,1,0]=4 2207 B11R2.106 Nc1cccc2c1CC=C2 Amb24539420 [0,1,0,1,0,0|2,0,0]=4 2208 B11R2.106 Nc1cccc2ccoc12 Amb15772371 [0,1,0,1,0,0|1,0,0]=3 2209 B11R2.106 Nc1cccc2ccoc12 Amb31291351 [0,1,0,1,0,0|1,0,0]=3 2210 B11R2.106 Nc1cccc2ccsc12 Amb17570001 [0,1,0,1,0,0|1,1,0]=4 2211 B11R2.106 Nc1cccc2ccsc12 Amb28555542 [0,1,0,1,0,0|1,1,0]=4 2212 B11R2.106 Nc1cccc2cnoc12 Amb22233975 [0,1,0,1,0,0|2,0,0]=4 2213 B11R2.106 Nc1cccc2ncoc12 Amb17231888 [0,1,0,1,0,0|2,0,0]=4 2214 B11R2.106 Nc1cccc2occc12 Amb17569954 [0,1,0,1,0,0|1,0,0]=3 2215 B11R2.106 Nc1cccc2occc12 Amb35750149 [0,1,0,1,0,0|1,0,0]=3 2216 B11R2.106 Nc1cccc2ocnc12 Amb2433128 [0,1,0,1,0,0|2,0,0]=4 2217 B11R2.106 Nc1cccc2ocnc12 Amb30586492 [0,1,0,1,0,0|2,0,0]=4 2218 B11R2.106 Nc1cccc2oncc12 Amb22495450 [0,1,0,1,0,0|2,0,0]=4 2219 B11R2.106 Nc1cccc2sccc12 Amb22499707 [0,1,0,1,0,0|1,1,0]=4 2220 B11R2.106 Nc1cccc2sccc12 Amb8439504 [0,1,0,1,0,0|1,1,0]=4 2221 B11R2.106 Nc1cccn2cccc12 Amb25763072 [0,1,0,1,0,0|2,0,0]=4 2222 B11R2.106 Nc1ccnc2ccsc12 Amb18644432 [0,1,0,1,0,0|1,1,0]=4 2223 B11R2.106 Nc1ccnc2ccsc12 Amb33484377 [0,1,0,1,0,0|1,1,0]=4 2224 B11R2.106 Nc1ccnc2occc12 Amb28286823 [0,1,0,1,0,0|1,0,0]=3 2225 B11R2.106 Nc1ccnc2ocnc12 Amb27438681 [0,1,0,1,0,0|2,0,0]=4 2226 B11R2.106 Nc1ccnc2oncc12 Amb27193848 [0,1,0,1,0,0|2,0,0]=4 2227 B11R2.106 Nc1ccnn2cccc12 Amb23439913 [0,1,0,1,0,0|2,0,0]=4 2228 B11R2.106 Nc1cncc2ccoc12 Amb27193901 [0,1,0,1,0,0|2,0,0]=4 2229 B11R2.106 Nc1cncc2sccc12 Amb27424771 [0,1,0,1,0,0|1,1,0]=4 2230 B11R2.106 Nc1nccc2occc12 Amb23590989 [0,1,0,1,0,0|1,0,0]=3 2231 B11R2.106 Nc1nccc2sccc12 Amb9380596 [0,1,0,1,0,0|1,1,0]=4 2232 B11R2.106 Nc1ncnc2occc12 Amb18203124 [0,1,0,1,0,0|2,0,0]=4 2233 B11R2.106 Nc1nncc2occc12 Amb23560298 [0,1,0,1,0,0|2,0,0]=4 2234 B11R2.106 O=C1C=CC=C2CC=CN12 Amb27438668 [0,1,0,1,0,0|1,0,1]=4 2235 B11R2.106 O=C1C=CN=C2SC=CN12 Amb19550090 [0,1,0,1,0,0|1,1,0]=4 2236 B11R2.106 O=C1C=CNc2ccnn21 Amb21959331 [0,1,0,1,0,0|2,0,0]=4 2237 B11R2.106 O=C1C=CNc2cscc21 Amb27411994 [0,1,0,1,0,0|2,0,0]=4 2238 B11R2.106 O=C1C=CNc2nccn21 Amb21927565 [0,1,0,1,0,0|2,0,0]=4 2239 B11R2.106 O=C1C=CNn2cccc21 Amb21960733 [0,1,0,1,0,0|2,0,0]=4 2240 B11R2.106 O=C1C=CNn2nccc21 Amb27972907 [0,1,0,1,0,0|2,0,0]=4 2241 B11R2.106 O=C1C=CSc2nccn21 Amb28400092 [0,1,0,1,0,0|2,0,0]=4 2242 B11R2.106 O=C1C=CSc2sccc21 Amb25146412 [0,1,0,1,0,0|0,1,0]=3 2243 B11R2.106 O=C1CCCc2occc21 Amb2427525 [0,1,0,1,0,0|0,0,2]=4 2244 B11R2.106 O=C1CCNc2occc21 Amb18832409 [0,1,0,1,0,0|0,0,2]=4 2245 B11R2.106 O=C1CNCc2occc21 Amb18832394 [0,1,0,1,0,0|0,0,2]=4 2246 B11R2.106 O=C1CSCc2occc21 Amb28141634 [0,1,0,1,0,0|0,0,2]=4 2247 B11R2.106 O=C1N=CC=C2NC=CN12 Amb19882322 [0,1,0,1,0,0|2,0,0]=4 2248 B11R2.106 O=C1N=CNc2sccc21 Amb22371621 [0,1,0,1,0,0|1,1,0]=4 2249 B11R2.106 O=C1NC=CC2=C1CCO2 Amb27235024 [0,1,0,1,0,0|0,0,2]=4 2250 B11R2.106 O=C1NC=CC2=NC=CC12 Amb27668194 [0,1,0,1,0,0|1,0,1]=4 2251 B11R2.106 O=C1NC=Cc2ccoc21 Amb21927943 [0,1,0,1,0,0|2,0,0]=4 2252 B11R2.106 O=C1NC=Cc2ccsc21 Amb22235448 [0,1,0,1,0,0|2,0,0]=4 2253 B11R2.106 O=C1NC=Cc2cscc21 Amb27838096 [0,1,0,1,0,0|2,0,0]=4 2254 B11R2.106 O=C1NC=Cc2nccn21 Amb22352382 [0,1,0,1,0,0|2,0,0]=4 2255 B11R2.106 O=C1NC=Cc2occc21 Amb19267112 [0,1,0,1,0,0|0,0,0]=2 2256 B11R2.106 O=C1NC=Cn2cccc21 Amb19515808 [0,1,0,1,0,0|2,0,0]=4 2257 B11R2.106 O=C1NC=Cn2nccc21 Amb22435243 [0,1,0,1,0,0|2,0,0]=4 2258 B11R2.106 O=C1NC=Nc2ccoc21 Amb22234742 [0,1,0,1,0,0|2,0,0]=4 2259 B11R2.106 O=C1NC=Nc2occc21 Amb22371686 [0,1,0,1,0,0|1,0,0]=3 2260 B11R2.106 O=C1NC=Nc2sccc21 Amb18031834 [0,1,0,1,0,0|1,1,0]=4 2261 B11R2.106 O=C1NCCc2occc21 Amb23585450 [0,1,0,1,0,0|0,0,2]=4 2262 B11R2.106 O=C1NN=Cc2cccn21 Amb22032554 [0,1,0,1,0,0|2,0,0]=4 2263 B11R2.106 O=C1NN=Cc2sccc21 Amb32686602 [0,1,0,1,0,0|1,1,0]=4 2264 B11R2.106 O=C1NNC=C2N=CC=C12 Amb27982183 [0,1,0,1,0,0|2,0,0]=4 2265 B11R2.106 O=c1nccc2ncnc12 Amb4010214 [0,1,0,1,0,0|2,0,0]=4 2266 B11R2.106 Oc1cccc2c1C=CC2 Amb26875548 [0,1,0,1,0,0|1,0,1]=4 2267 B11R2.106 Oc1cccc2ccoc12 Amb10070901 [0,1,0,1,0,0|1,0,0]=3 2268 B11R2.106 Oc1cccc2ccsc12 Amb18644431 [0,1,0,1,0,0|1,1,0]=4 2269 B11R2.106 Oc1cccc2cnoc12 Amb15701577 [0,1,0,1,0,0|2,0,0]=4 2270 B11R2.106 Oc1cccc2ncoc12 Amb26949852 [0,1,0,1,0,0|2,0,0]=4 2271 B11R2.106 Oc1cccc2occc12 Amb18124403 [0,1,0,1,0,0|0,0,1]=3 2272 B11R2.106 Oc1cccc2ocnc12 Amb10603972 [0,1,0,1,0,0|1,0,1]=4 2273 B11R2.106 Oc1cccc2oncc12 Amb23437223 [0,1,0,1,0,0|1,0,1]=4 2274 B11R2.106 Oc1cccc2sccc12 Amb18125084 [0,1,0,1,0,0|0,1,1]=4 2275 B11R2.106 Oc1ccnc2ccoc12 Amb33624225 [0,1,0,1,0,0|1,0,0]=3 2276 B11R2.106 Oc1ccnc2ccsc12 Amb3941569 [0,1,0,1,0,0|1,1,0]=4 2277 B11R2.106 Oc1ccnc2occc12 Amb27225150 [0,1,0,1,0,0|0,0,1]=3 2278 B11R2.106 Oc1ccnc2sccc12 Amb18644462 [0,1,0,1,0,0|0,1,1]=4 2279 B11R2.106 Oc1cncc2ccoc12 Amb28250077 [0,1,0,1,0,0|2,0,0]=4 2280 B11R2.106 Oc1cncc2sccc12 Amb18644464 [0,1,0,1,0,0|0,1,1]=4 2281 B11R2.106 Oc1nccc2sccc12 Amb21856975 [0,1,0,1,0,0|0,1,1]=4 2282 B11R2.106 Oc1nncc2occc12 Amb23560302 [0,1,0,1,0,0|1,0,1]=4 2283 B11R2.106 S=C1NC=Cc2occc21 Amb25939581 [0,1,0,1,0,0|0,1,0]=3 2284 B11R2.106 Sc1cccc2ocnc12 Amb27971096 [0,1,0,1,0,0|1,1,0]=4 2285 B11R2.106 Sc1ccnc2ccsc12 Amb27193432 [0,1,0,1,0,0|1,1,0]=4 2286 B11R2.106 [O-][n+]1cccc2ccoc21 Amb22234598 [0,1,0,1,0,0|2,0,0]=4 2287 B11R2.106 [O-][n+]1cccc2occc21 Amb13883494 [0,1,0,1,0,0|0,0,1]=3 2288 B11R2.10 BrC1=Cc2ccccc2C1 Amb8517387 [0,1,0,1,0,0|2,0,0]=4 2289 B11R2.10 Brc1cc2ccccc2o1 Amb2723106 [0,1,0,1,0,0|1,0,0]=3 2290 B11R2.10 Brc1cc2ccccc2s1 Amb2723178 [0,1,0,1,0,0|1,1,0]=4 2291 B11R2.10 Brc1cc2ccccn2c1 Amb27591844 [0,1,0,1,0,0|2,0,0]=4 2292 B11R2.10 Brc1cc2cnccc2o1 Amb18187766 [0,1,0,1,0,0|2,0,0]=4 2293 B11R2.10 Brc1cc2ncccc2o1 Amb25133797 [0,1,0,1,0,0|1,0,0]=3 2294 B11R2.10 Brc1cc2ncccc2o1 Amb32683420 [0,1,0,1,0,0|1,0,0]=3 2295 B11R2.10 Brc1cc2ncccc2s1 Amb18771328 [0,1,0,1,0,0|1,1,0]=4 2296 B11R2.10 Brc1cc2ncncc2o1 Amb18811031 [0,1,0,1,0,0|2,0,0]=4 2297 B11R2.10 Brc1nc2ccccc2o1 Amb19054929 [0,1,0,1,0,0|2,0,0]=4 2298 B11R2.10 CC1=Cc2ccccc2C1 Amb15692403 [0,1,0,1,0,0|2,0,0]=4 2299 B11R2.10 Cc1cc2ccccc2o1 Amb20621560 [0,1,0,1,0,0|1,0,0]=3 2300 B11R2.10 Cc1cc2ccccc2s1 Amb2237023 [0,1,0,1,0,0|1,1,0]=4 2301 B11R2.10 Cc1cc2ccccn2c1 Amb22264777 [0,1,0,1,0,0|2,0,0]=4 2302 B11R2.10 Cc1cc2cccnc2o1 Amb25299352 [0,1,0,1,0,0|2,0,0]=4 2303 B11R2.10 Cc1cc2cnccc2o1 Amb23590993 [0,1,0,1,0,0|2,0,0]=4 2304 B11R2.10 Cc1nc2ccccc2o1 Amb2599323 [0,1,0,1,0,0|2,0,0]=4 2305 B11R2.10 Cc1nc2ncccc2o1 Amb2433107 [0,1,0,1,0,0|2,0,0]=4 2306 B11R2.10 ClC1=Cc2ccccc2C1 Amb22752069 [0,1,0,1,0,0|2,0,0]=4 2307 B11R2.10 Clc1cc2ccccc2o1 Amb24104234 [0,1,0,1,0,0|1,0,0]=3 2308 B11R2.10 Clc1cc2ccccn2c1 Amb27209850 [0,1,0,1,0,0|2,0,0]=4 2309 B11R2.10 Clc1cc2ccncc2o1 Amb28126707 [0,1,0,1,0,0|2,0,0]=4 2310 B11R2.10 Clc1cc2ncccc2s1 Amb22494669 [0,1,0,1,0,0|1,1,0]=4 2311 B11R2.10 Clc1nc2ccccc2o1 Amb1106378 [0,1,0,1,0,0|2,0,0]=4 2312 B11R2.10 Clc1nc2ncccc2o1 Amb21857472 [0,1,0,1,0,0|2,0,0]=4 2313 B11R2.10 Clc1nc2ncccc2o1 Amb23439056 [0,1,0,1,0,0|2,0,0]=4 2314 B11R2.10 Ic1cc2ccccc2o1 Amb24482100 [0,1,0,1,0,0|1,0,0]=3 2315 B11R2.10 Ic1cc2ccccc2s1 Amb22896395 [0,1,0,1,0,0|1,1,0]=4 2316 B11R2.10 Ic1nc2ncccc2o1 Amb28369829 [0,1,0,1,0,0|2,0,0]=4 2317 B11R2.10 Nc1cc2ccccc2s1 Amb17593717 [0,1,0,1,0,0|1,1,0]=4 2318 B11R2.10 Nc1cc2cnccc2o1 Amb18203158 [0,1,0,1,0,0|2,0,0]=4 2319 B11R2.10 Nc1cc2ncccc2s1 Amb18201882 [0,1,0,1,0,0|1,1,0]=4 2320 B11R2.10 Nc1nc2ccccc2o1 Amb1153977 [0,1,0,1,0,0|2,0,0]=4 2321 B11R2.10 Nc1nc2ncccc2o1 Amb6754298 [0,1,0,1,0,0|2,0,0]=4 2322 B11R2.10 O=C1C=C2C=CC=CC2=N1 Amb24620213 [0,1,0,1,0,0|2,0,0]=4 2323 B11R2.10 O=C1C=C2C=COC=C2O1 Amb19132425 [0,1,0,1,0,0|2,0,0]=4 2324 B11R2.10 O=C1Cc2ccccc2O1 Amb2781615 [0,1,0,1,0,0|1,0,1]=4 2325 B11R2.10 O=C1Nc2ccccc2O1 Amb18043097 [0,1,0,1,0,0|2,0,0]=4 2326 B11R2.10 O=C1Nc2ncccc2O1 Amb17933371 [0,1,0,1,0,0|2,0,0]=4 2327 B11R2.10 O=C1Oc2ccccc2O1 Amb19514273 [0,1,0,1,0,0|2,0,0]=4 2328 B11R2.10 Oc1cc2ccccc2s1 Amb24518934 [0,1,0,1,0,0|1,1,0]=4 2329 B11R2.10 Oc1cc2ccccn2c1 Amb27841533 [0,1,0,1,0,0|2,0,0]=4 2330 B11R2.10 Oc1cc2ncccc2o1 Amb28385482 [0,1,0,1,0,0|1,0,0]=3 2331 B11R2.10 Oc1nc2ncccc2o1 Amb17949727 [0,1,0,1,0,0|2,0,0]=4 2332 B11R2.10 S=C1Nc2ccccc2O1 Amb18799383 [0,1,0,1,0,0|2,0,0]=4 2333 B11R2.10 S=C1Nc2ncccc2O1 Amb19895098 [0,1,0,1,0,0|2,0,0]=4 2334 B11R2.10 S=C1Oc2ccccc2O1 Amb22363540 [0,1,0,1,0,0|2,0,0]=4 2335 B11R2.10 S=C1Oc2ccccc2S1 Amb27839135 [0,1,0,1,0,0|2,0,0]=4 2336 B11R2.10 Sc1cc2ccccc2s1 Amb24105482 [0,1,0,1,0,0|1,1,0]=4 2337 B11R2.10 Sc1nc2ccccc2o1 Amb17570013 [0,1,0,1,0,0|2,0,0]=4 2338 B11R2.10 Sc1nc2ncccc2o1 Amb1091182 [0,1,0,1,0,0|2,0,0]=4 2339 B11R2.10 [SH3]c1nc2ccccc2o1 Amb18046725 [0,1,0,1,0,0|2,0,0]=4 2340 B11R2.66 Cc1cc2c(o1)CCC2=O Amb18832478 [0,1,0,1,0,0|0,0,2]=4 2341 B11R2.66 O=C1C=Cc2cc(Br)cn21 Amb28315893 [0,1,0,1,0,0|1,0,0]=3 2342 B11R2.66 O=C1CCc2oc(Br)cc21 Amb18810385 [0,1,0,1,0,0|0,0,2]=4 2343 B11R2.66 O=C1CNc2oc(Br)cc21 Amb18787303 [0,1,0,1,0,0|1,0,1]=4 2344 B11R2.67 Cc1ncc2n1C(=O)C=C2 Amb27251584 [0,1,0,1,0,0|2,0,0]=4 2345 B11R2.7 O=C1C=CC1n2cccc2 Amb25945277 [0,1,0,1,0,0|2,0,0]=4 2346 B11R2.18 C1=CN=C2OC=CN2C=C1 Amb28423061 [0,1,0,1,0,0|2,0,0]=4 2347 B11R2.18 C1=CNc2cccn2C=C1 Amb27590224 [0,1,0,1,0,0|2,0,0]=4 2348 B11R2.18 c1ccc-2cccc2cc1 Amb18511836 [0,1,0,1,0,0|2,0,0]=4 2349 B11R2.18 c1ccc2ccnc2cc1 Amb27620192 [0,1,0,1,0,0|2,0,0]=4 2350 B11R2.191 O=CC1CCc2occc21 Amb18832479 [0,1,0,1,0,0|0,0,2]=4 2351 B11R2.191 O=Cc1cnc2ncnc12 Amb18203132 [0,1,0,1,0,0|2,0,0]=4 2352 B11R2.191 O=Cc1cnc2oncn12 Amb18832414 [0,1,0,1,0,0|2,0,0]=4 2353 B11R2.191 O=Cc1cnc2sccn12 Amb17215482 [0,1,0,1,0,0|1,1,0]=4 2354 B11R2.191 O=Cc1csc2c1OCO2 Amb18830796 [0,1,0,1,0,0|1,0,1]=4 2355 B11R2.191 O=Cc1csc2ccoc12 Amb18139527 [0,1,0,1,0,0|2,0,0]=4 2356 B11R2.191 O=Cc1csc2sccc12 Amb18199115 [0,1,0,1,0,0|0,1,0]=3 2357 B11R2.191 O=Cc1css2sccc12 Amb28049953 [0,1,0,1,0,0|1,1,0]=4 2358 B11R2.191 O=Cc1ncc2sccn12 Amb18831207 [0,1,0,1,0,0|1,1,0]=4 2359 B11R2.191 O=Cc1scc2c1OCO2 Amb18830798 [0,1,0,1,0,0|1,0,1]=4 2360 B11R2.8 C=C1Cc2sccc2C1=O Amb18561540 [0,1,0,1,0,0|0,1,1]=4 2361 B11R2.8 CC1=Nc2sccc2C1=O Amb5721189 [0,1,0,1,0,0|1,1,0]=4 2362 B11R2.15 NCc1cc2occc2s1 Amb19515683 [0,1,0,1,0,0|1,0,1]=4 2363 B11R2.15 O=CC1Cc2ccoc2C1 Amb18832480 [0,1,0,1,0,0|0,0,2]=4 2364 B11R2.15 O=Cc1cc2c(s1)OCO2 Amb18830797 [0,1,0,1,0,0|1,0,1]=4 2365 B11R2.15 O=Cc1cc2ccnc2n1 Amb27488076 [0,1,0,1,0,0|2,0,0]=4 2366 B11R2.15 O=Cc1cc2ccsc2o1 Amb27839409 [0,1,0,1,0,0|1,1,0]=4 2367 B11R2.15 O=Cc1cc2ccsc2s1 Amb4140122 [0,1,0,1,0,0|1,1,0]=4 2368 B11R2.15 O=Cc1cc2cscc2s1 Amb24722245 [0,1,0,1,0,0|2,0,0]=4 2369 B11R2.15 O=Cc1cc2ncnc2n1 Amb27782476 [0,1,0,1,0,0|2,0,0]=4 2370 B11R2.15 O=Cc1cc2ncoc2s1 Amb18831154 [0,1,0,1,0,0|2,0,0]=4 2371 B11R2.15 O=Cc1cc2oncc2o1 Amb18832420 [0,1,0,1,0,0|1,0,0]=3 2372 B11R2.15 O=Cc1cc2oncc2s1 Amb18831159 [0,1,0,1,0,0|1,0,0]=3 2373 B11R2.15 O=Cc1cc2sccc2s1 Amb2611536 [0,1,0,1,0,0|0,1,0]=3 2374 B11R2.15 O=Cc1cc2sccn2c1 Amb28315767 [0,1,0,1,0,0|1,1,0]=4 2375 B11R2.15 O=Cc1cc2scnc2s1 Amb28049890 [0,1,0,1,0,0|1,1,0]=4 2376 B11R2.36 Brc1cc2occc2cn1 Amb18187805 [0,1,0,1,0,0|2,0,0]=4 2377 B11R2.36 Brc1ccc2c(c1)C=CC2 Amb2383763 [0,1,0,1,0,0|2,0,0]=4 2378 B11R2.36 Brc1ccc2c(c1)CC=C2 Amb22002296 [0,1,0,1,0,0|2,0,0]=4 2379 B11R2.36 Brc1ccc2cccn2c1 Amb26991571 [0,1,0,1,0,0|2,0,0]=4 2380 B11R2.36 Brc1ccc2ccoc2c1 Amb16192026 [0,1,0,1,0,0|1,0,0]=3 2381 B11R2.36 Brc1ccc2ccoc2n1 Amb23437182 [0,1,0,1,0,0|2,0,0]=4 2382 B11R2.36 Brc1ccc2ccsc2c1 Amb10975970 [0,1,0,1,0,0|1,1,0]=4 2383 B11R2.36 Brc1ccc2cnoc2c1 Amb18187784 [0,1,0,1,0,0|2,0,0]=4 2384 B11R2.36 Brc1ccc2ncoc2c1 Amb10602229 [0,1,0,1,0,0|2,0,0]=4 2385 B11R2.36 Brc1ccc2occc2c1 Amb2694966 [0,1,0,1,0,0|1,0,0]=3 2386 B11R2.36 Brc1ccc2occc2n1 Amb18187816 [0,1,0,1,0,0|1,0,0]=3 2387 B11R2.36 Brc1ccc2ocnc2c1 Amb3941364 [0,1,0,1,0,0|2,0,0]=4 2388 B11R2.36 Brc1ccc2ocnc2n1 Amb25782928 [0,1,0,1,0,0|2,0,0]=4 2389 B11R2.36 Brc1ccc2oncc2c1 Amb19957546 [0,1,0,1,0,0|2,0,0]=4 2390 B11R2.36 Brc1ccc2sccc2c1 Amb2447430 [0,1,0,1,0,0|1,1,0]=4 2391 B11R2.36 Brc1ccc2sccc2n1 Amb18769649 [0,1,0,1,0,0|1,1,0]=4 2392 B11R2.36 Brc1cnc2cnoc2c1 Amb33493359 [0,1,0,1,0,0|2,0,0]=4 2393 B11R2.36 Brc1cnc2ncoc2c1 Amb18100434 [0,1,0,1,0,0|2,0,0]=4 2394 B11R2.36 Brc1cnc2occc2c1 Amb4560959 [0,1,0,1,0,0|2,0,0]=4 2395 B11R2.36 C[n+]1ccc2ccoc2c1 Amb27230410 [0,1,0,1,0,0|2,0,0]=4 2396 B11R2.36 Cc1ccc2[se]ccc2n1 Amb2611593 [0,1,0,1,0,0|1,1,0]=4 2397 B11R2.36 Cc1ccc2c(c1)C=CC2 Amb24062964 [0,1,0,1,0,0|2,0,0]=4 2398 B11R2.36 Cc1ccc2c(c1)CC=C2 Amb28204212 [0,1,0,1,0,0|2,0,0]=4 2399 B11R2.36 Cc1ccc2cccn2c1 Amb22490217 [0,1,0,1,0,0|2,0,0]=4 2400 B11R2.36 Cc1ccc2ccoc2c1 Amb22039412 [0,1,0,1,0,0|1,0,0]=3 2401 B11R2.36 Cc1ccc2ccsc2c1 Amb10603775 [0,1,0,1,0,0|1,1,0]=4 2402 B11R2.36 Cc1ccc2cnoc2c1 Amb22002117 [0,1,0,1,0,0|2,0,0]=4 2403 B11R2.36 Cc1ccc2ncoc2c1 Amb6875051 [0,1,0,1,0,0|2,0,0]=4 2404 B11R2.36 Cc1ccc2occc2c1 Amb22751743 [0,1,0,1,0,0|1,0,0]=3 2405 B11R2.36 Cc1ccc2occc2n1 Amb26844414 [0,1,0,1,0,0|1,0,0]=3 2406 B11R2.36 Cc1ccc2ocnc2c1 Amb2433105 [0,1,0,1,0,0|2,0,0]=4 2407 B11R2.36 Cc1ccc2ocnc2n1 Amb27641147 [0,1,0,1,0,0|2,0,0]=4 2408 B11R2.36 Cc1ccc2oncc2c1 Amb27975667 [0,1,0,1,0,0|2,0,0]=4 2409 B11R2.36 Cc1ccc2sccc2c1 Amb2689331 [0,1,0,1,0,0|1,1,0]=4 2410 B11R2.36 Cc1ccn2cccc2c1 Amb24670240 [0,1,0,1,0,0|2,0,0]=4 2411 B11R2.36 Cc1cnc2ccoc2c1 Amb27478517 [0,1,0,1,0,0|1,0,0]=3 2412 B11R2.36 Cc1cnc2ccsc2c1 Amb28342766 [0,1,0,1,0,0|1,1,0]=4 2413 B11R2.36 Cc1cnc2occc2c1 Amb23403003 [0,1,0,1,0,0|2,0,0]=4 2414 B11R2.36 Clc1cc2ccoc2cn1 Amb27756425 [0,1,0,1,0,0|2,0,0]=4 2415 B11R2.36 Clc1cc2occc2cn1 Amb27265954 [0,1,0,1,0,0|2,0,0]=4 2416 B11R2.36 Clc1ccc2c(c1)C=CC2 Amb2383761 [0,1,0,1,0,0|2,0,0]=4 2417 B11R2.36 Clc1ccc2c(c1)CC=C2 Amb26349302 [0,1,0,1,0,0|2,0,0]=4 2418 B11R2.36 Clc1ccc2ccoc2n1 Amb23437178 [0,1,0,1,0,0|2,0,0]=4 2419 B11R2.36 Clc1ccc2ccsc2c1 Amb24091106 [0,1,0,1,0,0|1,1,0]=4 2420 B11R2.36 Clc1ccc2cnoc2c1 Amb24073976 [0,1,0,1,0,0|2,0,0]=4 2421 B11R2.36 Clc1ccc2ncoc2c1 Amb9783095 [0,1,0,1,0,0|2,0,0]=4 2422 B11R2.36 Clc1ccc2occc2c1 Amb20248132 [0,1,0,1,0,0|1,0,0]=3 2423 B11R2.36 Clc1ccc2occc2n1 Amb21864771 [0,1,0,1,0,0|1,0,0]=3 2424 B11R2.36 Clc1ccc2ocnc2c1 Amb2747117 [0,1,0,1,0,0|2,0,0]=4 2425 B11R2.36 Clc1ccc2ocnc2n1 Amb27958509 [0,1,0,1,0,0|2,0,0]=4 2426 B11R2.36 Clc1ccc2oncc2c1 Amb22495862 [0,1,0,1,0,0|2,0,0]=4 2427 B11R2.36 Clc1ccc2sccc2c1 Amb8629060 [0,1,0,1,0,0|1,1,0]=4 2428 B11R2.36 Clc1ccc2sccc2n1 Amb21962456 [0,1,0,1,0,0|1,1,0]=4 2429 B11R2.36 Clc1cnc2c(c1)CC=C2 Amb27453570 [0,1,0,1,0,0|2,0,0]=4 2430 B11R2.36 Clc1cnc2ccoc2c1 Amb13890158 [0,1,0,1,0,0|1,0,0]=3 2431 B11R2.36 Clc1cnc2ccsc2c1 Amb27642568 [0,1,0,1,0,0|1,1,0]=4 2432 B11R2.36 Clc1cnc2ncoc2c1 Amb26456899 [0,1,0,1,0,0|2,0,0]=4 2433 B11R2.36 Clc1cnc2occc2c1 Amb25256318 [0,1,0,1,0,0|2,0,0]=4 2434 B11R2.36 Clc1ncc2occc2n1 Amb23402944 [0,1,0,1,0,0|2,0,0]=4 2435 B11R2.36 Fc1ccc2c(c1)C=CC2 Amb2383762 [0,1,0,1,0,0|2,0,0]=4 2436 B11R2.36 Fc1ccc2c(c1)CC=C2 Amb25927316 [0,1,0,1,0,0|2,0,0]=4 2437 B11R2.36 Fc1ccc2ccoc2c1 Amb27636754 [0,1,0,1,0,0|1,0,0]=3 2438 B11R2.36 Fc1ccc2ncoc2c1 Amb24463817 [0,1,0,1,0,0|2,0,0]=4 2439 B11R2.36 Fc1ccc2occc2c1 Amb20241175 [0,1,0,1,0,0|1,0,0]=3 2440 B11R2.36 Fc1ccc2ocnc2c1 Amb10841895 [0,1,0,1,0,0|2,0,0]=4 2441 B11R2.36 Fc1ccc2oncc2c1 Amb22495874 [0,1,0,1,0,0|2,0,0]=4 2442 B11R2.36 Fc1ccc2sccc2c1 Amb19958720 [0,1,0,1,0,0|1,1,0]=4 2443 B11R2.36 Ic1ccc2c(c1)C=CC2 Amb25313198 [0,1,0,1,0,0|2,0,0]=4 2444 B11R2.36 Ic1ccc2ccoc2c1 Amb23401822 [0,1,0,1,0,0|1,0,0]=3 2445 B11R2.36 Ic1ccc2cnoc2c1 Amb27656210 [0,1,0,1,0,0|2,0,0]=4 2446 B11R2.36 Ic1ccc2occc2c1 Amb23401832 [0,1,0,1,0,0|1,0,0]=3 2447 B11R2.36 Ic1ccc2occc2n1 Amb24760836 [0,1,0,1,0,0|1,0,0]=3 2448 B11R2.36 Ic1ccc2ocnc2c1 Amb22737648 [0,1,0,1,0,0|2,0,0]=4 2449 B11R2.36 Ic1ccc2oncc2c1 Amb24392287 [0,1,0,1,0,0|2,0,0]=4 2450 B11R2.36 Ic1ccc2sccc2c1 Amb24062930 [0,1,0,1,0,0|1,1,0]=4 2451 B11R2.36 Ic1cnc2ccoc2c1 Amb13890154 [0,1,0,1,0,0|1,0,0]=3 2452 B11R2.36 Nc1cc2occc2cn1 Amb18832517 [0,1,0,1,0,0|2,0,0]=4 2453 B11R2.36 Nc1ccc2ccoc2c1 Amb18137748 [0,1,0,1,0,0|1,0,0]=3 2454 B11R2.36 Nc1ccc2ccoc2c1 Amb32661636 [0,1,0,1,0,0|1,0,0]=3 2455 B11R2.36 Nc1ccc2ccsc2c1 Amb30633689 [0,1,0,1,0,0|1,1,0]=4 2456 B11R2.36 Nc1ccc2ccsc2c1 Amb8439505 [0,1,0,1,0,0|1,1,0]=4 2457 B11R2.36 Nc1ccc2cnoc2c1 Amb10603847 [0,1,0,1,0,0|2,0,0]=4 2458 B11R2.36 Nc1ccc2ncoc2c1 Amb2724961 [0,1,0,1,0,0|2,0,0]=4 2459 B11R2.36 Nc1ccc2occc2c1 Amb2425577 [0,1,0,1,0,0|1,0,0]=3 2460 B11R2.36 Nc1ccc2occc2n1 Amb24445845 [0,1,0,1,0,0|1,0,0]=3 2461 B11R2.36 Nc1ccc2ocnc2c1 Amb2433112 [0,1,0,1,0,0|2,0,0]=4 2462 B11R2.36 Nc1ccc2ocnc2n1 Amb27812068 [0,1,0,1,0,0|2,0,0]=4 2463 B11R2.36 Nc1ccc2oncc2c1 Amb21927333 [0,1,0,1,0,0|2,0,0]=4 2464 B11R2.36 Nc1ccc2oncc2n1 Amb18203126 [0,1,0,1,0,0|2,0,0]=4 2465 B11R2.36 Nc1ccc2sccc2c1 Amb33526381 [0,1,0,1,0,0|1,1,0]=4 2466 B11R2.36 Nc1ccc2sccc2c1 Amb482302 [0,1,0,1,0,0|1,1,0]=4 2467 B11R2.36 Nc1cnc2ccsc2c1 Amb19374072 [0,1,0,1,0,0|1,1,0]=4 2468 B11R2.36 Nc1cnc2ccsc2c1 Amb31217501 [0,1,0,1,0,0|1,1,0]=4 2469 B11R2.36 Nc1cnc2ncoc2c1 Amb18100408 [0,1,0,1,0,0|2,0,0]=4 2470 B11R2.36 Nc1cnc2occc2c1 Amb22496271 [0,1,0,1,0,0|2,0,0]=4 2471 B11R2.36 O=C1C=CN2NC=CC2=C1 Amb25764723 [0,1,0,1,0,0|2,0,0]=4 2472 B11R2.36 O=C1C=Cc2ccsc2N1 Amb24417184 [0,1,0,1,0,0|2,0,0]=4 2473 B11R2.36 O=C1C=Cc2nccn2N1 Amb22388527 [0,1,0,1,0,0|2,0,0]=4 2474 B11R2.36 O=C1C=Cc2nocc2C1 Amb27962578 [0,1,0,1,0,0|2,0,0]=4 2475 B11R2.36 O=C1C=Cc2sccc2N1 Amb28206306 [0,1,0,1,0,0|0,1,0]=3 2476 B11R2.36 O=C1C=Cn2nccc2N1 Amb21927423 [0,1,0,1,0,0|2,0,0]=4 2477 B11R2.36 O=c1ccc2ccsc2o1 Amb5720014 [0,1,0,1,0,0|2,0,0]=4 2478 B11R2.36 O=c1ccc2sccc2o1 Amb5719894 [0,1,0,1,0,0|0,1,0]=3 2479 B11R2.36 Oc1ccc2c(c1)C=CC2 Amb18124353 [0,1,0,1,0,0|1,0,1]=4 2480 B11R2.36 Oc1ccc2ccoc2c1 Amb18124404 [0,1,0,1,0,0|1,0,0]=3 2481 B11R2.36 Oc1ccc2ccsc2c1 Amb18644429 [0,1,0,1,0,0|1,1,0]=4 2482 B11R2.36 Oc1ccc2cnoc2c1 Amb10603075 [0,1,0,1,0,0|2,0,0]=4 2483 B11R2.36 Oc1ccc2ncoc2c1 Amb33546968 [0,1,0,1,0,0|2,0,0]=4 2484 B11R2.36 Oc1ccc2occc2c1 Amb16185813 [0,1,0,1,0,0|0,0,1]=3 2485 B11R2.36 Oc1ccc2ocnc2c1 Amb17479110 [0,1,0,1,0,0|1,0,1]=4 2486 B11R2.36 Oc1ccc2oncc2c1 Amb23403626 [0,1,0,1,0,0|1,0,1]=4 2487 B11R2.36 Oc1ccc2sccc2c1 Amb18644430 [0,1,0,1,0,0|0,1,1]=4 2488 B11R2.36 Oc1cnc2ccsc2c1 Amb19959222 [0,1,0,1,0,0|1,1,0]=4 2489 B11R2.36 Sc1ccc2ncoc2c1 Amb28072623 [0,1,0,1,0,0|2,0,0]=4 2490 B11R2.36 Sc1ccc2occc2c1 Amb24089279 [0,1,0,1,0,0|0,1,0]=3 2491 B11R2.36 Sc1cnc2ccsc2c1 Amb19374475 [0,1,0,1,0,0|1,1,0]=4 2492 B11R2.36 [O-][n+]1ccc2ccoc2c1 Amb28182446 [0,1,0,1,0,0|2,0,0]=4 2493 B11R2.60 Cc1ncn2c1C=CC2=O Amb24480374 [0,1,0,1,0,0|2,0,0]=4 2494 B11R2.60 O=C1C=CC2C(=O)C=CC12 Amb2778855 [0,1,0,1,0,0|1,0,1]=4 2495 B11R2.60 O=C1C=C[C@@H]2C(=O)C=C[C@H]12 Amb28066580 [0,1,0,1,0,0|1,0,1]=4 2496 B11R2.60 O=C1C=Cc2c(Cl)csc21 Amb5720080 [0,1,0,1,0,0|2,0,0]=4