0 B11R2.15 BrCc1cn2ccsc2n1 Amb3442356 [0,0,0,0,0,0|2,1,0]=3 1 B11R2.15 C#Cc1cn2ncsc2n1 Amb28044453 [0,0,0,0,0,0|2,1,1]=4 2 B11R2.15 CCc1cn2ccnc2s1 Amb24089378 [0,0,0,0,0,0|3,0,1]=4 3 B11R2.15 CCc1cn2ccsc2n1 Amb28137743 [0,0,0,0,0,0|1,1,1]=3 4 B11R2.15 ClCc1cn2ccsc2n1 Amb2923991 [0,0,0,0,0,0|2,1,0]=3 5 B11R2.15 ICc1cn2ccsc2n1 Amb27814596 [0,0,0,0,0,0|2,1,0]=3 6 B11R2.15 N#Cc1cn2ccnc2s1 Amb27213689 [0,0,0,0,0,0|4,0,0]=4 7 B11R2.15 NCc1cc2occn2n1 Amb27865622 [0,0,0,0,0,0|4,0,0]=4 8 B11R2.15 NCc1cn2c(n1)OCC2 Amb18832089 [0,0,0,0,0,0|2,0,2]=4 9 B11R2.15 NCc1cn2ccsc2n1 Amb13881337 [0,0,0,0,0,0|2,1,0]=3 10 B11R2.15 NCc1cn2ccsc2n1 Amb22492404 [0,0,0,0,0,0|2,1,0]=3 11 B11R2.15 NCc1cn2ccsc2n1 Amb2342718 [0,0,0,0,0,0|2,1,0]=3 12 B11R2.15 NCc1cn2ccsc2n1 Amb6223184 [0,0,0,0,0,0|2,1,0]=3 13 B11R2.15 NCc1cn2ccsc2n1 Amb6892512 [0,0,0,0,0,0|2,1,0]=3 14 B11R2.15 NCc1cn2ncsc2n1 Amb7968843 [0,0,0,0,0,0|3,1,0]=4 15 B11R2.15 O=Cc1cc2ccnc2n1 Amb27488076 [0,0,0,0,0,0|4,0,0]=4 16 B11R2.15 O=Cc1cc2sccn2c1 Amb28315767 [0,0,0,0,0,0|3,1,0]=4 17 B11R2.15 O=Cc1cn2ccnc2s1 Amb18831202 [0,0,0,0,0,0|4,0,0]=4 18 B11R2.15 O=Cc1cn2ccsc2n1 Amb2723514 [0,0,0,0,0,0|2,1,0]=3 19 B11R2.15 OCc1cc2sccn2c1 Amb27948071 [0,0,0,0,0,0|3,1,0]=4 20 B11R2.15 OCc1cn2ccsc2n1 Amb2723515 [0,0,0,0,0,0|2,1,0]=3 21 B10R2.2 Brc1cn2c(n1)OCC2 Amb18190281 [1,0,0,0,0,0|1,0,2]=4 22 B10R2.2 Brc1cn2ccnc2s1 Amb22496215 [1,0,0,0,0,0|3,0,0]=4 23 B10R2.2 Brc1cn2ccsc2n1 Amb18176803 [1,0,0,0,0,0|1,1,0]=3 24 B10R2.2 Cc1cn2ccsc2n1 Amb385307 [1,0,0,0,0,0|0,1,1]=3 25 B10R2.2 Clc1cn2ccsc2n1 Amb1649100 [1,0,0,0,0,0|1,1,0]=3 26 B10R2.2 Clc1cn2ncoc2n1 Amb27493620 [1,0,0,0,0,0|2,0,0]=3 27 B10R2.2 Nc1cn2ccsc2n1 Amb18861525 [1,0,0,0,0,0|0,1,1]=3 28 B10R2.2 Oc1cn2ccsc2n1 Amb35710126 [1,0,0,0,0,0|1,1,0]=3 29 B10R2.2 Oc1cn2ncsc2n1 Amb35710127 [1,0,0,0,0,0|2,1,0]=4 30 B12R2.30 BrCc1nc2sccn2c1Br Amb13952551 [0,1,0,0,0,0|2,1,0]=4 31 B12R2.30 BrCc1nc2sccn2c1Br Amb27843532 [0,1,0,0,0,0|2,1,0]=4 32 B12R2.30 Cc1c(C=O)nc2sccn12 Amb18199623 [0,1,0,0,0,0|2,1,0]=4 33 B12R2.30 Clc1c(CBr)nc2sccn12 Amb27617520 [0,1,0,0,0,0|2,1,0]=4 34 B12R2.39 CNCc1cn2ccsc2n1 Amb27778972 [0,1,0,0,0,0|0,1,2]=4 35 B12R2.39 COCc1cn2ccsc2n1 Amb27184024 [0,1,0,0,0,0|1,1,1]=4 36 B12R2.39 CSCc1cn2ccsc2n1 Amb27774699 [0,1,0,0,0,0|1,1,1]=4 37 B12R2.39 NCCc1cn2ccsc2n1 Amb5729714 [0,1,0,0,0,0|1,1,1]=4 38 B12R2.39 NCCc1cn2ccsc2n1 Amb5738356 [0,1,0,0,0,0|1,1,1]=4 39 B12R2.39 NOCc1cn2ccsc2n1 Amb27950063 [0,1,0,0,0,0|2,1,0]=4 40 B12R2.39 O=C=Nc1cn2ccnc2s1 Amb27463501 [0,1,0,0,0,0|2,0,1]=4 41 B12R2.252 CC(N)c1cn2ccsc2n1 Amb10607932 [0,1,0,0,0,0|1,1,1]=4 42 B12R2.252 CC(N)c1cn2ccsc2n1 Amb5729684 [0,1,0,0,0,0|1,1,1]=4 43 B12R2.252 NC(=O)c1cn2ccsc2n1 Amb26978870 [0,1,0,0,0,0|2,1,0]=4 44 B12R2.252 O=C(O)c1cn2ccsc2n1 Amb2688824 [0,1,0,0,0,0|2,1,0]=4 45 B12R2.252 O=C(O)c1cn2ccsc2n1 Amb33528845 [0,1,0,0,0,0|2,1,0]=4 46 B12R2.364 Cc1cn2cc(C=O)nc2s1 Amb17215485 [0,1,0,0,0,0|2,1,0]=4 47 B12R2.364 Cc1cn2cc(CCl)nc2s1 Amb17215484 [0,1,0,0,0,0|2,1,0]=4 48 B12R2.364 Cc1cn2cc(CN)nc2s1 Amb10608536 [0,1,0,0,0,0|2,1,0]=4 49 B12R2.364 Cc1cn2cc(CN)nc2s1 Amb23399545 [0,1,0,0,0,0|2,1,0]=4 50 B12R2.364 Cc1cn2cc(CN)nc2s1 Amb32409681 [0,1,0,0,0,0|2,1,0]=4 51 B12R2.364 NCc1cn2cc(Cl)sc2n1 Amb7968824 [0,1,0,0,0,0|2,1,0]=4 52 B12R2.2040 Cc1csc2nc(CN)cn12 Amb22587659 [0,1,0,0,0,0|2,1,0]=4 53 B12R2.2040 Cc1csc2nc(CN)cn12 Amb3941296 [0,1,0,0,0,0|2,1,0]=4 54 B12R2.32 BrCc1cn2ccccc2n1 Amb2502422 [0,0,0,0,0,1|3,0,0]=4 55 B12R2.32 BrCc1cn2ccccc2n1 Amb2606323 [0,0,0,0,0,1|3,0,0]=4 56 B12R2.32 BrCc1cn2cccnc2n1 Amb2477862 [0,0,0,0,0,1|3,0,0]=4 57 B12R2.32 C#Cc1cn2ccccc2n1 Amb27467701 [0,0,0,0,0,1|2,0,1]=4 58 B12R2.32 C#Cc1cn2cccnc2n1 Amb27259114 [0,0,0,0,0,1|2,0,1]=4 59 B12R2.32 CCc1cn2cccnc2n1 Amb27407446 [0,0,0,0,0,1|2,0,1]=4 60 B12R2.32 CNc1cn2ccccc2n1 Amb24617293 [0,0,0,0,0,1|1,0,2]=4 61 B12R2.32 ClCc1cn2ccccc2n1 Amb1073681 [0,0,0,0,0,1|3,0,0]=4 62 B12R2.32 ClCc1cn2ccccc2n1 Amb1154236 [0,0,0,0,0,1|3,0,0]=4 63 B12R2.32 ClCc1cn2cccnc2n1 Amb1075396 [0,0,0,0,0,1|3,0,0]=4 64 B12R2.32 ClCc1cn2cccnc2n1 Amb22283713 [0,0,0,0,0,1|3,0,0]=4 65 B12R2.32 ClCc1cn2ccncc2n1 Amb24065578 [0,0,0,0,0,1|3,0,0]=4 66 B12R2.32 ClCc1cn2cnccc2n1 Amb24509225 [0,0,0,0,0,1|3,0,0]=4 67 B12R2.32 ClCc1cn2ncccc2n1 Amb31308355 [0,0,0,0,0,1|3,0,0]=4 68 B12R2.32 N#Cc1cn2ccccc2n1 Amb15701297 [0,0,0,0,0,1|3,0,0]=4 69 B12R2.32 N#Cc1cn2cccnc2n1 Amb22494851 [0,0,0,0,0,1|3,0,0]=4 70 B12R2.32 NCc1cn2ccccc2n1 Amb10072977 [0,0,0,0,0,1|3,0,0]=4 71 B12R2.32 NCc1cn2ccccc2n1 Amb1154302 [0,0,0,0,0,1|3,0,0]=4 72 B12R2.32 NCc1cn2ccccc2n1 Amb15694861 [0,0,0,0,0,1|3,0,0]=4 73 B12R2.32 NCc1cn2ccccc2n1 Amb2600312 [0,0,0,0,0,1|3,0,0]=4 74 B12R2.32 NCc1cn2ccccc2n1 Amb8503464 [0,0,0,0,0,1|3,0,0]=4 75 B12R2.32 NCc1cn2cccnc2n1 Amb21955313 [0,0,0,0,0,1|3,0,0]=4 76 B12R2.32 NCc1cn2cccnc2n1 Amb22587652 [0,0,0,0,0,1|3,0,0]=4 77 B12R2.32 NCc1cn2cccnc2n1 Amb2606107 [0,0,0,0,0,1|3,0,0]=4 78 B12R2.32 NCc1cn2ccncc2n1 Amb33677243 [0,0,0,0,0,1|3,0,0]=4 79 B12R2.32 NCc1cn2ncccc2n1 Amb18061736 [0,0,0,0,0,1|3,0,0]=4 80 B12R2.32 NCc1cn2nccnc2n1 Amb22737762 [0,0,0,0,0,1|3,0,0]=4 81 B12R2.32 O=Cc1cn2ccccc2n1 Amb2723503 [0,0,0,0,0,1|3,0,0]=4 82 B12R2.32 O=Cc1cn2cccnc2n1 Amb8010289 [0,0,0,0,0,1|3,0,0]=4 83 B12R2.32 O=Cc1cn2ccncc2n1 Amb8010290 [0,0,0,0,0,1|3,0,0]=4 84 B12R2.32 O=Cc1cn2ncccc2n1 Amb18831428 [0,0,0,0,0,1|3,0,0]=4 85 B12R2.32 O=Cc1cn2nccnc2n1 Amb18831402 [0,0,0,0,0,1|3,0,0]=4 86 B12R2.32 OCc1cn2ccccc2n1 Amb20623412 [0,0,0,0,0,1|3,0,0]=4 87 B12R2.32 OCc1cn2ccccc2n1 Amb33526650 [0,0,0,0,0,1|3,0,0]=4 88 B12R2.32 OCc1cn2cccnc2n1 Amb9421587 [0,0,0,0,0,1|3,0,0]=4 89 B12R2.32 OCc1cn2ccncc2n1 Amb27492925 [0,0,0,0,0,1|3,0,0]=4 90 B12R2.32 OCc1cn2ncccc2n1 Amb31308352 [0,0,0,0,0,1|3,0,0]=4 91 B12R2.32 SCc1cn2ccccc2n1 Amb9207300 [0,0,0,0,0,1|3,0,0]=4 92 B12R2.32 SCc1cn2cccnc2n1 Amb32650846 [0,0,0,0,0,1|3,0,0]=4 93 B12R2.32 [C-]#[N+]c1cn2ccccc2n1 Amb33447800 [0,0,0,0,0,1|1,0,2]=4 94 B12R2.44 BrCc1cnc2occc2c1 Amb25149005 [0,0,0,0,0,1|3,0,0]=4 95 B12R2.44 C#Cc1cn2ccnc2cn1 Amb19895150 [0,0,0,0,0,1|2,0,1]=4 96 B12R2.44 C=Cc1ccc2occc2c1 Amb27951918 [0,0,0,0,0,1|3,0,0]=4 97 B12R2.44 C=Cc1cnc2ccnn2c1 Amb33340811 [0,0,0,0,0,1|3,0,0]=4 98 B12R2.44 COc1ccn2ccnc2n1 Amb24097920 [0,0,0,0,0,1|2,0,1]=4 99 B12R2.44 COc1cnc2nccn2c1 Amb28284731 [0,0,0,0,0,1|2,0,1]=4 100 B12R2.44 ClCc1cnc2occc2c1 Amb28120006 [0,0,0,0,0,1|3,0,0]=4 101 B12R2.44 N#Cc1ccn2ccnc2n1 Amb27154804 [0,0,0,0,0,1|3,0,0]=4 102 B12R2.44 N#Cc1cn2ccnc2cn1 Amb21927954 [0,0,0,0,0,1|3,0,0]=4 103 B12R2.44 N#Cc1cnc2nccn2c1 Amb28313726 [0,0,0,0,0,1|3,0,0]=4 104 B12R2.44 NCc1cc2ccoc2cn1 Amb18831392 [0,0,0,0,0,1|3,0,0]=4 105 B12R2.44 NCc1ccn2ccnc2n1 Amb18831369 [0,0,0,0,0,1|3,0,0]=4 106 B12R2.44 NCc1cn2cccc2cn1 Amb22737753 [0,0,0,0,0,1|3,0,0]=4 107 B12R2.44 NCc1cn2ccnc2cn1 Amb22737756 [0,0,0,0,0,1|3,0,0]=4 108 B12R2.44 NCc1cn2ccnc2cn1 Amb30874099 [0,0,0,0,0,1|3,0,0]=4 109 B12R2.44 NCc1cnc2nccn2c1 Amb25887088 [0,0,0,0,0,1|3,0,0]=4 110 B12R2.44 NCc1cnc2nccn2c1 Amb28652863 [0,0,0,0,0,1|3,0,0]=4 111 B12R2.44 O=Cc1cc2ccoc2cn1 Amb18831431 [0,0,0,0,0,1|3,0,0]=4 112 B12R2.44 O=Cc1ccc2ccoc2n1 Amb18831432 [0,0,0,0,0,1|3,0,0]=4 113 B12R2.44 O=Cc1ccn2ccnc2n1 Amb24081844 [0,0,0,0,0,1|3,0,0]=4 114 B12R2.44 O=Cc1cnc2nccn2c1 Amb18831426 [0,0,0,0,0,1|3,0,0]=4 115 B12R2.44 O=Cc1cnc2occc2c1 Amb18202339 [0,0,0,0,0,1|3,0,0]=4 116 B12R2.44 OCc1cc2ccoc2cn1 Amb19958437 [0,0,0,0,0,1|3,0,0]=4 117 B12R2.44 OCc1cnc2nccn2c1 Amb27453594 [0,0,0,0,0,1|3,0,0]=4 118 B9R1.33 C=CCN1C=CSC1=N Amb28049661 [1,0,1,0,0,0|0,1,1]=4 119 B9R2.3 c1cc2ccnc2n1 Amb27881525 [2,0,0,0,0,0|2,0,0]=4 120 B9R2.3 c1cc2sccn2c1 Amb28312857 [2,0,0,0,0,0|1,1,0]=4 121 B9R2.3 c1cc2scnc2o1 Amb23412528 [2,0,0,0,0,0|2,0,0]=4 122 B9R2.3 c1cn2ccsc2n1 Amb15693037 [2,0,0,0,0,0|0,1,0]=3 123 B9R2.3 c1cn2cnnc2s1 Amb28200605 [2,0,0,0,0,0|1,1,0]=4 124 B11R2.8 Cc1c(Br)nc2sccn12 Amb27638108 [1,1,0,0,0,0|1,1,0]=4 125 B11R2.8 Cc1nc2oncn2c1N Amb18832242 [1,1,0,0,0,0|1,0,1]=4 126 B11R2.8 Cc1nc2sccn2c1Br Amb33548804 [1,1,0,0,0,0|0,1,1]=4 127 B11R2.8 Cc1nc2sccn2c1O Amb32877086 [1,1,0,0,0,0|0,1,1]=4 128 B11R2.8 Clc1nc2sccn2c1Br Amb2419127 [1,1,0,0,0,0|1,1,0]=4 129 B11R2.8 Clc1nc2sccn2c1Cl Amb6892781 [1,1,0,0,0,0|1,1,0]=4 130 B11R2.66 Cc1cn2c(N)csc2n1 Amb18224343 [1,1,0,0,0,0|0,1,1]=4 131 B11R2.66 Cc1csc2nc(Cl)cn12 Amb28320708 [1,1,0,0,0,0|1,1,0]=4 132 B11R2.66 Cc1csc2nc(N)cn12 Amb18224275 [1,1,0,0,0,0|0,1,1]=4 133 B11R2.66 Cc1csc2nc(O)cn12 Amb35710128 [1,1,0,0,0,0|1,1,0]=4 134 B11R2.66 Cn1ccn2cc(Cl)nc12 Amb27859645 [1,1,0,0,0,0|2,0,0]=4 135 B11R2.139 Cc1cn2cc(C)sc2n1 Amb26573684 [1,1,0,0,0,0|0,1,1]=4 136 B11R2.139 Cc1cn2cc(Cl)nc2s1 Amb28320707 [1,1,0,0,0,0|1,1,0]=4 137 B11R2.139 Cc1cn2cc(Cl)sc2n1 Amb27243895 [1,1,0,0,0,0|0,1,1]=4 138 B11R2.139 Nc1cn2cc(Br)sc2n1 Amb27776936 [1,1,0,0,0,0|0,1,1]=4 139 B13R2.26 N\N=C\c1cn2ccccc2n1 Amb28291939 [0,1,0,0,0,1|2,0,0]=4 140 B13R2.26 O=C=Nc1cn2ccccc2n1 Amb28436322 [0,1,0,0,0,1|1,0,1]=4 141 B13R2.26 O=CCc1cn2ccccc2n1 Amb24330441 [0,1,0,0,0,1|2,0,0]=4 142 B13R2.26 O\N=C\c1cn2ccccc2n1 Amb24565405 [0,1,0,0,0,1|2,0,0]=4 143 B13R2.43 C=Cc1cn2cc(Cl)ccc2n1 Amb24095493 [0,1,0,0,0,1|2,0,0]=4 144 B13R2.43 OCc1cn2c(n1)OC(Cl)=CC2 Amb27178342 [0,1,0,0,0,1|2,0,0]=4 145 B13R2.164 O=CCCc1cn2ccsc2n1 Amb28045075 [0,2,0,0,0,0|1,1,0]=4 146 B13R2.164 [N-]=[N+]=NCc1cn2ccsc2n1 Amb27663930 [0,2,0,0,0,0|1,1,0]=4 147 B13R2.543 CC(=O)Cc1cn2ccsc2n1 Amb27953285 [0,2,0,0,0,0|1,1,0]=4 148 B13R2.543 NC(=S)Cc1cn2ccsc2n1 Amb27837186 [0,2,0,0,0,0|1,1,0]=4 149 B13R2.543 O=C(O)Cc1cn2ccsc2n1 Amb1106610 [0,2,0,0,0,0|1,1,0]=4 150 B13R2.543 O=C(O)Cc1cn2ccsc2n1 Amb33611565 [0,2,0,0,0,0|1,1,0]=4 151 B13R2.543 O=C(O)Cc1cn2ccsc2n1 Amb8503501 [0,2,0,0,0,0|1,1,0]=4 152 B13R2.4515 Cc1cn2cc(CC#N)nc2o1 Amb28071453 [0,2,0,0,0,0|1,0,1]=4 153 B11R2.36 Brc1cn2ccnc2cn1 Amb10070395 [0,0,1,1,0,0|2,0,0]=4 154 B11R2.36 Cc1cn2ccnc2cn1 Amb28455402 [0,0,1,1,0,0|2,0,0]=4 155 B11R2.36 Clc1cc2ccoc2cn1 Amb27756425 [0,0,1,1,0,0|2,0,0]=4 156 B11R2.36 Clc1cn2ccnc2cn1 Amb10603054 [0,0,1,1,0,0|2,0,0]=4 157 B11R2.36 Clc1ncc2ccoc2n1 Amb24635142 [0,0,1,1,0,0|2,0,0]=4 158 B11R2.36 Ic1cn2ccnc2cn1 Amb22497787 [0,0,1,1,0,0|2,0,0]=4 159 B11R2.36 Nc1cn2ccnc2cn1 Amb10600580 [0,0,1,1,0,0|1,0,1]=4 160 B11R2.36 Oc1cn2ccnc2cn1 Amb10600581 [0,0,1,1,0,0|2,0,0]=4 161 B11R2.1 Brc1ccc2cnccn12 Amb18188551 [0,0,1,1,0,0|2,0,0]=4 162 B11R2.1 Brc1ncc2cnccn12 Amb27243098 [0,0,1,1,0,0|2,0,0]=4 163 B11R2.1 Clc1ncc2cnccn12 Amb28049365 [0,0,1,1,0,0|2,0,0]=4 164 B11R2.1 Oc1ccc2cnccn12 Amb28201971 [0,0,1,1,0,0|2,0,0]=4 165 B11R2.18 C1=CN=C2OC=CN2C=C1 Amb28423061 [0,0,1,1,0,0|1,0,0]=3 166 B11R2.18 C1=CN=C2SC=CN2C=C1 Amb27834876 [0,0,1,1,0,0|1,1,0]=4 167 B11R2.18 C1=Cn2cccc2NC=N1 Amb27244701 [0,0,1,1,0,0|1,0,1]=4 168 B11R2.191 NCc1ncn2ccoc12 Amb27869583 [0,0,1,1,0,0|2,0,0]=4 169 B11R2.10 Brc1cn2ccccc2n1 Amb10603566 [1,0,0,0,0,1|2,0,0]=4 170 B11R2.10 Brc1cn2cccnc2n1 Amb18810782 [1,0,0,0,0,1|2,0,0]=4 171 B11R2.10 Brc1cn2ccncc2n1 Amb24745260 [1,0,0,0,0,1|2,0,0]=4 172 B11R2.10 Brc1cn2ncccc2n1 Amb18187713 [1,0,0,0,0,1|2,0,0]=4 173 B11R2.10 Cc1cn2ccccc2n1 Amb3348237 [1,0,0,0,0,1|1,0,1]=4 174 B11R2.10 Cc1cn2cccnc2n1 Amb19148909 [1,0,0,0,0,1|1,0,1]=4 175 B11R2.10 Cc1cn2ccncc2n1 Amb28050175 [1,0,0,0,0,1|1,0,1]=4 176 B11R2.10 Clc1cn2ccccc2n1 Amb404592 [1,0,0,0,0,1|2,0,0]=4 177 B11R2.10 Clc1cn2ccncc2n1 Amb26567217 [1,0,0,0,0,1|2,0,0]=4 178 B11R2.10 Clc1cn2cnccc2n1 Amb26918418 [1,0,0,0,0,1|2,0,0]=4 179 B11R2.10 Clc1cn2ncccc2n1 Amb27770397 [1,0,0,0,0,1|2,0,0]=4 180 B11R2.10 Nc1cn2ccccc2n1 Amb17065517 [1,0,0,0,0,1|1,0,1]=4 181 B11R2.10 Nc1cn2ccccc2n1 Amb22899518 [1,0,0,0,0,1|1,0,1]=4 182 B11R2.10 Nc1cn2cccnc2n1 Amb2373788 [1,0,0,0,0,1|1,0,1]=4 183 B11R2.10 Nc1cn2ccncc2n1 Amb27448595 [1,0,0,0,0,1|1,0,1]=4 184 B11R2.10 Oc1cn2ccccc2n1 Amb19515773 [1,0,0,0,0,1|2,0,0]=4 185 B11R2.10 Oc1cn2cccnc2n1 Amb25063031 [1,0,0,0,0,1|2,0,0]=4 186 B11R2.10 Oc1cn2ccncc2n1 Amb25146321 [1,0,0,0,0,1|2,0,0]=4 187 B11R2.10 Oc1cn2cnccc2n1 Amb27603689 [1,0,0,0,0,1|2,0,0]=4