0 B11R2.191 ClCc1cnc2sccn12 Amb17215481 [0,0,0,0,0,0|3,0,1]=4 1 B11R2.191 N#Cc1nnc2sccn12 Amb27479777 [0,0,0,0,0,0|2,0,1]=3 2 B11R2.191 NCc1cnc2sccn12 Amb18831101 [0,0,0,0,0,0|3,0,1]=4 3 B11R2.191 NCc1cnc2sccn12 Amb32882501 [0,0,0,0,0,0|3,0,1]=4 4 B11R2.191 NCc1cnc2sccn12 Amb33330394 [0,0,0,0,0,0|3,0,1]=4 5 B11R2.191 NCc1ncc2sccn12 Amb18559588 [0,0,0,0,0,0|3,0,1]=4 6 B11R2.191 O=Cc1cnc2oncn12 Amb18832414 [0,0,0,0,0,0|3,0,1]=4 7 B11R2.191 O=Cc1cnc2sccn12 Amb17215482 [0,0,0,0,0,0|2,0,1]=3 8 B11R2.191 O=Cc1cnc2scnn12 Amb17130278 [0,0,0,0,0,0|3,0,1]=4 9 B11R2.191 O=Cc1ncc2sccn12 Amb18831207 [0,0,0,0,0,0|2,0,1]=3 10 B11R2.191 O=Cc1nnc2n1CCC2 Amb18832383 [0,0,0,0,0,0|0,0,4]=4 11 B11R2.191 O=Cc1nnc2sccn12 Amb27629313 [0,0,0,0,0,0|1,0,1]=2 12 B11R2.191 OCC1=NN=C2C=CC=C21 Amb27970989 [0,0,0,0,0,0|1,0,1]=2 13 B11R2.191 OCc1cnc2sccn12 Amb17215480 [0,0,0,0,0,0|2,0,1]=3 14 B11R2.191 OCc1csc2cncn12 Amb28312840 [0,0,0,0,0,0|3,0,1]=4 15 B11R2.191 OCc1csc2nccn12 Amb27953600 [0,0,0,0,0,0|3,0,1]=4 16 B11R2.191 OCc1ncc2sccn12 Amb28280089 [0,0,0,0,0,0|2,0,1]=3 17 B11R2.191 OCc1nnc2n1CCC2 Amb23441241 [0,0,0,0,0,0|0,0,4]=4 18 B11R2.191 OCc1noc2ccsc12 Amb25916465 [0,0,0,0,0,0|3,0,1]=4 19 B10R2.32 Brc1cnc2sccn12 Amb24083375 [1,0,0,0,0,0|3,0,0]=4 20 B10R2.32 Brc1nsc2nccn12 Amb28064286 [1,0,0,0,0,0|3,0,0]=4 21 B10R2.32 Clc1cnc2sccn12 Amb25218909 [1,0,0,0,0,0|3,0,0]=4 22 B10R2.32 Ic1cnc2sccn12 Amb27838467 [1,0,0,0,0,0|3,0,0]=4 23 B10R2.32 Ic1nnc2sccn12 Amb27170731 [1,0,0,0,0,0|2,0,0]=3 24 B10R2.32 Nc1cnc2sccn12 Amb17223553 [1,0,0,0,0,0|3,0,0]=4 25 B10R2.32 Nc1ncc2sccn12 Amb18223677 [1,0,0,0,0,0|3,0,0]=4 26 B10R2.32 Nc1nnc2sccn12 Amb18862445 [1,0,0,0,0,0|2,0,0]=3 27 B10R2.32 O=C1C=Cc2cccn21 Amb27409386 [1,0,0,0,0,0|2,0,1]=4 28 B10R2.32 O=C1SN=C2SC=CN12 Amb27391219 [1,0,0,0,0,0|2,0,1]=4 29 B12R2.72 C=Cc1c(C)nc2sccn12 Amb32877109 [0,1,0,0,0,0|3,0,0]=4 30 B12R2.72 Cc1nc2sccn2c1C=O Amb1106647 [0,1,0,0,0,0|2,0,1]=4 31 B12R2.72 Cc1nc2sccn2c1CO Amb2388498 [0,1,0,0,0,0|2,0,1]=4 32 B12R2.72 O=Cc1c(Br)nc2sccn12 Amb18660835 [0,1,0,0,0,0|2,0,1]=4 33 B12R2.72 O=Cc1c(Cl)nc2sccn12 Amb1106649 [0,1,0,0,0,0|2,0,1]=4 34 B12R2.72 O=Cc1c(S)nc2sccn12 Amb2420560 [0,1,0,0,0,0|2,0,1]=4 35 B12R2.72 OCc1c(Cl)nc2sccn12 Amb1106997 [0,1,0,0,0,0|2,0,1]=4 36 B12R2.144 O\N=C\c1nnc2n1CCC2 Amb23535968 [0,1,0,0,0,0|0,0,3]=4 37 B12R2.367 Cn1ccn2c(C#N)nnc12 Amb28194829 [0,1,0,0,0,0|2,0,1]=4 38 B12R2.367 Cn1ccn2c(CO)cnc12 Amb27495567 [0,1,0,0,0,0|2,0,1]=4 39 B12R2.375 Cc1cn2c(C=O)cnc2s1 Amb17128774 [0,1,0,0,0,0|2,0,1]=4 40 B12R2.375 O=Cc1cnc2sc(Br)cn12 Amb33804568 [0,1,0,0,0,0|2,0,1]=4 41 B12R2.376 Cc1csc2cnc(C=O)n12 Amb18199622 [0,1,0,0,0,0|2,0,1]=4 42 B12R2.376 Cc1csc2ncc(C=O)n12 Amb17128773 [0,1,0,0,0,0|2,0,1]=4 43 B12R2.376 Cc1csc2nnc(CN)n12 Amb17319368 [0,1,0,0,0,0|2,0,1]=4 44 B12R2.1362 CC(=O)c1cnc2sccn12 Amb18199620 [0,1,0,0,0,0|2,0,1]=4 45 B12R2.1362 CC(=O)c1ncc2sccn12 Amb18199619 [0,1,0,0,0,0|2,0,1]=4 46 B12R2.1362 CC(=O)c1nnc2sccn12 Amb18199507 [0,1,0,0,0,0|1,0,1]=3 47 B12R2.1362 O=C(O)c1ccc2sccn12 Amb18199524 [0,1,0,0,0,0|3,0,0]=4 48 B12R2.1362 O=C(O)c1cnc2sccn12 Amb7173029 [0,1,0,0,0,0|2,0,0]=3 49 B12R2.1362 O=C(O)c1csc2cncn12 Amb18199329 [0,1,0,0,0,0|3,0,0]=4 50 B12R2.1362 O=C(O)c1csc2cncn12 Amb32992592 [0,1,0,0,0,0|3,0,0]=4 51 B12R2.1362 O=C(O)c1csc2nccn12 Amb18862747 [0,1,0,0,0,0|3,0,0]=4 52 B12R2.1362 O=C(O)c1csc2nccn12 Amb33189327 [0,1,0,0,0,0|3,0,0]=4 53 B12R2.1362 O=C(O)c1ncc2sccn12 Amb18826707 [0,1,0,0,0,0|2,0,0]=3 54 B12R2.1362 O=C(O)c1nnc2cnnc12 Amb18201483 [0,1,0,0,0,0|3,0,0]=4 55 B12R2.1362 O=C(O)c1nnc2n1CCC2 Amb1102417 [0,1,0,0,0,0|0,0,3]=4 56 B12R2.1362 O=C(O)c1nnc2sccn12 Amb17484332 [0,1,0,0,0,0|1,0,0]=2 57 B12R2.1362 O=C(O)c1onc2ccoc12 Amb18201210 [0,1,0,0,0,0|3,0,0]=4 58 B12R2.1362 O=C(O)c1onc2ccsc12 Amb18199123 [0,1,0,0,0,0|3,0,0]=4 59 B12R2.1362 O=C(O)c1onc2occc12 Amb18201209 [0,1,0,0,0,0|3,0,0]=4 60 B12R2.1362 O=C(O)c1onc2sccc12 Amb18199122 [0,1,0,0,0,0|3,0,0]=4 61 B12R2.2263 Cc1nc(C=O)n2ccsc12 Amb18199621 [0,1,0,0,0,0|2,0,1]=4 62 B10R1.5 C=CCn1ccnc1C=O Amb28458578 [0,0,1,0,0,0|1,0,2]=4 63 B10R1.5 C=CCn1cncc1CO Amb25887639 [0,0,1,0,0,0|1,0,2]=4 64 B10R1.5 C=CCn1cnnc1C#N Amb27485361 [0,0,1,0,0,0|1,0,2]=4 65 B10R1.5 C=CCn1cnnc1CN Amb18224104 [0,0,1,0,0,0|1,0,2]=4 66 B10R1.5 C=CCn1cnnc1SC Amb28315883 [0,0,1,0,0,0|2,0,1]=4 67 B12R3.1603 c1cc2coc3ccc1n23 Amb26005188 [0,0,0,1,0,0|2,0,0]=3 68 B12R3.1615 C1=C2CC(O1)c3cccn32 Amb24480389 [0,0,0,1,0,0|2,0,0]=3 69 B12R2.1 BrCc1cnc2ccccn12 Amb23403052 [0,0,0,0,0,1|2,0,1]=4 70 B12R2.1 BrCc1cnc2cnccn12 Amb33435696 [0,0,0,0,0,1|2,0,1]=4 71 B12R2.1 BrCc1ncc2ccccn12 Amb23559978 [0,0,0,0,0,1|2,0,1]=4 72 B12R2.1 C#Cc1cnc2ccccn12 Amb16192263 [0,0,0,0,0,1|2,0,1]=4 73 B12R2.1 C#Cc1cnc2cccnn12 Amb22406166 [0,0,0,0,0,1|2,0,1]=4 74 B12R2.1 C#Cc1cnc2cnccn12 Amb23401326 [0,0,0,0,0,1|2,0,1]=4 75 B12R2.1 C#Cc1nnc2cnccn12 Amb27946352 [0,0,0,0,0,1|1,0,1]=3 76 B12R2.1 C=Cc1cnc2ccccn12 Amb17601404 [0,0,0,0,0,1|2,0,0]=3 77 B12R2.1 C=Cc1cnc2cnccn12 Amb32724725 [0,0,0,0,0,1|2,0,0]=3 78 B12R2.1 C=Cc1onc2ccccc12 Amb27208307 [0,0,0,0,0,1|3,0,0]=4 79 B12R2.1 C=Cn1nnc2ccccc21 Amb10559409 [0,0,0,0,0,1|3,0,0]=4 80 B12R2.1 CCc1cnc2cnccn12 Amb27945720 [0,0,0,0,0,1|2,0,1]=4 81 B12R2.1 CCc1cnc2ncccn12 Amb27176260 [0,0,0,0,0,1|2,0,1]=4 82 B12R2.1 CCc1ncc2ccccn12 Amb2852264 [0,0,0,0,0,1|2,0,1]=4 83 B12R2.1 CNc1cnc2ccccn12 Amb23437245 [0,0,0,0,0,1|3,0,0]=4 84 B12R2.1 CNc1ncc2ccccn12 Amb27422888 [0,0,0,0,0,1|3,0,0]=4 85 B12R2.1 CNc1nnc2ccccn12 Amb27493158 [0,0,0,0,0,1|2,0,0]=3 86 B12R2.1 CSc1nnc2ncccn12 Amb27647532 [0,0,0,0,0,1|2,0,0]=3 87 B12R2.1 ClCc1cnc2ccccn12 Amb18534674 [0,0,0,0,0,1|2,0,1]=4 88 B12R2.1 ClCc1cnc2ccccn12 Amb2301399 [0,0,0,0,0,1|2,0,1]=4 89 B12R2.1 ClCc1cnc2cccnn12 Amb25749082 [0,0,0,0,0,1|2,0,1]=4 90 B12R2.1 ClCc1cnc2cccnn12 Amb35788236 [0,0,0,0,0,1|2,0,1]=4 91 B12R2.1 ClCc1cnc2ccncn12 Amb25783396 [0,0,0,0,0,1|2,0,1]=4 92 B12R2.1 ClCc1cnc2cnccn12 Amb24730254 [0,0,0,0,0,1|2,0,1]=4 93 B12R2.1 ClCc1cnc2ncccn12 Amb21927824 [0,0,0,0,0,1|2,0,1]=4 94 B12R2.1 ClCc1nnc2cccnn12 Amb25174041 [0,0,0,0,0,1|1,0,1]=3 95 B12R2.1 ClCc1nnc2ncccn12 Amb22524575 [0,0,0,0,0,1|1,0,1]=3 96 B12R2.1 N#Cc1cnc2ccccn12 Amb8467913 [0,0,0,0,0,1|2,0,1]=4 97 B12R2.1 N#Cc1cnc2cccnn12 Amb25107734 [0,0,0,0,0,1|2,0,1]=4 98 B12R2.1 N#Cc1cnc2cnccn12 Amb23401327 [0,0,0,0,0,1|2,0,1]=4 99 B12R2.1 N#Cc1cnc2ncccn12 Amb28239709 [0,0,0,0,0,1|2,0,1]=4 100 B12R2.1 N#Cc1nnc2cccnn12 Amb18644192 [0,0,0,0,0,1|1,0,1]=3 101 B12R2.1 NCc1cnc2ccccn12 Amb10067697 [0,0,0,0,0,1|2,0,1]=4 102 B12R2.1 NCc1cnc2ccccn12 Amb10608545 [0,0,0,0,0,1|2,0,1]=4 103 B12R2.1 NCc1cnc2ccccn12 Amb20413753 [0,0,0,0,0,1|2,0,1]=4 104 B12R2.1 NCc1cnc2ccccn12 Amb22492384 [0,0,0,0,0,1|2,0,1]=4 105 B12R2.1 NCc1cnc2cccnn12 Amb27839897 [0,0,0,0,0,1|2,0,1]=4 106 B12R2.1 NCc1cnc2cnccn12 Amb22232092 [0,0,0,0,0,1|2,0,1]=4 107 B12R2.1 NCc1cnc2cnccn12 Amb22587523 [0,0,0,0,0,1|2,0,1]=4 108 B12R2.1 NCc1cnc2ncccn12 Amb18831364 [0,0,0,0,0,1|2,0,1]=4 109 B12R2.1 NCc1ncc2ccccn12 Amb17058863 [0,0,0,0,0,1|2,0,1]=4 110 B12R2.1 NCc1ncc2cccnn12 Amb27193791 [0,0,0,0,0,1|2,0,1]=4 111 B12R2.1 NCc1nnc2ccccn12 Amb22551836 [0,0,0,0,0,1|1,0,1]=3 112 B12R2.1 NCc1nnc2ccccn12 Amb2371067 [0,0,0,0,0,1|1,0,1]=3 113 B12R2.1 NCc1nnc2ccccn12 Amb35309 [0,0,0,0,0,1|1,0,1]=3 114 B12R2.1 NCc1nnc2cccnn12 Amb18202117 [0,0,0,0,0,1|1,0,1]=3 115 B12R2.1 NCc1nnc2ccncn12 Amb27218748 [0,0,0,0,0,1|1,0,1]=3 116 B12R2.1 NCc1nnc2cnccn12 Amb1111599 [0,0,0,0,0,1|1,0,1]=3 117 B12R2.1 NCc1nnc2ncccn12 Amb13951891 [0,0,0,0,0,1|1,0,1]=3 118 B12R2.1 NCc1nnc2ncccn12 Amb7172897 [0,0,0,0,0,1|1,0,1]=3 119 B12R2.1 NNc1cnc2cccnn12 Amb27648688 [0,0,0,0,0,1|3,0,0]=4 120 B12R2.1 O=CC1=NNC2=CC=CNN21 Amb18202006 [0,0,0,0,0,1|0,0,2]=3 121 B12R2.1 O=Cc1ccc2ccccn12 Amb18559296 [0,0,0,0,0,1|2,0,1]=4 122 B12R2.1 O=Cc1ccc2cnccn12 Amb18202370 [0,0,0,0,0,1|2,0,1]=4 123 B12R2.1 O=Cc1cnc2ccccn12 Amb9901908 [0,0,0,0,0,1|1,0,1]=3 124 B12R2.1 O=Cc1cnc2cccnn12 Amb18202313 [0,0,0,0,0,1|1,0,1]=3 125 B12R2.1 O=Cc1cnc2ccncn12 Amb18202320 [0,0,0,0,0,1|1,0,1]=3 126 B12R2.1 O=Cc1cnc2cnccn12 Amb8011550 [0,0,0,0,0,1|1,0,1]=3 127 B12R2.1 O=Cc1cnc2ncccn12 Amb8010295 [0,0,0,0,0,1|1,0,1]=3 128 B12R2.1 O=Cc1cnc2ncncn12 Amb18202271 [0,0,0,0,0,1|2,0,1]=4 129 B12R2.1 O=Cc1cnc2nnccn12 Amb18202272 [0,0,0,0,0,1|2,0,1]=4 130 B12R2.1 O=Cc1ncc2ccccn12 Amb18124774 [0,0,0,0,0,1|1,0,1]=3 131 B12R2.1 O=Cc1ncc2cnccn12 Amb27481427 [0,0,0,0,0,1|1,0,1]=3 132 B12R2.1 O=Cc1nnc2ccccn12 Amb23450391 [0,0,0,0,0,1|0,0,1]=2 133 B12R2.1 O=Cc1nnc2cccnn12 Amb18124867 [0,0,0,0,0,1|0,0,1]=2 134 B12R2.1 O=Cc1nnc2cnccn12 Amb23450392 [0,0,0,0,0,1|0,0,1]=2 135 B12R2.1 O=Cc1nnc2ncccn12 Amb27462577 [0,0,0,0,0,1|0,0,1]=2 136 B12R2.1 O=Cc1nnn2ccccc12 Amb18202317 [0,0,0,0,0,1|2,0,1]=4 137 B12R2.1 O=Cc1noc2cccnc12 Amb27633323 [0,0,0,0,0,1|2,0,1]=4 138 B12R2.1 O=Cc1noc2ccncc12 Amb27963151 [0,0,0,0,0,1|2,0,1]=4 139 B12R2.1 O=Cc1noc2ncccc12 Amb18202280 [0,0,0,0,0,1|2,0,1]=4 140 B12R2.1 O=Cc1nsc2ccncc12 Amb18199776 [0,0,0,0,0,1|2,0,1]=4 141 B12R2.1 O=Cc1nsc2ncccc12 Amb18199775 [0,0,0,0,0,1|2,0,1]=4 142 B12R2.1 O=Cc1onc2ccccc12 Amb18831437 [0,0,0,0,0,1|2,0,1]=4 143 B12R2.1 O=Cc1snc2ccccc12 Amb26948515 [0,0,0,0,0,1|2,0,1]=4 144 B12R2.1 O=Cn1nnc2ccccc21 Amb3374289 [0,0,0,0,0,1|2,0,1]=4 145 B12R2.1 OCc1cnc2ccccn12 Amb10067471 [0,0,0,0,0,1|1,0,1]=3 146 B12R2.1 OCc1cnc2ccccn12 Amb21927957 [0,0,0,0,0,1|1,0,1]=3 147 B12R2.1 OCc1cnc2cccnn12 Amb27176226 [0,0,0,0,0,1|1,0,1]=3 148 B12R2.1 OCc1cnc2cnccn12 Amb22494030 [0,0,0,0,0,1|1,0,1]=3 149 B12R2.1 OCc1nnc2cccnn12 Amb23449898 [0,0,0,0,0,1|0,0,1]=2 150 B12R2.1 OCc1noc2ccccc12 Amb22498744 [0,0,0,0,0,1|2,0,1]=4 151 B12R2.1 OCc1noc2cnccc12 Amb28436318 [0,0,0,0,0,1|2,0,1]=4 152 B12R2.1 OCc1noc2ncccc12 Amb27450932 [0,0,0,0,0,1|2,0,1]=4 153 B12R2.1 OCc1onc2ccccc12 Amb35781902 [0,0,0,0,0,1|2,0,1]=4 154 B12R2.1 OCc1snc2ccccc12 Amb27839871 [0,0,0,0,0,1|2,0,1]=4 155 B12R2.1 OCn1nnc2ccccc21 Amb1350546 [0,0,0,0,0,1|2,0,1]=4 156 B12R2.1 ONc1snc2ccccc12 Amb28365603 [0,0,0,0,0,1|3,0,0]=4 157 B12R2.1 SCc1cnc2ccccn12 Amb32788062 [0,0,0,0,0,1|1,1,1]=4 158 B12R2.1 SCc1cnc2cnccn12 Amb32724502 [0,0,0,0,0,1|1,1,1]=4 159 B12R2.1 [C-]#[N+]c1cnc2ccccn12 Amb33274374 [0,0,0,0,0,1|3,0,0]=4 160 B12R2.1 [C-]#[N+]c1cnc2cnccn12 Amb32724401 [0,0,0,0,0,1|3,0,0]=4 161 B12R2.1 [N-]=[N+]=C1N=Nc2ccccc21 Amb27441838 [0,0,0,0,0,1|3,0,0]=4 162 B12R2.44 C=Cc1cnc2ccnn2c1 Amb33340811 [0,0,0,0,0,1|3,0,0]=4 163 B12R2.44 CSc1ncc2cccn2n1 Amb24487092 [0,0,0,0,0,1|3,0,0]=4 164 B12R2.44 NCc1cn2cccc2cn1 Amb22737753 [0,0,0,0,0,1|2,0,1]=4 165 B12R2.44 NCc1ncc2cccn2n1 Amb18202221 [0,0,0,0,0,1|2,0,1]=4 166 B12R2.44 O=Cc1cnc2ccnn2c1 Amb18202329 [0,0,0,0,0,1|2,0,1]=4 167 B12R2.44 O=Cc1cnc2cncn2c1 Amb18202309 [0,0,0,0,0,1|2,0,1]=4 168 B12R2.44 O=Cc1cnc2nccn2c1 Amb18831426 [0,0,0,0,0,1|2,0,1]=4 169 B12R2.44 OCc1cnc2ccnn2c1 Amb28249983 [0,0,0,0,0,1|2,0,1]=4 170 B12R2.44 OCc1cnc2nccn2c1 Amb27453594 [0,0,0,0,0,1|2,0,1]=4 171 B12R2.315 CNc1ncnc2ccnn12 Amb28043093 [0,0,0,0,0,1|3,0,0]=4 172 B12R2.315 CNc1nncc2cncn12 Amb27482484 [0,0,0,0,0,1|3,0,0]=4 173 B12R2.315 COc1cnnc2ccnn12 Amb27250697 [0,0,0,0,0,1|3,0,0]=4 174 B12R2.315 ClCc1cncc2cccn12 Amb27263694 [0,0,0,0,0,1|2,0,1]=4 175 B12R2.315 O=Cc1nccc2cccn12 Amb24082048 [0,0,0,0,0,1|1,0,1]=3 176 B9R1.14 C=Cn1cccc1CC Amb28249845 [1,0,1,0,0,0|2,0,0]=4 177 B9R1.14 C=Cn1ccnc1C=O Amb26874462 [1,0,1,0,0,0|1,0,1]=4 178 B9R1.14 C=Cn1ccnc1CO Amb9201055 [1,0,1,0,0,0|1,0,1]=4 179 B9R1.11 C=CC(=O)n1cccc1 Amb28122830 [1,0,1,0,0,0|2,0,0]=4 180 B9R1.11 O=C(NO)n1cccc1 Amb25114377 [1,0,1,0,0,0|2,0,0]=4 181 B9R1.12 C=C\N=C\c1cccs1 Amb27240018 [1,0,1,0,0,0|2,0,0]=4 182 B9R2.3 c1cc2sccn2c1 Amb28312857 [2,0,0,0,0,0|2,0,0]=4 183 B9R2.3 c1cn2ccsc2n1 Amb15693037 [2,0,0,0,0,0|2,0,0]=4 184 B9R2.3 c1cn2cncc2s1 Amb27453580 [2,0,0,0,0,0|2,0,0]=4 185 B9R2.3 c1cn2cnnc2s1 Amb28200605 [2,0,0,0,0,0|1,0,0]=3 186 B11R1.473 C=Cc1ncc(C(=O)O)n1C Amb35718952 [0,1,1,0,0,0|1,0,1]=4 187 B11R2.8 Cc1nc2sccn2c1O Amb32877086 [1,1,0,0,0,0|2,0,0]=4 188 B11R2.60 Nc1nnc2n(O)ccn12 Amb27494065 [1,1,0,0,0,0|2,0,0]=4 189 B11R2.67 Cc1csc2nnc(N)n12 Amb18862507 [1,1,0,0,0,0|2,0,0]=4 190 B11R2.67 Cc1ncc2n1C(=O)C=C2 Amb27251584 [1,1,0,0,0,0|1,0,1]=4 191 B13R2.1 CCNc1nnc2ccccn12 Amb27433476 [0,1,0,0,0,1|1,0,1]=4 192 B13R2.1 CCSc1nnc2ccccn12 Amb27178919 [0,1,0,0,0,1|1,0,1]=4 193 B13R2.1 CNCc1nnc2ccccn12 Amb32664394 [0,1,0,0,0,1|1,0,1]=4 194 B13R2.1 CNCc1nnc2ccccn12 Amb6275562 [0,1,0,0,0,1|1,0,1]=4 195 B13R2.1 CNCc1nnc2cccnn12 Amb28141068 [0,1,0,0,0,1|1,0,1]=4 196 B13R2.1 CNCc1nnc2cnccn12 Amb9339047 [0,1,0,0,0,1|1,0,1]=4 197 B13R2.1 C\C=N/c1cnc2ccccn12 Amb24095340 [0,1,0,0,0,1|2,0,0]=4 198 B13R2.1 NCCc1nnc2ccccn12 Amb31307229 [0,1,0,0,0,1|1,0,1]=4 199 B13R2.1 NCCc1nnc2ccccn12 Amb435645 [0,1,0,0,0,1|1,0,1]=4 200 B13R2.1 NCCc1nnc2ccccn12 Amb6891912 [0,1,0,0,0,1|1,0,1]=4 201 B13R2.1 NCCc1nnc2cccnn12 Amb18829322 [0,1,0,0,0,1|1,0,1]=4 202 B13R2.1 NCCc1nnc2ccncn12 Amb25829534 [0,1,0,0,0,1|1,0,1]=4 203 B13R2.1 NCCc1nnc2cnccn12 Amb9339028 [0,1,0,0,0,1|1,0,1]=4 204 B13R2.1 NCCc1nnc2ncccn12 Amb9493269 [0,1,0,0,0,1|1,0,1]=4 205 B13R2.1 NOCc1cnc2ccccn12 Amb33274063 [0,1,0,0,0,1|1,0,1]=4 206 B13R2.1 NOCc1cnc2cnccn12 Amb33339768 [0,1,0,0,0,1|1,0,1]=4 207 B13R2.1 O=CCc1cnc2ccccn12 Amb25325297 [0,1,0,0,0,1|1,0,1]=4 208 B13R2.1 O=CCc1cnc2cnccn12 Amb32724727 [0,1,0,0,0,1|1,0,1]=4 209 B13R2.1 OCCc1cnc2ccccn12 Amb24097754 [0,1,0,0,0,1|1,0,1]=4 210 B13R2.1 OCCc1cnc2cnccn12 Amb24081833 [0,1,0,0,0,1|1,0,1]=4 211 B13R2.1 OCCc1cnc2ncccn12 Amb25947483 [0,1,0,0,0,1|1,0,1]=4 212 B13R2.1 OCCc1ncc2ccccn12 Amb28126981 [0,1,0,0,0,1|1,0,1]=4 213 B13R2.1 ONCc1cnc2ccccn12 Amb33274856 [0,1,0,0,0,1|1,0,1]=4 214 B13R2.1 ONCc1cnc2cnccn12 Amb32724664 [0,1,0,0,0,1|1,0,1]=4 215 B13R2.1 O\N=C\c1cnc2ccccn12 Amb20668890 [0,1,0,0,0,1|1,0,0]=3 216 B13R2.1 O\N=C\c1nsc2ccccc12 Amb27798976 [0,1,0,0,0,1|2,0,0]=4 217 B13R2.9 CCc1nnc2c(Br)nccn12 Amb32757815 [0,1,0,0,0,1|1,0,1]=4 218 B13R2.9 CCc1nnc2c(Cl)nccn12 Amb8388133 [0,1,0,0,0,1|1,0,1]=4 219 B13R2.9 CCc1nnc2c(N)cccn12 Amb17096252 [0,1,0,0,0,1|1,0,1]=4 220 B13R2.9 CCc1nnc2n1C=CNC2=O Amb23597567 [0,1,0,0,0,1|1,0,1]=4 221 B13R2.9 COc1nnc2c(Br)nccn12 Amb27441313 [0,1,0,0,0,1|2,0,0]=4 222 B13R2.9 Cc1cccn2c(C=O)cnc12 Amb18559579 [0,1,0,0,0,1|1,0,1]=4 223 B13R2.9 Cc1cccn2c(CCl)nnc12 Amb25294700 [0,1,0,0,0,1|1,0,1]=4 224 B13R2.9 Cc1cccn2c(CN)nnc12 Amb17210431 [0,1,0,0,0,1|1,0,1]=4 225 B13R2.9 Cc1cccn2c(CN)nnc12 Amb22886410 [0,1,0,0,0,1|1,0,1]=4 226 B13R2.9 Cc1cccn2c(CO)cnc12 Amb10607944 [0,1,0,0,0,1|1,0,1]=4 227 B13R2.9 Cc1ccnn2c(C#N)nnc12 Amb27857276 [0,1,0,0,0,1|1,0,1]=4 228 B13R2.9 ClCc1nnc2c(Cl)nccn12 Amb27646782 [0,1,0,0,0,1|1,0,1]=4 229 B13R2.9 Fc1cccn2c(CCl)nnc12 Amb26873985 [0,1,0,0,0,1|1,0,1]=4 230 B13R2.9 NCc1nnc2c(Br)cccn12 Amb27627171 [0,1,0,0,0,1|1,0,1]=4 231 B13R2.9 NCc1nnc2c(Br)nccn12 Amb32757818 [0,1,0,0,0,1|1,0,1]=4 232 B13R2.9 NCc1nnc2c(Cl)cccn12 Amb24179219 [0,1,0,0,0,1|1,0,1]=4 233 B13R2.9 NCc1nnc2c(Cl)cccn12 Amb28555765 [0,1,0,0,0,1|1,0,1]=4 234 B13R2.9 NCc1nnc2c(F)cccn12 Amb25104679 [0,1,0,0,0,1|1,0,1]=4 235 B13R2.9 NCc1nnc2c(F)cccn12 Amb33532510 [0,1,0,0,0,1|1,0,1]=4 236 B13R2.9 NCc1nnc2n1C=CNC2=O Amb32675503 [0,1,0,0,0,1|1,0,1]=4 237 B13R2.9 O=C1NC=Cn2c(CCl)nnc21 Amb32679290 [0,1,0,0,0,1|1,0,1]=4 238 B13R2.9 O=C1NC=Cn2c(CS)nnc21 Amb32650899 [0,1,0,0,0,1|0,1,1]=4 239 B13R2.9 O=Cc1cnc2c(Br)cccn12 Amb24097695 [0,1,0,0,0,1|1,0,1]=4 240 B13R2.9 O=Cc1cnc2c(O)cccn12 Amb19959697 [0,1,0,0,0,1|1,0,1]=4 241 B13R2.9 O=Cc1ncc2n1C=CNC2=O Amb28077733 [0,1,0,0,0,1|1,0,1]=4 242 B13R2.9 OCc1cnc2c(Cl)cccn12 Amb18264381 [0,1,0,0,0,1|1,0,1]=4 243 B13R2.9 OCc1nnc2c(Br)nccn12 Amb32757805 [0,1,0,0,0,1|0,0,1]=3 244 B13R2.72 C=C(C)c1cnc2ccccn12 Amb27622227 [0,1,0,0,0,1|2,0,0]=4 245 B13R2.72 CC(=O)c1cnc2ccccn12 Amb21963091 [0,1,0,0,0,1|1,0,1]=4 246 B13R2.72 CC(=O)c1cnc2cccnn12 Amb18830099 [0,1,0,0,0,1|1,0,1]=4 247 B13R2.72 CC(=O)c1cnc2cnccn12 Amb18830100 [0,1,0,0,0,1|1,0,1]=4 248 B13R2.72 CC(=O)c1cnc2ncccn12 Amb24060251 [0,1,0,0,0,1|1,0,1]=4 249 B13R2.72 CC(=O)c1nnc2ccccn12 Amb25329309 [0,1,0,0,0,1|0,0,1]=3 250 B13R2.72 CC(Br)c1nnc2cnccn12 Amb27244183 [0,1,0,0,0,1|1,0,1]=4 251 B13R2.72 CC(C)c1nnc2cnccn12 Amb26517523 [0,1,0,0,0,1|1,0,1]=4 252 B13R2.72 CC(Cl)c1nnc2cnccn12 Amb28250123 [0,1,0,0,0,1|1,0,1]=4 253 B13R2.72 CC(N)c1nnc2ccccn12 Amb2357873 [0,1,0,0,0,1|1,0,1]=4 254 B13R2.72 CC(N)c1nnc2ccccn12 Amb31291635 [0,1,0,0,0,1|1,0,1]=4 255 B13R2.72 CC(N)c1nnc2ccccn12 Amb9729354 [0,1,0,0,0,1|1,0,1]=4 256 B13R2.72 CC(N)c1nnc2cccnn12 Amb28119747 [0,1,0,0,0,1|1,0,1]=4 257 B13R2.72 CC(N)c1nnc2cnccn12 Amb9339027 [0,1,0,0,0,1|1,0,1]=4 258 B13R2.72 CC(N)c1nnc2ncccn12 Amb20667636 [0,1,0,0,0,1|1,0,1]=4 259 B13R2.72 CC(N)c1nnc2ncccn12 Amb9493270 [0,1,0,0,0,1|1,0,1]=4 260 B13R2.72 CC(O)c1cnc2ccccn12 Amb17115478 [0,1,0,0,0,1|1,0,1]=4 261 B13R2.72 CC(O)c1nnc2ccccn12 Amb27866627 [0,1,0,0,0,1|0,0,1]=3 262 B13R2.72 C[C@@H](N)c1nnc2ccccn12 Amb5759176 [0,1,0,0,0,1|1,0,1]=4 263 B13R2.72 C[C@@H](O)c1cnc2ccccn12 Amb33274525 [0,1,0,0,0,1|1,0,1]=4 264 B13R2.72 C[C@@H](O)c1cnc2cnccn12 Amb32724522 [0,1,0,0,0,1|1,0,1]=4 265 B13R2.72 C[C@H](N)c1nnc2ccccn12 Amb2371357 [0,1,0,0,0,1|1,0,1]=4 266 B13R2.72 C[C@H](O)c1cnc2ccccn12 Amb33274524 [0,1,0,0,0,1|1,0,1]=4 267 B13R2.72 C[C@H](O)c1cnc2cnccn12 Amb32724528 [0,1,0,0,0,1|1,0,1]=4 268 B13R2.72 FC(F)c1nnc2cnccn12 Amb27951922 [0,1,0,0,0,1|1,0,1]=4 269 B13R2.72 N=C(N)c1cnc2ccccn12 Amb25697441 [0,1,0,0,0,1|2,0,0]=4 270 B13R2.72 N=C(N)c1cnc2cnccn12 Amb32724492 [0,1,0,0,0,1|2,0,0]=4 271 B13R2.72 NC(=O)c1nnc2ccccn12 Amb27760483 [0,1,0,0,0,1|0,0,1]=3 272 B13R2.72 NC(=S)c1cnc2ccccn12 Amb20667632 [0,1,0,0,0,1|1,1,0]=4 273 B13R2.72 NC(=S)c1cnc2cnccn12 Amb32724493 [0,1,0,0,0,1|1,1,0]=4 274 B13R2.72 NC(=S)c1ncc2ccccn12 Amb28127008 [0,1,0,0,0,1|1,1,0]=4 275 B13R2.72 O=C(Cl)c1cnc2ccccn12 Amb25997777 [0,1,0,0,0,1|1,0,1]=4 276 B13R2.72 O=C(O)C1=NNC2C=CC=CN12 Amb23559190 [0,1,0,0,0,1|0,0,2]=4 277 B13R2.72 O=C(O)c1ccc2ccccn12 Amb18149687 [0,1,0,0,0,1|2,0,0]=4 278 B13R2.72 O=C(O)c1ccc2cccnn12 Amb25034789 [0,1,0,0,0,1|2,0,0]=4 279 B13R2.72 O=C(O)c1cnc2ccccn12 Amb2723386 [0,1,0,0,0,1|1,0,0]=3 280 B13R2.72 O=C(O)c1cnc2ccccn12 Amb32693473 [0,1,0,0,0,1|1,0,0]=3 281 B13R2.72 O=C(O)c1cnc2cccnn12 Amb33546267 [0,1,0,0,0,1|1,0,0]=3 282 B13R2.72 O=C(O)c1cnc2cnccn12 Amb18829542 [0,1,0,0,0,1|1,0,0]=3 283 B13R2.72 O=C(O)c1cnc2ncccn12 Amb8010291 [0,1,0,0,0,1|1,0,0]=3 284 B13R2.72 O=C(O)c1ncc2ccccn12 Amb17060780 [0,1,0,0,0,1|1,0,0]=3 285 B13R2.72 O=C(O)c1ncc2cnccn12 Amb24531553 [0,1,0,0,0,1|1,0,0]=3 286 B13R2.72 O=C(O)c1ncc2cncnn12 Amb27877600 [0,1,0,0,0,1|2,0,0]=4 287 B13R2.72 O=C(O)c1nnc2ccccn12 Amb17062672 [0,1,0,0,0,1|0,0,0]=2 288 B13R2.72 O=C(O)c1nnc2cccnn12 Amb23450388 [0,1,0,0,0,1|0,0,0]=2 289 B13R2.72 O=C(O)c1nnc2cnccn12 Amb18945408 [0,1,0,0,0,1|0,0,0]=2 290 B13R2.72 O=C(O)c1nnc2ncccn12 Amb17062666 [0,1,0,0,0,1|0,0,0]=2 291 B13R2.72 O=C(O)c1nnn2ccccc12 Amb18645769 [0,1,0,0,0,1|2,0,0]=4 292 B13R2.72 O=C(O)c1noc2ccccc12 Amb1994153 [0,1,0,0,0,1|2,0,0]=4 293 B13R2.72 O=C(O)c1noc2cnccc12 Amb27754951 [0,1,0,0,0,1|2,0,0]=4 294 B13R2.72 O=C(O)c1noc2ncccc12 Amb24343515 [0,1,0,0,0,1|2,0,0]=4 295 B13R2.72 O=C(O)c1nsc2ccccc12 Amb33542908 [0,1,0,0,0,1|2,0,0]=4 296 B13R2.72 O=C(O)c1onc2ccccc12 Amb2725091 [0,1,0,0,0,1|2,0,0]=4 297 B13R2.72 O=C(O)c1onc2cccnc12 Amb27186314 [0,1,0,0,0,1|2,0,0]=4 298 B13R2.72 O=C(O)c1onc2ncccc12 Amb18829102 [0,1,0,0,0,1|2,0,0]=4 299 B13R2.72 O=C(O)c1snc2ccccc12 Amb17594585 [0,1,0,0,0,1|2,0,0]=4 300 B13R2.72 O=C([O-])c1ncc2cnccn12 Amb32665113 [0,1,0,0,0,1|1,0,1]=4 301 B13R2.72 O=C([O-])c1nnc2ccccn12 Amb35749768 [0,1,0,0,0,1|0,0,1]=3 302 B13R2.72 O=C([O-])c1nnc2cnccn12 Amb22898765 [0,1,0,0,0,1|0,0,1]=3 303 B13R2.72 OB(O)c1cnc2ccccn12 Amb25824613 [0,1,0,0,0,1|2,0,0]=4 304 B13R2.135 C=Cc1c(Cl)nc2ccccn12 Amb27414128 [0,1,0,0,0,1|2,0,0]=4 305 B13R2.135 Cc1nc2ccccn2c1C=O Amb1106632 [0,1,0,0,0,1|1,0,1]=4 306 B13R2.135 Cc1nc2ccccn2c1CO Amb2723330 [0,1,0,0,0,1|1,0,1]=4 307 B13R2.135 Cc1nc2ccncn2c1C=O Amb18830022 [0,1,0,0,0,1|1,0,1]=4 308 B13R2.135 Cc1nc2cnccn2c1CO Amb26904848 [0,1,0,0,0,1|1,0,1]=4 309 B13R2.135 Cc1nc2ncccn2c1C=O Amb2689457 [0,1,0,0,0,1|1,0,1]=4 310 B13R2.135 O=C1N=C2C=CC=CN2\C1=C/O Amb24068486 [0,1,0,0,0,1|1,0,0]=3 311 B13R2.135 O=Cc1c(Br)nc2ccccn12 Amb18754830 [0,1,0,0,0,1|1,0,1]=4 312 B13R2.135 O=Cc1c(Cl)nc2ccccn12 Amb1106631 [0,1,0,0,0,1|1,0,1]=4 313 B13R2.135 OCc1c(Cl)nc2ccccn12 Amb1106996 [0,1,0,0,0,1|1,0,1]=4 314 B13R2.662 CCc1nnc2cc(Cl)ncn12 Amb8838276 [0,1,0,0,0,1|1,0,1]=4 315 B13R2.662 CCc1nnc2cc(N)ccn12 Amb28318440 [0,1,0,0,0,1|1,0,1]=4 316 B13R2.662 Cc1cc2ncc(C=O)n2cn1 Amb18830097 [0,1,0,0,0,1|1,0,1]=4 317 B13R2.662 Cc1cc2nnc(CN)n2cn1 Amb17484713 [0,1,0,0,0,1|1,0,1]=4 318 B13R2.662 Cc1ccn2c(C=O)cnc2c1 Amb18062104 [0,1,0,0,0,1|1,0,1]=4 319 B13R2.662 Cc1ccn2c(C=O)nnc2c1 Amb27246787 [0,1,0,0,0,1|0,0,1]=3 320 B13R2.662 Cc1ccn2c(CCl)nnc2c1 Amb24697597 [0,1,0,0,0,1|1,0,1]=4 321 B13R2.662 Cc1ccn2c(CN)nnc2c1 Amb17210437 [0,1,0,0,0,1|1,0,1]=4 322 B13R2.662 Cc1ccn2c(CN)nnc2n1 Amb27467691 [0,1,0,0,0,1|1,0,1]=4 323 B13R2.662 Cc1ccn2c(CO)cnc2c1 Amb17115491 [0,1,0,0,0,1|1,0,1]=4 324 B13R2.662 ClCc1nnc2cc(Br)ccn12 Amb25696033 [0,1,0,0,0,1|1,0,1]=4 325 B13R2.662 ClCc1nnc2cc(Cl)ncn12 Amb27474520 [0,1,0,0,0,1|1,0,1]=4 326 B13R2.662 Fc1ccn2c(CCl)nnc2c1 Amb27965535 [0,1,0,0,0,1|1,0,1]=4 327 B13R2.662 Fc1ccn2c(CCl)nnc2n1 Amb26865451 [0,1,0,0,0,1|1,0,1]=4 328 B13R2.662 NCc1nnc2cc(Br)ccn12 Amb27797107 [0,1,0,0,0,1|1,0,1]=4 329 B13R2.662 NCc1nnc2cc(Cl)ccn12 Amb18106755 [0,1,0,0,0,1|1,0,1]=4 330 B13R2.662 NCc1nnc2nc(F)ccn12 Amb25062932 [0,1,0,0,0,1|1,0,1]=4 331 B13R2.662 O=Cc1cnc2cc(Br)ccn12 Amb21964694 [0,1,0,0,0,1|1,0,1]=4 332 B13R2.662 O=Cc1cnc2cc(Cl)ccn12 Amb18824304 [0,1,0,0,0,1|1,0,1]=4 333 B13R2.662 O=Cc1cnc2cc(F)ccn12 Amb26080994 [0,1,0,0,0,1|1,0,1]=4 334 B13R2.662 O=Cc1cnc2nc(Br)ccn12 Amb18160689 [0,1,0,0,0,1|1,0,1]=4 335 B13R2.662 O=Cc1cnc2nc(Cl)ccn12 Amb24745684 [0,1,0,0,0,1|1,0,1]=4 336 B13R2.662 O=Cc1cnc2nc(F)ccn12 Amb26347282 [0,1,0,0,0,1|1,0,1]=4 337 B13R2.662 OCc1cnc2cc(Br)ccn12 Amb18264621 [0,1,0,0,0,1|1,0,1]=4 338 B13R2.662 OCc1cnc2cc(Cl)ccn12 Amb18624900 [0,1,0,0,0,1|1,0,1]=4 339 B13R2.662 OCc1cnc2cc(F)ccn12 Amb26936782 [0,1,0,0,0,1|1,0,1]=4 340 B13R2.662 OCc1cnc2cc(O)ccn12 Amb28244128 [0,1,0,0,0,1|1,0,1]=4 341 B13R2.662 OCc1nnc2cc(Cl)ncn12 Amb19057809 [0,1,0,0,0,1|0,0,1]=3 342 B13R2.2091 CCc1nnc2cccc(Cl)n12 Amb2432406 [0,1,0,0,0,1|1,0,1]=4 343 B13R2.2091 Cc1cccc2ncc(C=O)n12 Amb18559577 [0,1,0,0,0,1|1,0,1]=4 344 B13R2.2091 Cc1cccc2ncc(CO)n12 Amb10607945 [0,1,0,0,0,1|1,0,1]=4 345 B13R2.2091 Cc1cccc2nnc(CN)n12 Amb17210425 [0,1,0,0,0,1|1,0,1]=4 346 B13R2.2091 Cc1ccnc2ncc(C=O)n12 Amb25934131 [0,1,0,0,0,1|1,0,1]=4 347 B13R2.2091 Cc1ccnc2nnc(CCl)n12 Amb26591024 [0,1,0,0,0,1|1,0,1]=4 348 B13R2.2091 Cc1nccc2ncc(C=O)n12 Amb18830096 [0,1,0,0,0,1|1,0,1]=4 349 B13R2.2091 ClCc1nnc2cccc(Cl)n12 Amb2432449 [0,1,0,0,0,1|1,0,1]=4 350 B13R2.2091 Fc1ccnc2nnc(CCl)n12 Amb25187592 [0,1,0,0,0,1|1,0,1]=4 351 B13R2.2091 NCc1nnc2cccc(Cl)n12 Amb18624216 [0,1,0,0,0,1|1,0,1]=4 352 B13R2.2091 NCc1nnc2nccc(Cl)n12 Amb25793691 [0,1,0,0,0,1|1,0,1]=4 353 B13R2.2091 NCc1nnc2nccc(F)n12 Amb27398602 [0,1,0,0,0,1|1,0,1]=4 354 B13R2.2091 Nc1cccc2ncc(C=O)n12 Amb18830017 [0,1,0,0,0,1|1,0,1]=4 355 B13R2.2091 O=Cc1cnc2cccc(Br)n12 Amb27410422 [0,1,0,0,0,1|1,0,1]=4 356 B13R2.2091 O=Cc1cnc2cccc(Cl)n12 Amb18824300 [0,1,0,0,0,1|1,0,1]=4 357 B13R2.2091 O=Cc1cnc2ccnc(Br)n12 Amb18160710 [0,1,0,0,0,1|1,0,1]=4 358 B13R2.2091 O=Cc1cnc2n1C(=O)NC=C2 Amb18829507 [0,1,0,0,0,1|1,0,1]=4 359 B13R2.2091 O=Cc1cnc2nccc(Cl)n12 Amb25667278 [0,1,0,0,0,1|1,0,1]=4 360 B13R2.2091 O=Cc1cnc2nccc(F)n12 Amb24377177 [0,1,0,0,0,1|1,0,1]=4 361 B13R2.2136 C#Cc1nnc2ccc(Br)cn12 Amb25079073 [0,1,0,0,0,1|1,0,1]=4 362 B13R2.2136 C#Cc1nnc2ccc(Cl)nn12 Amb28139560 [0,1,0,0,0,1|1,0,1]=4 363 B13R2.2136 CCc1nnc2ccc(Br)cn12 Amb21856121 [0,1,0,0,0,1|1,0,1]=4 364 B13R2.2136 CCc1nnc2ccc(Cl)nn12 Amb9753507 [0,1,0,0,0,1|1,0,1]=4 365 B13R2.2136 CCc1nnc2ccc(F)cn12 Amb29847874 [0,1,0,0,0,1|1,0,1]=4 366 B13R2.2136 CCc1nnc2ccc(N)cn12 Amb17093580 [0,1,0,0,0,1|1,0,1]=4 367 B13R2.2136 CCc1nnc2ccc(O)cn12 Amb33039267 [0,1,0,0,0,1|1,0,1]=4 368 B13R2.2136 CCc1nnc2cnc(Cl)cn12 Amb28200846 [0,1,0,0,0,1|1,0,1]=4 369 B13R2.2136 CCc1nnc2ncc(Br)cn12 Amb25997879 [0,1,0,0,0,1|1,0,1]=4 370 B13R2.2136 CCc1nnc2ncc(N)cn12 Amb26861559 [0,1,0,0,0,1|1,0,1]=4 371 B13R2.2136 COc1nnc2ccc(Cl)nn12 Amb26926385 [0,1,0,0,0,1|2,0,0]=4 372 B13R2.2136 CSc1nnc2ccc(Br)cn12 Amb10067451 [0,1,0,0,0,1|2,0,0]=4 373 B13R2.2136 CSc1nnc2ccc(N)cn12 Amb17091770 [0,1,0,0,0,1|2,0,0]=4 374 B13R2.2136 Cc1ccc2cnc(C=O)n2c1 Amb27621672 [0,1,0,0,0,1|1,0,1]=4 375 B13R2.2136 Cc1ccc2ncc(C=O)n2c1 Amb18559578 [0,1,0,0,0,1|1,0,1]=4 376 B13R2.2136 Cc1ccc2ncc(CO)n2c1 Amb17115490 [0,1,0,0,0,1|1,0,1]=4 377 B13R2.2136 Cc1ccc2nnc(CCl)n2c1 Amb24655832 [0,1,0,0,0,1|1,0,1]=4 378 B13R2.2136 Cc1ccc2nnc(CN)n2c1 Amb17210443 [0,1,0,0,0,1|1,0,1]=4 379 B13R2.2136 Cc1ccc2nnc(CN)n2c1 Amb28555761 [0,1,0,0,0,1|1,0,1]=4 380 B13R2.2136 Cc1ccc2nnc(CN)n2n1 Amb33529449 [0,1,0,0,0,1|1,0,1]=4 381 B13R2.2136 Cc1cnc2ncc(C=O)n2c1 Amb25930314 [0,1,0,0,0,1|1,0,1]=4 382 B13R2.2136 Cc1cnc2nnc(CCl)n2c1 Amb24571283 [0,1,0,0,0,1|1,0,1]=4 383 B13R2.2136 Cc1cnc2nnc(CN)n2c1 Amb28247934 [0,1,0,0,0,1|1,0,1]=4 384 B13R2.2136 ClCc1nnc2ccc(Br)cn12 Amb27866428 [0,1,0,0,0,1|1,0,1]=4 385 B13R2.2136 ClCc1nnc2ccc(Cl)nn12 Amb25276353 [0,1,0,0,0,1|1,0,1]=4 386 B13R2.2136 Fc1ccc2nnc(CCl)n2c1 Amb26865930 [0,1,0,0,0,1|1,0,1]=4 387 B13R2.2136 NCc1nnc2ccc(Br)cn12 Amb17210455 [0,1,0,0,0,1|1,0,1]=4 388 B13R2.2136 NCc1nnc2ccc(Br)nn12 Amb18160491 [0,1,0,0,0,1|1,0,1]=4 389 B13R2.2136 NCc1nnc2ccc(Cl)cn12 Amb17210449 [0,1,0,0,0,1|1,0,1]=4 390 B13R2.2136 NCc1nnc2ccc(Cl)cn12 Amb28555764 [0,1,0,0,0,1|1,0,1]=4 391 B13R2.2136 NCc1nnc2ccc(Cl)nn12 Amb18823038 [0,1,0,0,0,1|1,0,1]=4 392 B13R2.2136 NCc1nnc2ccc(Cl)nn12 Amb21960073 [0,1,0,0,0,1|1,0,1]=4 393 B13R2.2136 NCc1nnc2ccc(Cl)nn12 Amb29844671 [0,1,0,0,0,1|1,0,1]=4 394 B13R2.2136 NCc1nnc2ccc(F)cn12 Amb17210461 [0,1,0,0,0,1|1,0,1]=4 395 B13R2.2136 NCc1nnc2ccc(O)nn12 Amb27229193 [0,1,0,0,0,1|1,0,1]=4 396 B13R2.2136 NCc1nnc2ncc(Cl)cn12 Amb28075499 [0,1,0,0,0,1|1,0,1]=4 397 B13R2.2136 Nc1ccc2nnc(CO)n2c1 Amb18947661 [0,1,0,0,0,1|0,0,1]=3 398 B13R2.2136 O=CC1=NNC2=CC=C(Br)NN21 Amb18755667 [0,1,0,0,0,1|0,0,2]=4 399 B13R2.2136 O=Cc1cnc2ccc(Br)cn12 Amb19374501 [0,1,0,0,0,1|1,0,1]=4 400 B13R2.2136 O=Cc1cnc2ccc(Br)nn12 Amb18160664 [0,1,0,0,0,1|1,0,1]=4 401 B13R2.2136 O=Cc1cnc2ccc(Cl)cn12 Amb18824295 [0,1,0,0,0,1|1,0,1]=4 402 B13R2.2136 O=Cc1cnc2ccc(Cl)nn12 Amb17739809 [0,1,0,0,0,1|1,0,1]=4 403 B13R2.2136 O=Cc1cnc2ccc(F)cn12 Amb18829074 [0,1,0,0,0,1|1,0,1]=4 404 B13R2.2136 O=Cc1cnc2cnc(Br)cn12 Amb19149317 [0,1,0,0,0,1|1,0,1]=4 405 B13R2.2136 O=Cc1cnc2ncc(Cl)cn12 Amb27786347 [0,1,0,0,0,1|1,0,1]=4 406 B13R2.2136 O=Cc1ncc2ncc(Br)cn12 Amb33728681 [0,1,0,0,0,1|1,0,1]=4 407 B13R2.2136 OCc1cnc2ccc(Br)cn12 Amb17115493 [0,1,0,0,0,1|1,0,1]=4 408 B13R2.2136 OCc1cnc2ccc(Cl)cn12 Amb17115492 [0,1,0,0,0,1|1,0,1]=4 409 B13R2.2136 OCc1cnc2ccc(Cl)nn12 Amb22496984 [0,1,0,0,0,1|1,0,1]=4 410 B13R2.2136 OCc1cnc2ccc(F)cn12 Amb18262954 [0,1,0,0,0,1|1,0,1]=4 411 B13R2.2136 OCc1cnc2cnc(Br)cn12 Amb27394898 [0,1,0,0,0,1|1,0,1]=4 412 B13R2.2136 OCc1cnc2cnc(Cl)cn12 Amb28067688 [0,1,0,0,0,1|1,0,1]=4 413 B13R2.2136 OCc1nnc2ccc(Cl)nn12 Amb19057808 [0,1,0,0,0,1|0,0,1]=3 414 B13R2.2931 Cc1nc(C=O)n2ccccc12 Amb23454460 [0,1,0,0,0,1|1,0,1]=4 415 B13R2.2931 O=Cc1nc(Br)c2ccccn12 Amb33728223 [0,1,0,0,0,1|1,0,1]=4 416 B13R2.430 O=C(O)C1=Cn2cccc2CN1 Amb22495875 [0,1,0,0,0,1|1,0,1]=4 417 B13R2.430 O=C(O)c1cc2sccc2nn1 Amb18128591 [0,1,0,0,0,1|2,0,0]=4 418 B13R2.430 O=C(O)c1ccc2cccn2c1 Amb16232518 [0,1,0,0,0,1|2,0,0]=4 419 B13R2.430 O=C(O)c1cn2cccc2cn1 Amb22747148 [0,1,0,0,0,1|1,0,0]=3 420 B13R2.430 O=C(O)c1cn2ccnc2cn1 Amb22728065 [0,1,0,0,0,1|2,0,0]=4 421 B13R2.430 O=C(O)c1cnc2ccnn2c1 Amb13889372 [0,1,0,0,0,1|2,0,0]=4 422 B13R2.430 O=C(O)c1cnc2nccn2c1 Amb18829515 [0,1,0,0,0,1|2,0,0]=4 423 B13R2.430 O=C(O)c1cnc2nccn2n1 Amb27429112 [0,1,0,0,0,1|2,0,0]=4 424 B13R2.430 O=C(O)c1ncc2cccn2n1 Amb18829522 [0,1,0,0,0,1|1,0,0]=3 425 B13R2.430 O=C(O)c1ncc2cncn2n1 Amb18829096 [0,1,0,0,0,1|2,0,0]=4 426 B13R2.430 O=C(O)c1ncc2nccn2n1 Amb18829095 [0,1,0,0,0,1|2,0,0]=4 427 B13R2.5569 O=C(O)c1cccc2cccn12 Amb25150101 [0,1,0,0,0,1|2,0,0]=4 428 B13R2.5569 O=C(O)c1ccnc2ccnn12 Amb18829508 [0,1,0,0,0,1|2,0,0]=4 429 B13R2.5569 O=C(O)c1nccc2nccn12 Amb18829501 [0,1,0,0,0,1|2,0,0]=4 430 B13R2.5569 O=C(O)c1ncnc2ccsc12 Amb21960715 [0,1,0,0,0,1|2,0,0]=4 431 B13R2.5569 O=C(O)c1ncnc2sccc12 Amb28594298 [0,1,0,0,0,1|2,0,0]=4 432 B13R2.5569 O=C(O)c1ncnn2cccc12 Amb34158702 [0,1,0,0,0,1|2,0,0]=4 433 B13R2.283 Cc1nc2sccn2c1\C=N\O Amb21811934 [0,2,0,0,0,0|2,0,0]=4 434 B13R2.283 O\N=C\c1c(Cl)nc2sccn12 Amb24081660 [0,2,0,0,0,0|2,0,0]=4 435 B13R2.355 Cc1nc2sccn2c1C(=O)O Amb2388503 [0,2,0,0,0,0|2,0,0]=4 436 B13R2.355 Cc1nc2sccn2c1C(=O)O Amb32670628 [0,2,0,0,0,0|2,0,0]=4 437 B13R2.355 O=C(O)c1c(Br)nc2sccn12 Amb28368682 [0,2,0,0,0,0|2,0,0]=4 438 B13R2.355 O=C(O)c1c(Cl)nc2sccn12 Amb1106539 [0,2,0,0,0,0|2,0,0]=4 439 B13R2.687 O=C(O)Cc1cnc2sccn12 Amb18823796 [0,2,0,0,0,0|2,0,0]=4 440 B13R2.687 O=C(O)Cc1ncc2sccn12 Amb18823789 [0,2,0,0,0,0|2,0,0]=4 441 B13R2.687 O=C(O)Cc1nnc2ccnc12 Amb18828550 [0,2,0,0,0,0|2,0,0]=4 442 B13R2.687 O=C(O)Cc1nnc2nccc12 Amb18828549 [0,2,0,0,0,0|2,0,0]=4 443 B13R2.1095 C\C(=N/O)c1cnc2sccn12 Amb33742531 [0,2,0,0,0,0|2,0,0]=4 444 B13R2.1095 NCC(O)c1nnc2sccn12 Amb28061894 [0,2,0,0,0,0|1,0,1]=4 445 B13R2.3732 Cn1ccn2c(C(=N)N)nnc12 Amb27813215 [0,2,0,0,0,0|2,0,0]=4 446 B13R2.3732 Cn1ccn2c(C(N)=S)nnc12 Amb27857215 [0,2,0,0,0,0|1,1,0]=4 447 B13R2.3335 C=C1Cn2c(nnc2C(=O)O)S1 Amb35789296 [0,2,0,0,0,0|1,0,1]=4 448 B13R2.3335 CC(=O)c1nnc2sc(C)cn12 Amb18824189 [0,2,0,0,0,0|1,0,1]=4 449 B13R2.3335 Cc1cn2c(C(=O)O)cnc2s1 Amb17215486 [0,2,0,0,0,0|2,0,0]=4 450 B13R2.3749 Cc1csc2ncc(C(=O)O)n12 Amb17215824 [0,2,0,0,0,0|2,0,0]=4 451 B13R2.3749 O=C(O)c1cnc2scc(Br)n12 Amb28283497 [0,2,0,0,0,0|2,0,0]=4 452 B11R2.36 Brc1ccc2nncn2c1 Amb10067448 [0,0,1,1,0,0|2,0,0]=4 453 B11R2.36 Brc1cnc2cccn2c1 Amb22496217 [0,0,1,1,0,0|2,0,0]=4 454 B11R2.36 Clc1ccc2nncn2c1 Amb9677823 [0,0,1,1,0,0|2,0,0]=4 455 B11R2.36 Clc1cn2cnnc2cn1 Amb22735840 [0,0,1,1,0,0|2,0,0]=4 456 B11R2.36 Fc1ccc2nncn2c1 Amb25967540 [0,0,1,1,0,0|2,0,0]=4 457 B11R2.36 Ic1ccc2nncn2c1 Amb27780549 [0,0,1,1,0,0|2,0,0]=4 458 B11R2.36 Nc1ccc2nncn2c1 Amb17093668 [0,0,1,1,0,0|2,0,0]=4 459 B11R2.36 Nc1ccc2nncn2c1 Amb18090834 [0,0,1,1,0,0|2,0,0]=4 460 B11R2.36 Nc1cn2cnnc2cn1 Amb33191733 [0,0,1,1,0,0|2,0,0]=4 461 B11R2.36 Oc1ccc2nncn2c1 Amb28205353 [0,0,1,1,0,0|2,0,0]=4 462 B11R2.36 Oc1cn2ccnc2cn1 Amb10600581 [0,0,1,1,0,0|2,0,0]=4 463 B11R2.36 Oc1cnc2ccnn2c1 Amb28315099 [0,0,1,1,0,0|2,0,0]=4 464 B11R2.106 Brc1cccn2ccnc12 Amb23439178 [0,0,1,1,0,0|2,0,0]=4 465 B11R2.106 Brc1cccn2ccnc12 Amb8629929 [0,0,1,1,0,0|2,0,0]=4 466 B11R2.106 Brc1cccn2cncc12 Amb25861849 [0,0,1,1,0,0|2,0,0]=4 467 B11R2.106 Brc1cccn2cnnc12 Amb19149043 [0,0,1,1,0,0|1,0,0]=3 468 B11R2.106 Brc1cccn2nnnc12 Amb22831284 [0,0,1,1,0,0|2,0,0]=4 469 B11R2.106 Brc1cncn2cnnc12 Amb21963961 [0,0,1,1,0,0|2,0,0]=4 470 B11R2.106 Brc1nccn2cnnc12 Amb26511086 [0,0,1,1,0,0|2,0,0]=4 471 B11R2.106 Cc1cccn2ccnc12 Amb3650084 [0,0,1,1,0,0|2,0,0]=4 472 B11R2.106 Cc1cccn2cnnc12 Amb28239260 [0,0,1,1,0,0|1,0,0]=3 473 B11R2.106 Cc1ccnn2cnnc12 Amb28078016 [0,0,1,1,0,0|2,0,0]=4 474 B11R2.106 Clc1cccn2ccnc12 Amb22500659 [0,0,1,1,0,0|2,0,0]=4 475 B11R2.106 Clc1cccn2cncc12 Amb28124649 [0,0,1,1,0,0|2,0,0]=4 476 B11R2.106 Clc1cccn2cnnc12 Amb10067450 [0,0,1,1,0,0|1,0,0]=3 477 B11R2.106 Clc1cccn2nnnc12 Amb10071465 [0,0,1,1,0,0|2,0,0]=4 478 B11R2.106 Clc1cncn2cnnc12 Amb22496159 [0,0,1,1,0,0|2,0,0]=4 479 B11R2.106 Clc1nccn2cnnc12 Amb8388132 [0,0,1,1,0,0|2,0,0]=4 480 B11R2.106 Fc1cccn2ccnc12 Amb8629969 [0,0,1,1,0,0|2,0,0]=4 481 B11R2.106 Fc1cccn2cnnc12 Amb25844367 [0,0,1,1,0,0|1,0,0]=3 482 B11R2.106 Fc1cccn2nnnc12 Amb27446029 [0,0,1,1,0,0|2,0,0]=4 483 B11R2.106 Fc1nccn2cnnc12 Amb35642444 [0,0,1,1,0,0|2,0,0]=4 484 B11R2.106 Ic1cccn2ccnc12 Amb34911821 [0,0,1,1,0,0|2,0,0]=4 485 B11R2.106 Ic1ccnn2cnnc12 Amb33715334 [0,0,1,1,0,0|2,0,0]=4 486 B11R2.106 Nc1cccn2ccnc12 Amb16230433 [0,0,1,1,0,0|2,0,0]=4 487 B11R2.106 Nc1cccn2cncc12 Amb24081863 [0,0,1,1,0,0|2,0,0]=4 488 B11R2.106 Nc1cccn2cnnc12 Amb15701627 [0,0,1,1,0,0|1,0,0]=3 489 B11R2.106 Nc1cccn2nnnc12 Amb10608395 [0,0,1,1,0,0|2,0,0]=4 490 B11R2.106 Nc1ccnn2cnnc12 Amb27597699 [0,0,1,1,0,0|2,0,0]=4 491 B11R2.106 Nc1nccn2cnnc12 Amb19957562 [0,0,1,1,0,0|2,0,0]=4 492 B11R2.106 O=C1NC=Cn2cnnc21 Amb23597580 [0,0,1,1,0,0|1,0,1]=4 493 B11R2.106 Oc1cccc2cnoc12 Amb15701577 [0,0,1,1,0,0|2,0,0]=4 494 B11R2.106 Oc1cccc2cnsc12 Amb28198574 [0,0,1,1,0,0|2,0,0]=4 495 B11R2.106 Oc1cccc2csnc12 Amb27882576 [0,0,1,1,0,0|2,0,0]=4 496 B11R2.106 Oc1cccc2onnc12 Amb28368671 [0,0,1,1,0,0|2,0,0]=4 497 B11R2.106 Oc1cccn2ccnc12 Amb10068090 [0,0,1,1,0,0|1,0,0]=3 498 B11R2.106 Oc1cccn2ccnc12 Amb2439190 [0,0,1,1,0,0|1,0,0]=3 499 B11R2.106 Oc1cccn2cnnc12 Amb33712853 [0,0,1,1,0,0|0,0,0]=2 500 B11R2.106 Oc1cccn2ncnc12 Amb22492296 [0,0,1,1,0,0|2,0,0]=4 501 B11R2.106 Oc1cccn2nnnc12 Amb12805797 [0,0,1,1,0,0|1,0,0]=3 502 B11R2.106 Oc1ccnn2cnnc12 Amb28349352 [0,0,1,1,0,0|1,0,0]=3 503 B11R2.106 Oc1nccn2ccnc12 Amb19373687 [0,0,1,1,0,0|2,0,0]=4 504 B11R2.106 Oc1ncnn2cnnc12 Amb24683948 [0,0,1,1,0,0|2,0,0]=4 505 B11R2.106 Sc1nccn2cnnc12 Amb28200503 [0,0,1,1,0,0|1,1,0]=4 506 B11R2.2 c1ccn(-c2ccon2)c1 Amb3974109 [0,0,1,1,0,0|2,0,0]=4 507 B11R2.2 c1ccn(-c2cnns2)c1 Amb27198636 [0,0,1,1,0,0|2,0,0]=4 508 B11R2.2 c1ccn(-c2cnoc2)c1 Amb27629475 [0,0,1,1,0,0|1,0,0]=3 509 B11R2.2 c1ccn(-c2cnsc2)c1 Amb28122946 [0,0,1,1,0,0|1,1,0]=4 510 B11R2.2 c1ccn(-c2csnn2)c1 Amb35707364 [0,0,1,1,0,0|0,1,0]=3 511 B11R2.2 c1ccn(-c2nncs2)c1 Amb2235652 [0,0,1,1,0,0|2,0,0]=4 512 B11R2.2 c1ccn(-c2nnns2)c1 Amb35699585 [0,0,1,1,0,0|2,0,0]=4 513 B11R2.1 Brc1nnc2ccccn12 Amb19517088 [0,0,1,1,0,0|2,0,0]=4 514 B11R2.1 Brc1nnc2cnccn12 Amb21963559 [0,0,1,1,0,0|2,0,0]=4 515 B11R2.1 Cc1nnc2ccccn12 Amb21962429 [0,0,1,1,0,0|1,0,1]=4 516 B11R2.1 Cc1nnc2ccccn12 Amb22276084 [0,0,1,1,0,0|1,0,1]=4 517 B11R2.1 Cc1nnc2cnccn12 Amb22497634 [0,0,1,1,0,0|1,0,1]=4 518 B11R2.1 Clc1nnc2ccccn12 Amb5751343 [0,0,1,1,0,0|2,0,0]=4 519 B11R2.1 Clc1nnc2cnccn12 Amb23400181 [0,0,1,1,0,0|2,0,0]=4 520 B11R2.1 Nc1nnc2ccccn12 Amb19891300 [0,0,1,1,0,0|2,0,0]=4 521 B11R2.1 Nc1nnc2ccccn12 Amb6316209 [0,0,1,1,0,0|2,0,0]=4 522 B11R2.1 Nc1nnc2cnccn12 Amb23401334 [0,0,1,1,0,0|2,0,0]=4 523 B11R2.1 Oc1nnc2ccccn12 Amb2389927 [0,0,1,1,0,0|2,0,0]=4 524 B11R2.1 Sc1nnc2ccccn12 Amb1104122 [0,0,1,1,0,0|2,0,0]=4 525 B11R2.1 Sc1nnc2cnccn12 Amb23590633 [0,0,1,1,0,0|2,0,0]=4 526 B13R3.1901 c1cc2ccc3ncc(c1)n23 Amb27654992 [0,0,0,1,0,1|2,0,0]=4 527 B9R1.89 COC1=NC=CC=CN1 Amb27225691 [0,0,1,0,1,0|2,0,0]=4 528 B11R1.12 N=C\C(=C\O)c1ccccc1 Amb27397057 [0,0,1,0,0,1|2,0,0]=4 529 B13R2.57 OCc1nnc2ccccc2n1 Amb26374373 [0,0,0,0,0,2|1,0,1]=4 530 B13R2.1613 O=Cc1ncnc2ccccc12 Amb21963279 [0,0,0,0,0,2|1,0,1]=4 531 B13R2.1613 O=Cc1ncnc2cnccc12 Amb27410387 [0,0,0,0,0,2|1,0,1]=4 532 B13R2.1613 OCc1cnnc2ccccc12 Amb24473309 [0,0,0,0,0,2|1,0,1]=4 533 B13R2.1613 ONc1cnnc2ccccc12 Amb27776635 [0,0,0,0,0,2|2,0,0]=4 534 B13R2.1613 ONc1ncnc2ccccc12 Amb28456836 [0,0,0,0,0,2|2,0,0]=4 535 B13R2.1613 ONc1ncnc2ccncc12 Amb28145996 [0,0,0,0,0,2|2,0,0]=4 536 B13R2.1613 ONc1nncc2ccccc12 Amb27468446 [0,0,0,0,0,2|2,0,0]=4