0 B12R2.1081 Oc1cccc2c1CCCC2 271570a_203496583355_100012354034 [0,0,0,0,0,0|1,0,3]=4 1 B12R2.1081 Oc1cccc2c1CCCN2 271570a_203496583355_100010196365 [0,0,0,0,0,0|2,0,2]=4 2 B12R2.1081 Oc1cccc2c1CCCO2 271570a_203496583355_100010188023 [0,0,0,0,0,0|2,0,2]=4 3 B12R2.1081 Oc1cccc2c1CCN=C2 271570a_203496583355_100010982778 [0,0,0,0,0,0|2,0,1]=3 4 B12R2.1081 Oc1cccc2c1CCNC2 271570a_203496583355_100000756787 [0,0,0,0,0,0|2,0,2]=4 5 B12R2.1081 Oc1cccc2c1CNCC2 271570a_203496583355_100000687140 [0,0,0,0,0,0|2,0,2]=4 6 B12R2.1081 Oc1cccc2c1NCCO2 271570a_203496583355_100015018771 [0,0,0,0,0,0|1,0,3]=4 7 B12R2.1081 Oc1cccc2c1OCCC2 271570a_203496583355_100010204675 [0,0,0,0,0,0|1,0,3]=4 8 B12R2.1081 Oc1cccc2c1OCCN2 271570a_203496583355_100000726803 [0,0,0,0,0,0|2,0,2]=4 9 B12R2.1081 Oc1cccc2c1OCCO2 271570a_203496583355_100009815980 [0,0,0,0,0,0|2,0,2]=4 10 B12R2.1081 Oc1cccc2c1cccc2 271570a_203496583355_100000210605 [0,0,0,0,0,0|1,0,0]=1 11 B12R2.1081 Oc1cccc2c1cccn2 271570a_203496583355_100011290932 [0,0,0,0,0,0|2,0,0]=2 12 B12R2.1081 Oc1cccc2c1ccnc2 271570a_203496583355_100000186358 [0,0,0,0,0,0|2,0,0]=2 13 B12R2.1081 Oc1cccc2c1cncc2 271570a_203496583355_100000685578 [0,0,0,0,0,0|2,0,0]=2 14 B12R2.1081 Oc1cccc2c1cncn2 271570a_203496583355_100009814520 [0,0,0,0,0,0|3,0,0]=3 15 B12R2.1081 Oc1cccc2c1nccc2 271570a_203496583355_100011215545 [0,0,0,0,0,0|0,0,0]=0 16 B12R2.1081 Oc1cccc2c1nccn2 271570a_203496583355_100010003881 [0,0,0,0,0,0|1,0,0]=1 17 B12R2.1081 Oc1cccc2c1ncnc2 271570a_203496583355_100010246313 [0,0,0,0,0,0|1,0,0]=1 18 B12R2.1081 Oc1ccnc2c1cccc2 271570a_203496583355_100011215880 [0,0,0,0,0,0|2,0,0]=2 19 B12R2.1081 Oc1ccnc2c1cccn2 271570a_203496583355_100000087570 [0,0,0,0,0,0|3,0,0]=3 20 B12R2.1081 Oc1ccnc2c1cncc2 271570a_203496583355_100000095135 [0,0,0,0,0,0|3,0,0]=3 21 B12R2.1081 Oc1ccnc2c1nccn2 271570a_203496583355_100010783457 [0,0,0,0,0,0|2,0,0]=2 22 B12R2.1081 Oc1cncc2c1cccc2 271570a_203496583355_100000187577 [0,0,0,0,0,0|2,0,0]=2 23 B12R2.1081 Oc1cncc2c1cccn2 271570a_203496583355_100010211308 [0,0,0,0,0,0|3,0,0]=3 24 B12R2.1081 Oc1cncc2c1ccnc2 271570a_203496583355_100010134378 [0,0,0,0,0,0|3,0,0]=3 25 B12R2.1081 Oc1cncc2c1nccn2 271570a_203496583355_200010209543 [0,0,0,0,0,0|2,0,0]=2 26 B12R2.1081 Oc1cnnc2c1cccc2 271570a_203496583355_100000063506 [0,0,0,0,0,0|3,0,0]=3 27 B12R2.1081 Oc1nccc2c1cccc2 271570a_203496583355_100011934041 [0,0,0,0,0,0|2,0,0]=2 28 B12R2.1081 Oc1nccc2c1cccn2 271570a_203496583355_100000077681 [0,0,0,0,0,0|3,0,0]=3 29 B12R2.1081 Oc1nccc2c1cncc2 271570a_203496583355_100000116921 [0,0,0,0,0,0|3,0,0]=3 30 B12R2.1081 Oc1nccc2c1nccc2 271570a_203496583355_100010063729 [0,0,0,0,0,0|1,0,0]=1 31 B12R2.1081 Oc1nccc2c1nccn2 271570a_203496583355_100010063732 [0,0,0,0,0,0|2,0,0]=2 32 B12R2.1081 Oc1ncnc2c1cccc2 271570a_203496583355_100000217608 [0,0,0,0,0,0|3,0,0]=3 33 B12R2.1081 Oc1ncnc2c1cccn2 271570a_203496583355_100000026734 [0,0,0,0,0,0|4,0,0]=4 34 B12R2.1081 Oc1ncnc2c1ccnc2 271570a_203496583355_100000098430 [0,0,0,0,0,0|4,0,0]=4 35 B13R2.32 Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010221197 [0,1,0,0,0,0|2,0,0]=3 36 B13R2.32 Cc1c(ccc2c1cccn2)O 271570a_203496583355_200010137439 [0,1,0,0,0,0|3,0,0]=4 37 B13R2.32 Cc1c(ccc2c1nccc2)O 271570a_203496583355_100010214467 [0,1,0,0,0,0|1,0,0]=2 38 B13R2.32 Cc1c(ccc2c1nccn2)O 271570a_203496583355_100135414757 [0,1,0,0,0,0|2,0,0]=3 39 B13R2.32 Cc1ccc2ccccc2c1O 271570a_203496583355_100000759710 [0,1,0,0,0,0|1,0,0]=2 40 B13R2.32 Cc1ccc2cnccc2c1O 271570a_203496583355_100010204589 [0,1,0,0,0,0|2,0,0]=3 41 B13R2.32 Cc1cnc2ccccc2c1O 271570a_203496583355_100000092342 [0,1,0,0,0,0|2,0,0]=3 42 B13R2.32 Nc1c(ccc2c1cccc2)O 271570a_203496583355_100009817101 [0,1,0,0,0,0|2,0,0]=3 43 B13R2.32 Nc1c(ccc2c1cccn2)O 271570a_203496583355_200010235790 [0,1,0,0,0,0|3,0,0]=4 44 B13R2.32 Nc1c(ccc2c1ccnc2)O 271570a_203496583355_100010191621 [0,1,0,0,0,0|3,0,0]=4 45 B13R2.32 Nc1c(cnc2c1cccc2)O 271570a_203496583355_100009995562 [0,1,0,0,0,0|3,0,0]=4 46 B13R2.32 Nc1c(ncc2c1cccc2)O 271570a_203496583355_100000087573 [0,1,0,0,0,0|3,0,0]=4 47 B13R2.32 Nc1ccc2ccccc2c1O 271570a_203496583355_100000705303 [0,1,0,0,0,0|1,0,0]=2 48 B13R2.32 Nc1ccc2cnccc2c1O 271570a_203496583355_100010245214 [0,1,0,0,0,0|2,0,0]=3 49 B13R2.32 Nc1ccc2ncccc2c1O 271570a_203496583355_200009995563 [0,1,0,0,0,0|2,0,0]=3 50 B13R2.32 Nc1ccc2nccnc2c1O 271570a_203496583355_100000729981 [0,1,0,0,0,0|1,0,0]=2 51 B13R2.32 Nc1cnc2ccccc2c1O 271570a_203496583355_100012243074 [0,1,0,0,0,0|2,0,0]=3 52 B13R2.32 Nc1cnc2cccnc2c1O 271570a_203496583355_100009889961 [0,1,0,0,0,0|1,0,0]=2 53 B13R2.32 Nc1ncc2ccccc2c1O 271570a_203496583355_100009994184 [0,1,0,0,0,0|2,0,0]=3 54 B13R2.32 O=c1c(c[nH]c2c1cccc2)O 271570a_203496583355_100012339567 [0,1,0,0,0,0|2,0,1]=4 55 B13R2.32 O=c1c(coc2c1cccc2)O 271570a_203496583355_100009813851 [0,1,0,0,0,0|2,0,1]=4 56 B13R2.32 Oc1c(ccc2c1cccc2)Br 271570a_203496583355_100010090040 [0,1,0,0,0,0|1,0,0]=2 57 B13R2.32 Oc1c(ccc2c1ccnc2)F 271570a_203496583355_100010272212 [0,1,0,0,0,0|2,0,0]=3 58 B13R2.32 Oc1c(ccc2c1cncc2)F 271570a_203496583355_200015767032 [0,1,0,0,0,0|2,0,0]=3 59 B13R2.32 Oc1c(cnc2c1cccc2)Br 271570a_203496583355_200010179490 [0,1,0,0,0,0|2,0,0]=3 60 B13R2.32 Oc1ccc2ccccc2c1Br 271570a_203496583355_200010089984 [0,1,0,0,0,0|2,0,0]=3 61 B13R2.32 Oc1ccc2ccccc2c1F 271570a_203496583355_100009832041 [0,1,0,0,0,0|2,0,0]=3 62 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100000183829 [0,1,0,0,0,0|1,0,0]=2 63 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100009996032 [0,1,0,0,0,0|1,0,0]=2 64 B13R2.32 Oc1ccc2cccnc2c1F 271570a_203496583355_100010751467 [0,1,0,0,0,0|1,0,0]=2 65 B13R2.32 Oc1ccc2cccnc2c1O 271570a_203496583355_100009816563 [0,1,0,0,0,0|0,0,0]=1 66 B13R2.32 Oc1ccc2cccnc2c1O 271570a_203496583355_100010173343 [0,1,0,0,0,0|0,0,0]=1 67 B13R2.32 Oc1ccc2ccncc2c1O 271570a_203496583355_200010115057 [0,1,0,0,0,0|2,0,0]=3 68 B13R2.32 Oc1cnc2ccccc2c1Cl 271570a_203496583355_100012352519 [0,1,0,0,0,0|3,0,0]=4 69 B13R2.32 Oc1nnc2ccccc2c1O 271570a_203496583355_100000688347 [0,1,0,0,0,0|3,0,0]=4 70 B13R2.162 Cc1ccc2cccc(c2n1)O 271570a_203496583355_100011934484 [0,1,0,0,0,0|0,0,0]=1 71 B13R2.162 Cc1ccc2cncc(c2c1)O 271570a_203496583355_100009817139 [0,1,0,0,0,0|2,0,0]=3 72 B13R2.162 Cc1ccc2nccc(c2c1)O 271570a_203496583355_100000751279 [0,1,0,0,0,0|2,0,0]=3 73 B13R2.162 Cc1ccc2nccc(c2n1)O 271570a_203496583355_100009889967 [0,1,0,0,0,0|1,0,0]=2 74 B13R2.162 Cc1ccc2ncnc(c2c1)O 271570a_203496583355_100000743341 [0,1,0,0,0,0|3,0,0]=4 75 B13R2.162 Cc1cccc2c1cc(cc2)O 271570a_203496583355_100010089936 [0,1,0,0,0,0|2,0,0]=3 76 B13R2.162 Cc1cccc2c1nc(cc2)O 271570a_203496583355_100012002297 [0,1,0,0,0,0|1,0,0]=2 77 B13R2.162 Cc1ccnc2c1cc(cc2)O 271570a_203496583355_100009817033 [0,1,0,0,0,0|3,0,0]=4 78 B13R2.162 Cc1nccc2c1cc(cc2)O 271570a_203496583355_200010739692 [0,1,0,0,0,0|3,0,0]=4 79 B13R2.162 Nc1ccc2cccc(c2n1)O 271570a_203496583355_100000687151 [0,1,0,0,0,0|0,0,0]=1 80 B13R2.162 Nc1ccc2nccc(c2c1)O 271570a_203496583355_100009879071 [0,1,0,0,0,0|2,0,0]=3 81 B13R2.162 Nc1cccc2c1cc(cc2)O 271570a_203496583355_100010090012 [0,1,0,0,0,0|2,0,0]=3 82 B13R2.162 Nc1cccc2c1cc(cn2)O 271570a_203496583355_100010264086 [0,1,0,0,0,0|3,0,0]=4 83 B13R2.162 Nc1ccnc2c1cc(cc2)O 271570a_203496583355_100011620571 [0,1,0,0,0,0|3,0,0]=4 84 B13R2.162 Nc1ncc2cccc(c2n1)O 271570a_203496583355_200010988910 [0,1,0,0,0,0|1,0,0]=2 85 B13R2.162 Nc1nccc2c1cc(cc2)O 271570a_203496583355_100012352255 [0,1,0,0,0,0|3,0,0]=4 86 B13R2.162 Nc1ncnc2c1nc(cc2)O 271570a_203496583355_100011016601 [0,1,0,0,0,0|3,0,0]=4 87 B13R2.162 O=C1CCc2cccc(c2C1)O 271570a_203496583355_100010006498 [0,1,0,0,0,0|1,0,2]=4 88 B13R2.162 O=c1[nH]cnc2c1nc(cc2)O 271570a_203496583355_100000117605 [0,1,0,0,0,0|2,0,1]=4 89 B13R2.162 O=c1cc[nH]c2c1cc(cc2)O 271570a_203496583355_100000746092 [0,1,0,0,0,0|2,0,1]=4 90 B13R2.162 O=c1ccc2cccc(c2[nH]1)O 271570a_203496583355_100000688906 [0,1,0,0,0,0|0,0,1]=2 91 B13R2.162 O=c1ccnc2n1nc(cc2)O 271570a_203496583355_100000086298 [0,1,0,0,0,0|2,0,1]=4 92 B13R2.162 O=c1ccoc2c1cc(cc2)O 271570a_203496583355_100009813387 [0,1,0,0,0,0|2,0,1]=4 93 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010089991 [0,1,0,0,0,0|1,0,0]=2 94 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010169565 [0,1,0,0,0,0|1,0,0]=2 95 B13R2.162 Oc1ccc2cccc(c2n1)F 271570a_203496583355_100012017632 [0,1,0,0,0,0|1,0,0]=2 96 B13R2.162 Oc1ccc2cccc(c2n1)O 271570a_203496583355_100010153751 [0,1,0,0,0,0|0,0,0]=1 97 B13R2.162 Oc1ccc2ccnc(c2c1)O 271570a_203496583355_100000010956 [0,1,0,0,0,0|2,0,0]=3 98 B13R2.162 Oc1ccc2ccnc(c2c1)O 271570a_203496583355_200009844553 [0,1,0,0,0,0|2,0,0]=3 99 B13R2.162 Oc1ccc2cncc(c2c1)O 271570a_203496583355_100010136424 [0,1,0,0,0,0|2,0,0]=3 100 B13R2.162 Oc1ccc2cncc(c2n1)O 271570a_203496583355_100009812673 [0,1,0,0,0,0|1,0,0]=2 101 B13R2.162 Oc1ccc2nccc(c2c1)Cl 271570a_203496583355_100011310491 [0,1,0,0,0,0|3,0,0]=4 102 B13R2.162 Oc1ccc2nccc(c2c1)O 271570a_203496583355_100000075933 [0,1,0,0,0,0|2,0,0]=3 103 B13R2.162 Oc1ccc2nncc(c2c1)O 271570a_203496583355_100010074700 [0,1,0,0,0,0|3,0,0]=4 104 B13R2.162 Oc1ccnc2c1cc(cc2)Br 271570a_203496583355_100010189052 [0,1,0,0,0,0|2,0,0]=3 105 B13R2.162 Oc1ccnc2c1cc(cc2)F 271570a_203496583355_100011217270 [0,1,0,0,0,0|2,0,0]=3 106 B13R2.162 Oc1ccnc2c1nc(cc2)F 271570a_203496583355_100000719316 [0,1,0,0,0,0|1,0,0]=2 107 B13R2.162 Oc1cnc2cccc(c2c1)O 271570a_203496583355_200010153752 [0,1,0,0,0,0|2,0,0]=3 108 B13R2.162 Oc1cnc2ncnc(c2n1)O 271570a_203496583355_100010174828 [0,1,0,0,0,0|3,0,0]=4 109 B13R2.162 Oc1ncc2cccc(c2n1)O 271570a_203496583355_100010674811 [0,1,0,0,0,0|1,0,0]=2 110 B13R2.162 Oc1nccc2c1cc(cc2)F 271570a_203496583355_100010202866 [0,1,0,0,0,0|2,0,0]=3 111 B13R2.162 Oc1ncnc2c1cc(cc2)F 271570a_203496583355_100000743340 [0,1,0,0,0,0|3,0,0]=4 112 B13R2.328 Cc1cc(c2ccccc2n1)O 271570a_203496583355_100000764982 [0,1,0,0,0,0|2,0,0]=3 113 B13R2.328 Cc1cc(c2cccnc2n1)O 271570a_203496583355_100009885123 [0,1,0,0,0,0|3,0,0]=4 114 B13R2.328 Cc1cc(c2ncccc2c1)O 271570a_203496583355_100010113427 [0,1,0,0,0,0|0,0,0]=1 115 B13R2.328 Cc1cc(cc2c1nccc2)O 271570a_203496583355_100010130319 [0,1,0,0,0,0|1,0,0]=2 116 B13R2.328 Cc1cc(cc2c1nccn2)O 271570a_203496583355_100010080486 [0,1,0,0,0,0|2,0,0]=3 117 B13R2.328 Cc1cc(nc2c1cccc2)O 271570a_203496583355_100012354972 [0,1,0,0,0,0|3,0,0]=4 118 B13R2.328 Cc1cc2ccccc2c(n1)O 271570a_203496583355_100000698243 [0,1,0,0,0,0|2,0,0]=3 119 B13R2.328 Cc1nc(c2ccccc2n1)O 271570a_203496583355_100000230251 [0,1,0,0,0,0|3,0,0]=4 120 B13R2.328 Nc1cc(c2ccccc2c1)O 271570a_203496583355_100010089974 [0,1,0,0,0,0|1,0,0]=2 121 B13R2.328 Nc1cc(cc2c1cccc2)O 271570a_203496583355_100010171453 [0,1,0,0,0,0|2,0,0]=3 122 B13R2.328 Nc1cc(cc2c1cccn2)O 271570a_203496583355_200010263263 [0,1,0,0,0,0|3,0,0]=4 123 B13R2.328 Nc1cc(cc2c1nccc2)O 271570a_203496583355_100009814519 [0,1,0,0,0,0|1,0,0]=2 124 B13R2.328 Nc1cc(nc2c1cccc2)O 271570a_203496583355_100010197925 [0,1,0,0,0,0|3,0,0]=4 125 B13R2.328 Nc1cc2ccccc2c(n1)O 271570a_203496583355_100009814382 [0,1,0,0,0,0|2,0,0]=3 126 B13R2.328 Nc1cc2cccnc2c(n1)O 271570a_203496583355_100010205410 [0,1,0,0,0,0|1,0,0]=2 127 B13R2.328 Nc1cc2cnccc2c(n1)O 271570a_203496583355_100000690061 [0,1,0,0,0,0|3,0,0]=4 128 B13R2.328 Nc1nc(cc2c1cccc2)O 271570a_203496583355_100009957331 [0,1,0,0,0,0|3,0,0]=4 129 B13R2.328 O=c1cc([nH]c2c1cccc2)O 271570a_203496583355_100000090176 [0,1,0,0,0,0|2,0,1]=4 130 B13R2.328 O=c1cc(c2ccccc2[nH]1)O 271570a_203496583355_100000075698 [0,1,0,0,0,0|2,0,0]=3 131 B13R2.328 O=c1cc(c2cccnc2[nH]1)O 271570a_203496583355_100010499609 [0,1,0,0,0,0|3,0,0]=4 132 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010001680 [0,1,0,0,0,0|1,0,0]=2 133 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010089979 [0,1,0,0,0,0|1,0,0]=2 134 B13R2.328 Oc1cc(c2cnccc2c1)F 271570a_203496583355_100011068762 [0,1,0,0,0,0|3,0,0]=4 135 B13R2.328 Oc1cc(c2cnccc2c1)O 271570a_203496583355_100011009069 [0,1,0,0,0,0|2,0,0]=3 136 B13R2.328 Oc1cc(c2ncccc2c1)Cl 271570a_203496583355_200010369337 [0,1,0,0,0,0|1,0,0]=2 137 B13R2.328 Oc1cc(c2ncccc2c1)F 271570a_203496583355_100010234705 [0,1,0,0,0,0|1,0,0]=2 138 B13R2.328 Oc1cc(c2ncccc2c1)O 271570a_203496583355_100010248853 [0,1,0,0,0,0|0,0,0]=1 139 B13R2.328 Oc1cc(c2nccnc2c1)F 271570a_203496583355_100010079260 [0,1,0,0,0,0|2,0,0]=3 140 B13R2.328 Oc1cc(cc2c1nccc2)Br 271570a_203496583355_100010090713 [0,1,0,0,0,0|0,0,0]=1 141 B13R2.328 Oc1cc(cc2c1nccc2)F 271570a_203496583355_100010214460 [0,1,0,0,0,0|0,0,0]=1 142 B13R2.328 Oc1cc(cc2c1nccn2)F 271570a_203496583355_100011083936 [0,1,0,0,0,0|1,0,0]=2 143 B13R2.328 [O-][n+]1cc(c2ccccc2c1)O 271570a_203496583355_100009995557 [0,1,0,0,0,0|2,0,0]=3 144 B13R2.328 [O-][n+]1cc(cc2c1cccc2)O 271570a_203496583355_200010000521 [0,1,0,0,0,0|2,0,1]=4 145 B13R2.342 Cc1cccc2c1ccnc2O 271570a_203496583355_100012002547 [0,1,0,0,0,0|2,0,0]=3 146 B13R2.342 Cc1cccc2c1nccc2O 271570a_203496583355_100000751276 [0,1,0,0,0,0|1,0,0]=2 147 B13R2.342 Cc1cccc2c1ncnc2O 271570a_203496583355_100000751292 [0,1,0,0,0,0|2,0,0]=3 148 B13R2.342 Cc1ccnc2c1cccc2O 271570a_203496583355_100010254272 [0,1,0,0,0,0|0,0,0]=1 149 B13R2.342 Cc1ccnc2c1nccc2O 271570a_203496583355_200013369187 [0,1,0,0,0,0|1,0,0]=2 150 B13R2.342 Cc1nccc2c1cccc2O 271570a_203496583355_100010137443 [0,1,0,0,0,0|2,0,0]=3 151 B13R2.342 Nc1cccc2c1cccc2O 271570a_203496583355_100009816864 [0,1,0,0,0,0|1,0,0]=2 152 B13R2.342 Nc1cccc2c1ccnc2O 271570a_203496583355_100000070072 [0,1,0,0,0,0|2,0,0]=3 153 B13R2.342 Nc1cccc2c1nccc2O 271570a_203496583355_100009892510 [0,1,0,0,0,0|1,0,0]=2 154 B13R2.342 Nc1ccnc2c1cccc2O 271570a_203496583355_100011620713 [0,1,0,0,0,0|0,0,0]=1 155 B13R2.342 Nc1nccc2c1cccc2O 271570a_203496583355_103549770558 [0,1,0,0,0,0|2,0,0]=3 156 B13R2.342 Nc1ncnc2c1cccc2O 271570a_203496583355_100010199759 [0,1,0,0,0,0|1,0,0]=2 157 B13R2.342 O=C1CCCc2c1cccc2O 271570a_203496583355_100000691372 [0,1,0,0,0,0|1,0,2]=4 158 B13R2.342 O=C1CCNc2c1cccc2O 271570a_203496583355_115082355814 [0,1,0,0,0,0|0,0,3]=4 159 B13R2.342 O=C1CCOc2c1cccc2O 271570a_203496583355_100000744318 [0,1,0,0,0,0|1,0,2]=4 160 B13R2.342 O=C1CCSc2c1cccc2O 271570a_203496583355_100011271337 [0,1,0,0,0,0|1,0,2]=4 161 B13R2.342 O=C1NCCc2c1cccc2O 271570a_203496583355_100000695023 [0,1,0,0,0,0|2,0,1]=4 162 B13R2.342 O=c1[nH]ccc2c1cccc2O 271570a_203496583355_100000703947 [0,1,0,0,0,0|2,0,0]=3 163 B13R2.342 O=c1[nH]cnc2c1cncc2O 271570a_203496583355_200010117198 [0,1,0,0,0,0|2,0,0]=3 164 B13R2.342 O=c1cc[nH]c2c1cccc2O 271570a_203496583355_100000749886 [0,1,0,0,0,0|0,0,1]=2 165 B13R2.342 Oc1cccc2c1cccc2F 271570a_203496583355_100009817034 [0,1,0,0,0,0|1,0,0]=2 166 B13R2.342 Oc1cccc2c1cccc2O 271570a_203496583355_100010003857 [0,1,0,0,0,0|1,0,0]=2 167 B13R2.342 Oc1cccc2c1ccnc2Cl 271570a_203496583355_100010080171 [0,1,0,0,0,0|2,0,0]=3 168 B13R2.342 Oc1ccnc2c1cccc2F 271570a_203496583355_100011934723 [0,1,0,0,0,0|1,0,0]=2 169 B13R2.342 Oc1ccnc2c1cccc2O 271570a_203496583355_100000703299 [0,1,0,0,0,0|0,0,0]=1 170 B13R2.342 Oc1cncc2c1cccc2F 271570a_203496583355_100010740057 [0,1,0,0,0,0|2,0,0]=3 171 B13R2.342 Oc1nccc2c1cccc2F 271570a_203496583355_100012180906 [0,1,0,0,0,0|2,0,0]=3 172 B13R2.342 Oc1ncnc2c1cccc2F 271570a_203496583355_100000693626 [0,1,0,0,0,0|2,0,0]=3 173 B13R2.342 Oc1ncnc2c1cccc2O 271570a_203496583355_100010201916 [0,1,0,0,0,0|1,0,0]=2 174 B13R2.371 Cc1ccc(c2c1cccc2)O 271570a_203496583355_100011215156 [0,1,0,0,0,0|1,0,0]=2 175 B13R2.371 Cc1ccc(c2c1nccc2)O 271570a_203496583355_100000694312 [0,1,0,0,0,0|1,0,0]=2 176 B13R2.371 Cc1cnc(c2c1cccc2)O 271570a_203496583355_100000112005 [0,1,0,0,0,0|2,0,0]=3 177 B13R2.371 Cc1ncc(c2c1cccc2)O 271570a_203496583355_100010239772 [0,1,0,0,0,0|2,0,0]=3 178 B13R2.371 Cc1nnc(c2c1cccc2)O 271570a_203496583355_100000189618 [0,1,0,0,0,0|3,0,0]=4 179 B13R2.371 Nc1ccc(c2c1cccc2)O 271570a_203496583355_100000766797 [0,1,0,0,0,0|1,0,0]=2 180 B13R2.371 Nc1ccc(c2c1cccn2)O 271570a_203496583355_100012360041 [0,1,0,0,0,0|0,0,0]=1 181 B13R2.371 Nc1ccc(c2c1ccnc2)O 271570a_203496583355_200012344021 [0,1,0,0,0,0|2,0,0]=3 182 B13R2.371 Nc1ccc(c2c1cncc2)O 271570a_203496583355_100011218454 [0,1,0,0,0,0|2,0,0]=3 183 B13R2.371 Nc1ccc(c2c1nccc2)O 271570a_203496583355_100000726955 [0,1,0,0,0,0|1,0,0]=2 184 B13R2.371 Nc1cnc(c2c1cccc2)O 271570a_203496583355_200009868590 [0,1,0,0,0,0|2,0,0]=3 185 B13R2.371 Nc1ncc(c2c1cccc2)O 271570a_203496583355_100010158575 [0,1,0,0,0,0|2,0,0]=3 186 B13R2.371 Nc1ncc(c2c1cccn2)O 271570a_203496583355_100010383929 [0,1,0,0,0,0|1,0,0]=2 187 B13R2.371 O=c1[nH]cc(c2c1cncc2)O 271570a_203496583355_100010090797 [0,1,0,0,0,0|3,0,0]=4 188 B13R2.371 O=c1[nH]nc(c2c1cccc2)O 271570a_203496583355_100010235092 [0,1,0,0,0,0|3,0,0]=4 189 B13R2.371 O=c1[nH]nc(c2c1cccn2)O 271570a_203496583355_200021304518 [0,1,0,0,0,0|2,0,0]=3 190 B13R2.371 O=c1[nH]nc(c2c1nccc2)O 271570a_203496583355_100021647086 [0,1,0,0,0,0|2,0,1]=4 191 B13R2.371 Oc1ccc(c2c1cccc2)Br 271570a_203496583355_100012339872 [0,1,0,0,0,0|1,0,0]=2 192 B13R2.371 Oc1ccc(c2c1cccc2)F 271570a_203496583355_100011218216 [0,1,0,0,0,0|1,0,0]=2 193 B13R2.371 Oc1ccc(c2c1cccc2)O 271570a_203496583355_100000186334 [0,1,0,0,0,0|1,0,0]=2 194 B13R2.371 Oc1ccc(c2c1cccn2)F 271570a_203496583355_100010245834 [0,1,0,0,0,0|1,0,0]=2 195 B13R2.371 Oc1ccc(c2c1cccn2)O 271570a_203496583355_100011934063 [0,1,0,0,0,0|0,0,0]=1 196 B13R2.371 Oc1ccc(c2c1ccnc2)F 271570a_203496583355_100000698020 [0,1,0,0,0,0|2,0,0]=3 197 B13R2.371 Oc1ccc(c2c1cncc2)F 271570a_203496583355_100010244717 [0,1,0,0,0,0|2,0,0]=3 198 B13R2.371 Oc1ccc(c2c1nccc2)F 271570a_203496583355_100010214461 [0,1,0,0,0,0|0,0,0]=1 199 B13R2.371 Oc1cnc(c2c1cccc2)O 271570a_203496583355_100000067196 [0,1,0,0,0,0|2,0,0]=3 200 B13R2.371 Oc1cnc(c2c1cccc2)O 271570a_203496583355_100009816523 [0,1,0,0,0,0|2,0,0]=3 201 B13R2.371 [O-][n+]1ccc(c2c1cccc2)O 271570a_203496583355_100020656173 [0,1,0,0,0,0|2,0,0]=3 202 B13R2.1613 C=Cc1cccc2c1cccc2 271570a_100011290941_100000210605 [0,1,0,0,0,0|2,0,0]=3 203 B13R2.1613 C=Cc1cccc2c1cccn2 271570a_100011290941_100011290932 [0,1,0,0,0,0|3,0,0]=4 204 B13R2.1613 C=Cc1cccc2c1ccnc2 271570a_100011290941_100000186358 [0,1,0,0,0,0|3,0,0]=4 205 B13R2.1613 C=Cc1cccc2c1cncc2 271570a_100011290941_100000685578 [0,1,0,0,0,0|3,0,0]=4 206 B13R2.1613 C=Cc1cccc2c1nccc2 271570a_100011290941_100011215545 [0,1,0,0,0,0|1,0,0]=2 207 B13R2.1613 C=Cc1cccc2c1nccn2 271570a_100011290941_100010003881 [0,1,0,0,0,0|2,0,0]=3 208 B13R2.1613 C=Cc1cccc2c1ncnc2 271570a_100011290941_100010246313 [0,1,0,0,0,0|2,0,0]=3 209 B13R2.1613 C=Cc1ccnc2c1cccc2 271570a_100011290941_100011215880 [0,1,0,0,0,0|3,0,0]=4 210 B13R2.1613 C=Cc1ccnc2c1nccn2 271570a_100011290941_100010783457 [0,1,0,0,0,0|3,0,0]=4 211 B13R2.1613 C=Cc1cncc2c1cccc2 271570a_100011290941_100000187577 [0,1,0,0,0,0|3,0,0]=4 212 B13R2.1613 C=Cc1cncc2c1nccn2 271570a_100011290941_200010209543 [0,1,0,0,0,0|3,0,0]=4 213 B13R2.1613 C=Cc1nccc2c1cccc2 271570a_100011290941_100011934041 [0,1,0,0,0,0|3,0,0]=4 214 B13R2.1613 C=Cc1nccc2c1nccc2 271570a_100011290941_100010063729 [0,1,0,0,0,0|2,0,0]=3 215 B13R2.1613 C=Cc1nccc2c1nccn2 271570a_100011290941_100010063732 [0,1,0,0,0,0|3,0,0]=4 216 B13R2.1613 CNc1cccc2c1cccc2 34a_100000185869_200000210301 [0,1,0,0,0,0|2,0,0]=3 217 B13R2.1613 CNc1cccc2c1cccn2 27a_100102657272_100011290932 [0,1,0,0,0,0|3,0,0]=4 218 B13R2.1613 CNc1cccc2c1cccn2 34a_100000183906_200000210301 [0,1,0,0,0,0|3,0,0]=4 219 B13R2.1613 CNc1cccc2c1nccc2 34a_100000181377_200000210301 [0,1,0,0,0,0|1,0,0]=2 220 B13R2.1613 CNc1cccc2c1nccn2 27a_100102657272_100010003881 [0,1,0,0,0,0|2,0,0]=3 221 B13R2.1613 CNc1cccc2c1ncnc2 27a_100102657272_100010246313 [0,1,0,0,0,0|2,0,0]=3 222 B13R2.1613 CNc1ccnc2c1cccc2 27a_100102657272_100011215880 [0,1,0,0,0,0|3,0,0]=4 223 B13R2.1613 CNc1ccnc2c1nccn2 27a_100102657272_100010783457 [0,1,0,0,0,0|3,0,0]=4 224 B13R2.1613 CNc1cncc2c1nccn2 27a_100102657272_200010209543 [0,1,0,0,0,0|3,0,0]=4 225 B13R2.1613 CNc1nccc2c1cccc2 27a_100102657272_100011934041 [0,1,0,0,0,0|3,0,0]=4 226 B13R2.1613 CNc1nccc2c1nccc2 27a_100102657272_100010063729 [0,1,0,0,0,0|2,0,0]=3 227 B13R2.1613 CNc1nccc2c1nccn2 27a_100102657272_100010063732 [0,1,0,0,0,0|3,0,0]=4 228 B13R2.1613 CNc1ncnc2c1nccc2 27a_100102657272_100000063688 [0,1,0,0,0,0|3,0,0]=4 229 B13R2.1613 COc1cccc2c1CC=CC2 34a_100000074931_200000210301 [0,1,0,0,0,0|1,0,1]=3 230 B13R2.1613 COc1cccc2c1CC=CC2 7a_100000074931_200000210301 [0,1,0,0,0,0|1,0,1]=3 231 B13R2.1613 COc1cccc2c1cccc2 34a_100000210388_200000210301 [0,1,0,0,0,0|1,0,0]=2 232 B13R2.1613 COc1cccc2c1cccc2 7a_100000210388_200000210301 [0,1,0,0,0,0|1,0,0]=2 233 B13R2.1613 COc1cccc2c1cccn2 34a_100011197808_200000210301 [0,1,0,0,0,0|2,0,0]=3 234 B13R2.1613 COc1cccc2c1ccnc2 34a_100011218533_200000210301 [0,1,0,0,0,0|2,0,0]=3 235 B13R2.1613 COc1cccc2c1cncc2 34a_103624766955_200000210301 [0,1,0,0,0,0|2,0,0]=3 236 B13R2.1613 COc1cccc2c1nccc2 34a_100000056035_200000210301 [0,1,0,0,0,0|0,0,0]=1 237 B13R2.1613 COc1cccc2c1nccn2 34a_100000077048_200000210301 [0,1,0,0,0,0|1,0,0]=2 238 B13R2.1613 COc1cccc2c1ncnc2 34a_200000077003_200000210301 [0,1,0,0,0,0|1,0,0]=2 239 B13R2.1613 COc1cncc2c1cccc2 34a_100000066178_200000210301 [0,1,0,0,0,0|2,0,0]=3 240 B13R2.1613 COc1cncc2c1cccc2 7a_100000066178_200000210301 [0,1,0,0,0,0|2,0,0]=3 241 B13R2.1613 COc1nccc2c1cccc2 34a_102531767632_200000210301 [0,1,0,0,0,0|2,0,0]=3 242 B13R2.1613 CSc1cccc2c1cccc2 62a_200000210301_100000210605 [0,1,0,0,0,0|1,1,0]=3 243 B13R2.1613 CSc1cccc2c1cccn2 62a_100011290932_200000210301 [0,1,0,0,0,0|2,1,0]=4 244 B13R2.1613 CSc1cccc2c1cccn2 62a_200000210301_100011290932 [0,1,0,0,0,0|2,1,0]=4 245 B13R2.1613 CSc1cccc2c1ccnc2 62a_100000186358_200000210301 [0,1,0,0,0,0|2,1,0]=4 246 B13R2.1613 CSc1cccc2c1ccnc2 62a_200000210301_100000186358 [0,1,0,0,0,0|2,1,0]=4 247 B13R2.1613 CSc1cccc2c1cncc2 62a_100000685578_200000210301 [0,1,0,0,0,0|2,1,0]=4 248 B13R2.1613 CSc1cccc2c1cncc2 62a_200000210301_100000685578 [0,1,0,0,0,0|2,1,0]=4 249 B13R2.1613 CSc1cccc2c1nccc2 62a_200000210301_100011215545 [0,1,0,0,0,0|0,1,0]=2 250 B13R2.1613 CSc1cccc2c1nccn2 62a_100010003881_200000210301 [0,1,0,0,0,0|1,1,0]=3 251 B13R2.1613 CSc1cccc2c1nccn2 62a_200000210301_100010003881 [0,1,0,0,0,0|1,1,0]=3 252 B13R2.1613 CSc1cccc2c1ncnc2 62a_100010246313_200000210301 [0,1,0,0,0,0|1,1,0]=3 253 B13R2.1613 CSc1cccc2c1ncnc2 62a_200000210301_100010246313 [0,1,0,0,0,0|1,1,0]=3 254 B13R2.1613 CSc1ccnc2c1cccc2 62a_100011458314_200000210301 [0,1,0,0,0,0|2,1,0]=4 255 B13R2.1613 CSc1ccnc2c1cccc2 62a_200000210301_100011215880 [0,1,0,0,0,0|2,1,0]=4 256 B13R2.1613 CSc1ccnc2c1nccn2 62a_100010783457_200000210301 [0,1,0,0,0,0|2,1,0]=4 257 B13R2.1613 CSc1ccnc2c1nccn2 62a_200000210301_100010783457 [0,1,0,0,0,0|2,1,0]=4 258 B13R2.1613 CSc1cncc2c1cccc2 62a_100000187577_200000210301 [0,1,0,0,0,0|2,1,0]=4 259 B13R2.1613 CSc1cncc2c1cccc2 62a_200000210301_100000187577 [0,1,0,0,0,0|2,1,0]=4 260 B13R2.1613 CSc1cncc2c1nccn2 62a_200000210301_200010209543 [0,1,0,0,0,0|2,1,0]=4 261 B13R2.1613 CSc1cncc2c1nccn2 62a_200010209543_200000210301 [0,1,0,0,0,0|2,1,0]=4 262 B13R2.1613 CSc1nccc2c1cccc2 62a_100011934041_200000210301 [0,1,0,0,0,0|2,1,0]=4 263 B13R2.1613 CSc1nccc2c1cccc2 62a_200000210301_100011934041 [0,1,0,0,0,0|2,1,0]=4 264 B13R2.1613 CSc1nccc2c1nccc2 62a_200000210301_100010063729 [0,1,0,0,0,0|1,1,0]=3 265 B13R2.1613 CSc1nccc2c1nccn2 62a_100010063732_200000210301 [0,1,0,0,0,0|2,1,0]=4 266 B13R2.1613 CSc1nccc2c1nccn2 62a_200000210301_100010063732 [0,1,0,0,0,0|2,1,0]=4 267 B13R2.1613 CSc1ncnc2c1nccc2 62a_200000210301_100000063688 [0,1,0,0,0,0|2,1,0]=4 268 B13R2.1613 [13CH3]Nc1cccc2c1cccc2 34a_100000185869_200025704644 [0,1,0,0,0,0|2,0,0]=3 269 B13R2.1613 [13CH3]Nc1cccc2c1cccn2 34a_100000183906_200025704644 [0,1,0,0,0,0|3,0,0]=4 270 B13R2.1613 [13CH3]Nc1cccc2c1nccc2 34a_100000181377_200025704644 [0,1,0,0,0,0|1,0,0]=2 271 B13R2.1613 [13CH3]Oc1cccc2c1CC=CC2 34a_100000074931_200025704644 [0,1,0,0,0,0|1,0,1]=3 272 B13R2.1613 [13CH3]Oc1cccc2c1CC=CC2 7a_100000074931_200025704644 [0,1,0,0,0,0|1,0,1]=3 273 B13R2.1613 [13CH3]Oc1cccc2c1cccc2 34a_100000210388_200025704644 [0,1,0,0,0,0|1,0,0]=2 274 B13R2.1613 [13CH3]Oc1cccc2c1cccc2 7a_100000210388_200025704644 [0,1,0,0,0,0|1,0,0]=2 275 B13R2.1613 [13CH3]Oc1cccc2c1cccn2 34a_100011197808_200025704644 [0,1,0,0,0,0|2,0,0]=3 276 B13R2.1613 [13CH3]Oc1cccc2c1ccnc2 34a_100011218533_200025704644 [0,1,0,0,0,0|2,0,0]=3 277 B13R2.1613 [13CH3]Oc1cccc2c1cncc2 34a_103624766955_200025704644 [0,1,0,0,0,0|2,0,0]=3 278 B13R2.1613 [13CH3]Oc1cccc2c1nccc2 34a_100000056035_200025704644 [0,1,0,0,0,0|0,0,0]=1 279 B13R2.1613 [13CH3]Oc1cccc2c1nccn2 34a_100000077048_200025704644 [0,1,0,0,0,0|1,0,0]=2 280 B13R2.1613 [13CH3]Oc1cccc2c1ncnc2 34a_200000077003_200025704644 [0,1,0,0,0,0|1,0,0]=2 281 B13R2.1613 [13CH3]Oc1cncc2c1cccc2 34a_100000066178_200025704644 [0,1,0,0,0,0|2,0,0]=3 282 B13R2.1613 [13CH3]Oc1cncc2c1cccc2 7a_100000066178_200025704644 [0,1,0,0,0,0|2,0,0]=3 283 B13R2.1613 [13CH3]Oc1nccc2c1cccc2 34a_102531767632_200025704644 [0,1,0,0,0,0|2,0,0]=3 284 B13R2.1613 [13CH3]Sc1cccc2c1cccc2 62a_200025704644_100000210605 [0,1,0,0,0,0|1,1,0]=3 285 B13R2.1613 [13CH3]Sc1cccc2c1cccn2 62a_100011290932_200025704644 [0,1,0,0,0,0|2,1,0]=4 286 B13R2.1613 [13CH3]Sc1cccc2c1cccn2 62a_200025704644_100011290932 [0,1,0,0,0,0|2,1,0]=4 287 B13R2.1613 [13CH3]Sc1cccc2c1ccnc2 62a_100000186358_200025704644 [0,1,0,0,0,0|2,1,0]=4 288 B13R2.1613 [13CH3]Sc1cccc2c1ccnc2 62a_200025704644_100000186358 [0,1,0,0,0,0|2,1,0]=4 289 B13R2.1613 [13CH3]Sc1cccc2c1cncc2 62a_100000685578_200025704644 [0,1,0,0,0,0|2,1,0]=4 290 B13R2.1613 [13CH3]Sc1cccc2c1cncc2 62a_200025704644_100000685578 [0,1,0,0,0,0|2,1,0]=4 291 B13R2.1613 [13CH3]Sc1cccc2c1nccc2 62a_200025704644_100011215545 [0,1,0,0,0,0|0,1,0]=2 292 B13R2.1613 [13CH3]Sc1cccc2c1nccn2 62a_100010003881_200025704644 [0,1,0,0,0,0|1,1,0]=3 293 B13R2.1613 [13CH3]Sc1cccc2c1nccn2 62a_200025704644_100010003881 [0,1,0,0,0,0|1,1,0]=3 294 B13R2.1613 [13CH3]Sc1cccc2c1ncnc2 62a_100010246313_200025704644 [0,1,0,0,0,0|1,1,0]=3 295 B13R2.1613 [13CH3]Sc1cccc2c1ncnc2 62a_200025704644_100010246313 [0,1,0,0,0,0|1,1,0]=3 296 B13R2.1613 [13CH3]Sc1ccnc2c1cccc2 62a_100011458314_200025704644 [0,1,0,0,0,0|2,1,0]=4 297 B13R2.1613 [13CH3]Sc1ccnc2c1cccc2 62a_200025704644_100011215880 [0,1,0,0,0,0|2,1,0]=4 298 B13R2.1613 [13CH3]Sc1ccnc2c1nccn2 62a_100010783457_200025704644 [0,1,0,0,0,0|2,1,0]=4 299 B13R2.1613 [13CH3]Sc1ccnc2c1nccn2 62a_200025704644_100010783457 [0,1,0,0,0,0|2,1,0]=4 300 B13R2.1613 [13CH3]Sc1cncc2c1cccc2 62a_100000187577_200025704644 [0,1,0,0,0,0|2,1,0]=4 301 B13R2.1613 [13CH3]Sc1cncc2c1cccc2 62a_200025704644_100000187577 [0,1,0,0,0,0|2,1,0]=4 302 B13R2.1613 [13CH3]Sc1cncc2c1nccn2 62a_200010209543_200025704644 [0,1,0,0,0,0|2,1,0]=4 303 B13R2.1613 [13CH3]Sc1cncc2c1nccn2 62a_200025704644_200010209543 [0,1,0,0,0,0|2,1,0]=4 304 B13R2.1613 [13CH3]Sc1nccc2c1cccc2 62a_100011934041_200025704644 [0,1,0,0,0,0|2,1,0]=4 305 B13R2.1613 [13CH3]Sc1nccc2c1cccc2 62a_200025704644_100011934041 [0,1,0,0,0,0|2,1,0]=4 306 B13R2.1613 [13CH3]Sc1nccc2c1nccc2 62a_200025704644_100010063729 [0,1,0,0,0,0|1,1,0]=3 307 B13R2.1613 [13CH3]Sc1nccc2c1nccn2 62a_100010063732_200025704644 [0,1,0,0,0,0|2,1,0]=4 308 B13R2.1613 [13CH3]Sc1nccc2c1nccn2 62a_200025704644_100010063732 [0,1,0,0,0,0|2,1,0]=4 309 B13R2.1613 [13CH3]Sc1ncnc2c1nccc2 62a_200025704644_100000063688 [0,1,0,0,0,0|2,1,0]=4 310 B13R2.4818 Cc1cccc2c1c(ccc2)O 271570a_203496583355_100009995290 [0,1,0,0,0,0|1,0,0]=2 311 B13R2.4818 Cc1cncc2c1c(ccc2)O 271570a_203496583355_100009817140 [0,1,0,0,0,0|2,0,0]=3 312 B13R2.4818 Nc1cccc2c1c(ccc2)O 271570a_203496583355_100010002837 [0,1,0,0,0,0|1,0,0]=2 313 B13R2.4818 Nc1cccc2c1c(ccn2)O 271570a_203496583355_100010263589 [0,1,0,0,0,0|2,0,0]=3 314 B13R2.4818 Nc1cccc2c1c(cnc2)O 271570a_203496583355_100000720362 [0,1,0,0,0,0|2,0,0]=3 315 B13R2.4818 Nc1nccc2c1c(ccc2)O 271570a_203496583355_100010291105 [0,1,0,0,0,0|2,0,0]=3 316 B13R2.4818 Nc1ncnc2c1c(ccc2)O 271570a_203496583355_100010171649 [0,1,0,0,0,0|3,0,0]=4 317 B13R2.4818 O=c1[nH]cnc2c1c(ccc2)O 271570a_203496583355_100000696754 [0,1,0,0,0,0|3,0,0]=4 318 B13R2.4818 Oc1cccc2c1c(ccc2)Br 271570a_203496583355_100010243825 [0,1,0,0,0,0|1,0,0]=2 319 B13R2.4818 Oc1cccc2c1c(ccc2)F 271570a_203496583355_100010177852 [0,1,0,0,0,0|1,0,0]=2 320 B13R2.4818 Oc1cccc2c1c(ccc2)O 271570a_203496583355_100010089961 [0,1,0,0,0,0|1,0,0]=2 321 B13R2.4818 Oc1cccc2c1c(ccn2)O 271570a_203496583355_100010187735 [0,1,0,0,0,0|2,0,0]=3 322 B13R2.4818 Oc1cccc2c1c(ncc2)O 271570a_203496583355_100010162479 [0,1,0,0,0,0|2,0,0]=3 323 B13R2.4818 Oc1ncnc2c1c(ccc2)F 271570a_203496583355_100000743342 [0,1,0,0,0,0|3,0,0]=4 324 B13R2.5179 Cc1ccc2c(cccc2n1)O 271570a_203496583355_100010173736 [0,1,0,0,0,0|2,0,0]=3 325 B13R2.5179 Cc1ccc2c(nccc2c1)O 271570a_203496583355_100000102439 [0,1,0,0,0,0|2,0,0]=3 326 B13R2.5179 Cc1ccc2c(ncnc2c1)O 271570a_203496583355_100000099684 [0,1,0,0,0,0|3,0,0]=4 327 B13R2.5179 Cc1cccc2c1ncc(c2)O 271570a_203496583355_100009829671 [0,1,0,0,0,0|1,0,0]=2 328 B13R2.5179 Cc1ccnc2c1ccc(c2)O 271570a_203496583355_100010132309 [0,1,0,0,0,0|3,0,0]=4 329 B13R2.5179 Nc1cc2cccc(c2cn1)O 271570a_203496583355_100010201637 [0,1,0,0,0,0|2,0,0]=3 330 B13R2.5179 Nc1ccc2c(cccc2n1)O 271570a_203496583355_100000723655 [0,1,0,0,0,0|2,0,0]=3 331 B13R2.5179 Nc1cccc2c1ccc(c2)O 271570a_203496583355_100010090037 [0,1,0,0,0,0|2,0,0]=3 332 B13R2.5179 Nc1cccc2c1ncc(c2)O 271570a_203496583355_100000702407 [0,1,0,0,0,0|1,0,0]=2 333 B13R2.5179 Nc1ccnc2c1ccc(c2)O 271570a_203496583355_200009816820 [0,1,0,0,0,0|3,0,0]=4 334 B13R2.5179 Nc1ncc2c(cccc2n1)O 271570a_203496583355_100010209551 [0,1,0,0,0,0|3,0,0]=4 335 B13R2.5179 Nc1nccc2c1ccc(c2)O 271570a_203496583355_100000732483 [0,1,0,0,0,0|3,0,0]=4 336 B13R2.5179 O=C1CCc2c(cccc2C1)O 271570a_203496583355_100010138409 [0,1,0,0,0,0|1,0,2]=4 337 B13R2.5179 O=C1CCc2c(cccc2N1)O 271570a_203496583355_100010232564 [0,1,0,0,0,0|2,0,1]=4 338 B13R2.5179 O=C1CCc2c(cccc2O1)O 271570a_203496583355_200015620928 [0,1,0,0,0,0|2,0,1]=4 339 B13R2.5179 O=C1COc2c(cccc2N1)O 271570a_203496583355_100012355675 [0,1,0,0,0,0|2,0,1]=4 340 B13R2.5179 O=c1[nH]cnc2c1ncc(c2)O 271570a_203496583355_100000709876 [0,1,0,0,0,0|2,0,1]=4 341 B13R2.5179 O=c1[nH]ncc2c1ncc(c2)O 271570a_203496583355_100010284064 [0,1,0,0,0,0|2,0,1]=4 342 B13R2.5179 O=c1ccc2c(cccc2[nH]1)O 271570a_203496583355_100000726145 [0,1,0,0,0,0|2,0,0]=3 343 B13R2.5179 O=c1ccoc2c1ccc(c2)O 271570a_203496583355_100010062221 [0,1,0,0,0,0|2,0,1]=4 344 B13R2.5179 Oc1cc2cccc(c2cn1)O 271570a_203496583355_100009817091 [0,1,0,0,0,0|2,0,0]=3 345 B13R2.5179 Oc1cc2ccnc(c2cn1)O 271570a_203496583355_100020669822 [0,1,0,0,0,0|3,0,0]=4 346 B13R2.5179 Oc1ccc2c(cccc2c1)O 271570a_203496583355_100010202202 [0,1,0,0,0,0|1,0,0]=2 347 B13R2.5179 Oc1ccc2c(ccnc2c1)Cl 271570a_203496583355_100009996786 [0,1,0,0,0,0|3,0,0]=4 348 B13R2.5179 Oc1ccc2c(ccnc2c1)O 271570a_203496583355_100000045489 [0,1,0,0,0,0|2,0,0]=3 349 B13R2.5179 Oc1ccc2c(ccnc2c1)O 271570a_203496583355_100000756855 [0,1,0,0,0,0|2,0,0]=3 350 B13R2.5179 Oc1ccc2c(nccc2c1)O 271570a_203496583355_100000760485 [0,1,0,0,0,0|2,0,0]=3 351 B13R2.5179 Oc1ccc2c(nccc2c1)O 271570a_203496583355_100009867704 [0,1,0,0,0,0|2,0,0]=3 352 B13R2.5179 Oc1ccc2c(nncc2c1)O 271570a_203496583355_100000724280 [0,1,0,0,0,0|3,0,0]=4 353 B13R2.5179 Oc1ccnc2c1ccc(c2)Cl 271570a_203496583355_100012352046 [0,1,0,0,0,0|2,0,0]=3 354 B13R2.5179 Oc1ccnc2c1ccc(c2)F 271570a_203496583355_100000755548 [0,1,0,0,0,0|2,0,0]=3 355 B13R2.5179 Oc1ccnc2c1ncc(c2)F 271570a_203496583355_100011072215 [0,1,0,0,0,0|1,0,0]=2 356 B13R2.5179 Oc1cnc2c(cccc2c1)Br 271570a_203496583355_100010204298 [0,1,0,0,0,0|1,0,0]=2 357 B13R2.5179 Oc1cnc2c(cccc2c1)Cl 271570a_203496583355_100000759377 [0,1,0,0,0,0|1,0,0]=2 358 B13R2.5179 Oc1cnc2c(cccc2c1)F 271570a_203496583355_100000049890 [0,1,0,0,0,0|1,0,0]=2 359 B13R2.5179 Oc1cnc2c(nccc2c1)O 271570a_203496583355_100010117065 [0,1,0,0,0,0|1,0,0]=2 360 B13R2.5179 Oc1nccc2c1ccc(c2)F 271570a_203496583355_100000097391 [0,1,0,0,0,0|2,0,0]=3 361 B13R2.5179 Oc1ncnc2c1ccc(c2)F 271570a_203496583355_100000230349 [0,1,0,0,0,0|3,0,0]=4 362 B13R2.5179 [O-][n+]1ccc2c(cccc2c1)O 271570a_203496583355_200010126733 [0,1,0,0,0,0|2,0,0]=3 363 B11R1.13 C=C=Cc1cccc(c1Br)O 271570a_100015277604_100010187914 [0,0,1,0,0,0|1,0,1]=3 364 B11R1.13 C=C=Cc1cccc(c1C)Br 271570a_100015277604_100012353703 [0,0,1,0,0,0|2,0,1]=4 365 B11R1.13 C=C=Cc1cccc(c1C)C 271570a_100015277604_100011214922 [0,0,1,0,0,0|2,0,1]=4 366 B11R1.13 C=C=Cc1cccc(c1C)Cl 271570a_100015277604_100000726075 [0,0,1,0,0,0|2,0,1]=4 367 B11R1.13 C=C=Cc1cccc(c1C)F 271570a_100015277604_100011216893 [0,0,1,0,0,0|2,0,1]=4 368 B11R1.13 C=C=Cc1cccc(c1C)N 271570a_100015277604_100000761887 [0,0,1,0,0,0|2,0,1]=4 369 B11R1.13 C=C=Cc1cccc(c1C)O 271570a_100015277604_100012002258 [0,0,1,0,0,0|1,0,1]=3 370 B11R1.13 C=C=Cc1cccc(c1Cl)Br 271570a_100015277604_100010142854 [0,0,1,0,0,0|2,0,1]=4 371 B11R1.13 C=C=Cc1cccc(c1Cl)C 271570a_100015277604_200012352035 [0,0,1,0,0,0|2,0,1]=4 372 B11R1.13 C=C=Cc1cccc(c1Cl)Cl 271570a_100015277604_100011215384 [0,0,1,0,0,0|2,0,1]=4 373 B11R1.13 C=C=Cc1cccc(c1Cl)F 271570a_100015277604_200010234923 [0,0,1,0,0,0|2,0,1]=4 374 B11R1.13 C=C=Cc1cccc(c1Cl)O 271570a_100015277604_100000049636 [0,0,1,0,0,0|1,0,1]=3 375 B11R1.13 C=C=Cc1cccc(c1F)Br 271570a_100015277604_100000702267 [0,0,1,0,0,0|2,0,1]=4 376 B11R1.13 C=C=Cc1cccc(c1F)C 271570a_100015277604_100000717567 [0,0,1,0,0,0|2,0,1]=4 377 B11R1.13 C=C=Cc1cccc(c1F)Cl 271570a_100015277604_100011217346 [0,0,1,0,0,0|2,0,1]=4 378 B11R1.13 C=C=Cc1cccc(c1F)F 271570a_100015277604_100000694657 [0,0,1,0,0,0|2,0,1]=4 379 B11R1.13 C=C=Cc1cccc(c1F)N 271570a_100015277604_100011935091 [0,0,1,0,0,0|2,0,1]=4 380 B11R1.13 C=C=Cc1cccc(c1F)O 271570a_100015277604_100009817021 [0,0,1,0,0,0|1,0,1]=3 381 B11R1.13 C=C=Cc1cccc(c1N)Br 271570a_100015277604_100010146558 [0,0,1,0,0,0|1,0,2]=4 382 B11R1.13 C=C=Cc1cccc(c1N)C 271570a_100015277604_100011834072 [0,0,1,0,0,0|1,0,2]=4 383 B11R1.13 C=C=Cc1cccc(c1N)Cl 271570a_100015277604_100010190421 [0,0,1,0,0,0|1,0,2]=4 384 B11R1.13 C=C=Cc1cccc(c1N)F 271570a_100015277604_100000042321 [0,0,1,0,0,0|1,0,2]=4 385 B11R1.13 C=C=Cc1cccc(c1N)N 271570a_100015277604_100015191791 [0,0,1,0,0,0|1,0,2]=4 386 B11R1.13 C=C=Cc1cccc(c1N)O 271570a_100015277604_100011934926 [0,0,1,0,0,0|0,0,2]=3 387 B11R1.13 C=C=Cc1cccc(c1O)Br 271570a_100015277604_100010084509 [0,0,1,0,0,0|2,0,1]=4 388 B11R1.13 C=C=Cc1cccc(c1O)C 271570a_100015277604_100009817157 [0,0,1,0,0,0|2,0,1]=4 389 B11R1.13 C=C=Cc1cccc(c1O)Cl 271570a_100015277604_100010202889 [0,0,1,0,0,0|2,0,1]=4 390 B11R1.13 C=C=Cc1cccc(c1O)F 271570a_100015277604_100009813666 [0,0,1,0,0,0|2,0,1]=4 391 B11R1.13 C=C=Cc1cccc(c1O)N 271570a_100015277604_100011934915 [0,0,1,0,0,0|2,0,1]=4 392 B11R1.13 C=C=Cc1cccc(c1O)O 271570a_100015277604_100009815950 [0,0,1,0,0,0|1,0,1]=3 393 B11R1.13 C=C=Cc1ccnc(c1C)O 271570a_100015277604_100009858498 [0,0,1,0,0,0|2,0,1]=4 394 B11R1.13 C=C=Cc1nccc(c1F)O 271570a_100015277604_100009876375 [0,0,1,0,0,0|2,0,1]=4 395 B11R1.13 C=C=Cc1nccc(c1N)O 271570a_100015277604_100000128729 [0,0,1,0,0,0|1,0,2]=4 396 B11R1.13 CC=Cc1cccc(c1Br)O 271570a_100016259895_100010187914 [0,0,1,0,0,0|1,0,1]=3 397 B11R1.13 CC=Cc1cccc(c1C)Br 271570a_100016259895_100012353703 [0,0,1,0,0,0|2,0,1]=4 398 B11R1.13 CC=Cc1cccc(c1C)C 271570a_100016259895_100011214922 [0,0,1,0,0,0|2,0,1]=4 399 B11R1.13 CC=Cc1cccc(c1C)Cl 271570a_100016259895_100000726075 [0,0,1,0,0,0|2,0,1]=4 400 B11R1.13 CC=Cc1cccc(c1C)F 271570a_100016259895_100011216893 [0,0,1,0,0,0|2,0,1]=4 401 B11R1.13 CC=Cc1cccc(c1C)N 271570a_100016259895_100000761887 [0,0,1,0,0,0|2,0,1]=4 402 B11R1.13 CC=Cc1cccc(c1C)O 271570a_100016259895_100012002258 [0,0,1,0,0,0|1,0,1]=3 403 B11R1.13 CC=Cc1cccc(c1Cl)Br 271570a_100016259895_100010142854 [0,0,1,0,0,0|2,0,1]=4 404 B11R1.13 CC=Cc1cccc(c1Cl)C 271570a_100016259895_200012352035 [0,0,1,0,0,0|2,0,1]=4 405 B11R1.13 CC=Cc1cccc(c1Cl)Cl 271570a_100016259895_100011215384 [0,0,1,0,0,0|2,0,1]=4 406 B11R1.13 CC=Cc1cccc(c1Cl)F 271570a_100016259895_200010234923 [0,0,1,0,0,0|2,0,1]=4 407 B11R1.13 CC=Cc1cccc(c1Cl)O 271570a_100016259895_100000049636 [0,0,1,0,0,0|1,0,1]=3 408 B11R1.13 CC=Cc1cccc(c1F)Br 271570a_100016259895_100000702267 [0,0,1,0,0,0|2,0,1]=4 409 B11R1.13 CC=Cc1cccc(c1F)C 271570a_100016259895_100000717567 [0,0,1,0,0,0|2,0,1]=4 410 B11R1.13 CC=Cc1cccc(c1F)Cl 271570a_100016259895_100011217346 [0,0,1,0,0,0|2,0,1]=4 411 B11R1.13 CC=Cc1cccc(c1F)F 271570a_100016259895_100000694657 [0,0,1,0,0,0|2,0,1]=4 412 B11R1.13 CC=Cc1cccc(c1F)N 271570a_100016259895_100011935091 [0,0,1,0,0,0|2,0,1]=4 413 B11R1.13 CC=Cc1cccc(c1F)O 271570a_100016259895_100009817021 [0,0,1,0,0,0|1,0,1]=3 414 B11R1.13 CC=Cc1cccc(c1N)Br 271570a_100016259895_100010146558 [0,0,1,0,0,0|1,0,2]=4 415 B11R1.13 CC=Cc1cccc(c1N)C 271570a_100016259895_100011834072 [0,0,1,0,0,0|1,0,2]=4 416 B11R1.13 CC=Cc1cccc(c1N)Cl 271570a_100016259895_100010190421 [0,0,1,0,0,0|1,0,2]=4 417 B11R1.13 CC=Cc1cccc(c1N)F 271570a_100016259895_100000042321 [0,0,1,0,0,0|1,0,2]=4 418 B11R1.13 CC=Cc1cccc(c1N)N 271570a_100016259895_100015191791 [0,0,1,0,0,0|1,0,2]=4 419 B11R1.13 CC=Cc1cccc(c1N)O 271570a_100016259895_100011934926 [0,0,1,0,0,0|0,0,2]=3 420 B11R1.13 CC=Cc1cccc(c1O)Br 271570a_100016259895_100010084509 [0,0,1,0,0,0|2,0,1]=4 421 B11R1.13 CC=Cc1cccc(c1O)C 271570a_100016259895_100009817157 [0,0,1,0,0,0|2,0,1]=4 422 B11R1.13 CC=Cc1cccc(c1O)Cl 271570a_100016259895_100010202889 [0,0,1,0,0,0|2,0,1]=4 423 B11R1.13 CC=Cc1cccc(c1O)F 271570a_100016259895_100009813666 [0,0,1,0,0,0|2,0,1]=4 424 B11R1.13 CC=Cc1cccc(c1O)N 271570a_100016259895_100011934915 [0,0,1,0,0,0|2,0,1]=4 425 B11R1.13 CC=Cc1cccc(c1O)O 271570a_100016259895_100009815950 [0,0,1,0,0,0|1,0,1]=3 426 B11R1.13 CC=Cc1ccnc(c1C)O 271570a_100016259895_100009858498 [0,0,1,0,0,0|2,0,1]=4 427 B11R1.13 CC=Cc1nccc(c1F)O 271570a_100016259895_100009876375 [0,0,1,0,0,0|2,0,1]=4 428 B11R1.13 CC=Cc1nccc(c1N)O 271570a_100016259895_100000128729 [0,0,1,0,0,0|1,0,2]=4 429 B11R1.16 C=CCC(=O)c1ccccc1 1458a_100000185807_100000210623 [0,0,1,0,0,0|1,0,2]=4 430 B11R1.17 C=CCNc1ccccc1Br 34a_100000210017_100015514636 [0,0,1,0,0,0|1,0,2]=4 431 B11R1.17 C=CCNc1ccccc1C 34a_100015192222_100015514636 [0,0,1,0,0,0|1,0,2]=4 432 B11R1.17 C=CCNc1ccccc1Cl 34a_100000185783_100015514636 [0,0,1,0,0,0|1,0,2]=4 433 B11R1.17 C=CCNc1ccccc1F 34a_100000210422_100015514636 [0,0,1,0,0,0|1,0,2]=4 434 B11R1.17 C=CCNc1ccccc1I 34a_100000210053_100015514636 [0,0,1,0,0,0|1,0,2]=4 435 B11R1.17 C=CCNc1ccccc1O 34a_100000185747_100015514636 [0,0,1,0,0,0|0,0,2]=3 436 B11R1.17 C=CCOc1ccccc1Br 34a_100000181306_100015514636 [0,0,1,0,0,0|2,0,1]=4 437 B11R1.17 C=CCOc1ccccc1Br 7a_100000181306_100015514636 [0,0,1,0,0,0|2,0,1]=4 438 B11R1.17 C=CCOc1ccccc1C 34a_100000210338_100015514636 [0,0,1,0,0,0|2,0,1]=4 439 B11R1.17 C=CCOc1ccccc1C 7a_100000210338_100015514636 [0,0,1,0,0,0|2,0,1]=4 440 B11R1.17 C=CCOc1ccccc1Cl 34a_100000210172_100015514636 [0,0,1,0,0,0|2,0,1]=4 441 B11R1.17 C=CCOc1ccccc1Cl 7a_100000210172_100015514636 [0,0,1,0,0,0|2,0,1]=4 442 B11R1.17 C=CCOc1ccccc1F 34a_100000210171_100015514636 [0,0,1,0,0,0|2,0,1]=4 443 B11R1.17 C=CCOc1ccccc1F 7a_100000210171_100015514636 [0,0,1,0,0,0|2,0,1]=4 444 B11R1.17 C=CCOc1ccccc1I 34a_100000739446_100015514636 [0,0,1,0,0,0|2,0,1]=4 445 B11R1.17 C=CCOc1ccccc1I 7a_100000739446_100015514636 [0,0,1,0,0,0|2,0,1]=4 446 B11R1.17 C=CCOc1ccccc1N 34a_100000185747_100015514636 [0,0,1,0,0,0|2,0,1]=4 447 B11R1.17 C=CCOc1ccccc1N 7a_100000185747_100015514636 [0,0,1,0,0,0|2,0,1]=4 448 B11R1.17 C=CCSc1ccccc1Br 62a_100000210623_100000695589 [0,0,1,0,0,0|2,0,1]=4 449 B11R1.17 C=CCSc1ccccc1Br 62a_100000695589_100000210623 [0,0,1,0,0,0|2,0,1]=4 450 B11R1.17 C=CCSc1ccccc1C 62a_100000210623_100000210755 [0,0,1,0,0,0|2,0,1]=4 451 B11R1.17 C=CCSc1ccccc1C 62a_100000210755_100000210623 [0,0,1,0,0,0|2,0,1]=4 452 B11R1.17 C=CCSc1ccccc1Cl 62a_100000210623_100000764095 [0,0,1,0,0,0|2,0,1]=4 453 B11R1.17 C=CCSc1ccccc1Cl 62a_100000764095_100000210623 [0,0,1,0,0,0|2,0,1]=4 454 B11R1.17 C=CCSc1ccccc1F 62a_100000210623_100011215700 [0,0,1,0,0,0|2,0,1]=4 455 B11R1.17 C=CCSc1ccccc1F 62a_100011215700_100000210623 [0,0,1,0,0,0|2,0,1]=4 456 B11R1.17 C=CCSc1ccccc1N 62a_100000210017_100000210623 [0,0,1,0,0,0|2,0,1]=4 457 B11R1.17 C=CCSc1ccccc1N 62a_100000210623_100000210017 [0,0,1,0,0,0|2,0,1]=4 458 B11R1.17 C=CCSc1ccccc1O 62a_100000210623_100000739446 [0,0,1,0,0,0|1,0,1]=3 459 B11R1.17 C=CCSc1ccccc1O 62a_100000739446_100000210623 [0,0,1,0,0,0|1,0,1]=3 460 B11R1.17 C=CCSc1cccnc1O 62a_100000210623_100000760158 [0,0,1,0,0,0|2,0,1]=4 461 B11R1.17 C=CCSc1cccnc1O 62a_100000760158_100000210623 [0,0,1,0,0,0|2,0,1]=4 462 B11R1.17 C=CCSc1ccncc1O 62a_100000210623_100009817591 [0,0,1,0,0,0|2,0,1]=4 463 B11R1.17 C=CCSc1ccncc1O 62a_100009817591_100000210623 [0,0,1,0,0,0|2,0,1]=4 464 B11R1.17 C=CCSc1ncccc1O 62a_100000034122_100000210623 [0,0,1,0,0,0|2,0,1]=4 465 B11R1.17 C=CCSc1ncccc1O 62a_100000210623_100000034122 [0,0,1,0,0,0|2,0,1]=4 466 B11R1.17 O=CCCc1ccccc1O 271570a_203496583355_100011713448 [0,0,1,0,0,0|2,0,1]=4 467 B11R1.17 O=CCNc1ccccc1O 34a_100000185747_200009817547 [0,0,1,0,0,0|1,0,2]=4 468 B11R1.17 O=CCSc1ccccc1O 62a_100000739446_200015260668 [0,0,1,0,0,0|2,0,1]=4 469 B11R1.17 O=CCSc1ccccc1O 62a_200015260668_100000739446 [0,0,1,0,0,0|2,0,1]=4 470 B11R1.24 C=CCNc1cccc(c1)O 34a_100000210217_100015514636 [0,0,1,0,0,0|2,0,1]=4 471 B11R1.24 C=CCSc1cccc(c1)O 62a_100000210623_100000211634 [0,0,1,0,0,0|2,0,1]=4 472 B11R1.24 O=CCNc1cccc(c1)O 34a_100000210217_200009817547 [0,0,1,0,0,0|2,0,1]=4 473 B11R1.24 O=CCSc1cccc(c1)O 62a_200015260668_100000211634 [0,0,1,0,0,0|2,0,1]=4 474 B11R1.28 C/C=C/COc1cccnc1 34a_100000210849_100102629194 [0,0,1,0,0,0|2,0,1]=4 475 B11R1.28 C/C=C/COc1cccnc1 7a_100000210849_100102629194 [0,0,1,0,0,0|2,0,1]=4 476 B11R1.28 C/C=C/CSc1cccnc1 62a_100000210063_100102629194 [0,0,1,0,0,0|2,0,1]=4 477 B11R1.28 C/C=C/CSc1cccnc1 62a_100102629194_100000210063 [0,0,1,0,0,0|2,0,1]=4 478 B11R1.28 CC=CCOc1cccnc1 34a_100000210849_100000070051 [0,0,1,0,0,0|2,0,1]=4 479 B11R1.28 CC=CCOc1cccnc1 7a_100000210849_100000070051 [0,0,1,0,0,0|2,0,1]=4 480 B11R1.28 CC=CCSc1cccnc1 62a_100000070051_100000210063 [0,0,1,0,0,0|2,0,1]=4 481 B11R1.28 CC=CCSc1cccnc1 62a_100000210063_100000070051 [0,0,1,0,0,0|2,0,1]=4 482 B11R1.28 CCCC=Cc1cccnc1 271570a_100016258520_100000752921 [0,0,1,0,0,0|1,0,2]=4 483 B11R1.28 CCOC=Cc1cccnc1 271570a_100016256518_100000752921 [0,0,1,0,0,0|2,0,1]=4 484 B11R1.28 COC/C=C/c1cccnc1 34a_200102594124_200000210301 [0,0,1,0,0,0|2,0,1]=4 485 B11R1.28 COCC=Cc1cccnc1 271570a_100016286323_100000752921 [0,0,1,0,0,0|2,0,1]=4 486 B11R1.28 [13CH3]OC/C=C/c1cccnc1 34a_200102594124_200025704644 [0,0,1,0,0,0|2,0,1]=4 487 B11R1.41 C=C=Cc1ccccc1C=O 271570a_100015277604_100000211189 [0,0,1,0,0,0|1,0,2]=4 488 B11R1.41 C=C=Cc1ccccc1CO 271570a_100015277604_100000187465 [0,0,1,0,0,0|1,0,2]=4 489 B11R1.41 C=C=Cc1cccnc1C#N 271570a_100015277604_100000685805 [0,0,1,0,0,0|1,0,2]=4 490 B11R1.41 C=C=Cc1cccnc1C=O 271570a_100015277604_100011934733 [0,0,1,0,0,0|0,0,2]=3 491 B11R1.41 C=C=Cc1cccnc1CC 271570a_100015277604_100009877225 [0,0,1,0,0,0|1,0,2]=4 492 B11R1.41 C=C=Cc1cccnc1CN 271570a_100015277604_100020591323 [0,0,1,0,0,0|1,0,2]=4 493 B11R1.41 C=C=Cc1cccnc1CO 271570a_100015277604_100011996772 [0,0,1,0,0,0|0,0,2]=3 494 B11R1.41 C=C=Cc1cccnc1NC 271570a_100015277604_100000700899 [0,0,1,0,0,0|2,0,1]=4 495 B11R1.41 C=C=Cc1cccnc1NN 271570a_100015277604_100011464834 [0,0,1,0,0,0|2,0,1]=4 496 B11R1.41 C=C=Cc1cccnc1OC 271570a_100015277604_100000047025 [0,0,1,0,0,0|2,0,1]=4 497 B11R1.41 C=C=Cc1cccnc1SC 271570a_100015277604_100011465278 [0,0,1,0,0,0|2,0,1]=4 498 B11R1.41 C=C=Cc1nccnc1CO 271570a_100015277604_100000057004 [0,0,1,0,0,0|1,0,2]=4 499 B11R1.41 C=CCc1ccccc1C=C 271570a_100011290941_100009828059 [0,0,1,0,0,0|2,0,1]=4 500 B11R1.41 CC=Cc1ccccc1C=O 271570a_100016259895_100000211189 [0,0,1,0,0,0|1,0,2]=4 501 B11R1.41 CC=Cc1ccccc1CO 271570a_100016259895_100000187465 [0,0,1,0,0,0|1,0,2]=4 502 B11R1.41 CC=Cc1cccnc1C#N 271570a_100016259895_100000685805 [0,0,1,0,0,0|1,0,2]=4 503 B11R1.41 CC=Cc1cccnc1C=O 271570a_100016259895_100011934733 [0,0,1,0,0,0|0,0,2]=3 504 B11R1.41 CC=Cc1cccnc1CC 271570a_100016259895_100009877225 [0,0,1,0,0,0|1,0,2]=4 505 B11R1.41 CC=Cc1cccnc1CN 271570a_100016259895_100020591323 [0,0,1,0,0,0|1,0,2]=4 506 B11R1.41 CC=Cc1cccnc1CO 271570a_100016259895_100011996772 [0,0,1,0,0,0|0,0,2]=3 507 B11R1.41 CC=Cc1cccnc1NC 271570a_100016259895_100000700899 [0,0,1,0,0,0|2,0,1]=4 508 B11R1.41 CC=Cc1cccnc1NN 271570a_100016259895_100011464834 [0,0,1,0,0,0|2,0,1]=4 509 B11R1.41 CC=Cc1cccnc1OC 271570a_100016259895_100000047025 [0,0,1,0,0,0|2,0,1]=4 510 B11R1.41 CC=Cc1cccnc1SC 271570a_100016259895_100011465278 [0,0,1,0,0,0|2,0,1]=4 511 B11R1.41 CC=Cc1nccnc1CO 271570a_100016259895_100000057004 [0,0,1,0,0,0|1,0,2]=4 512 B11R1.53 C=C(C)c1ccccc1C=O 271570a_100000694244_100000211189 [0,0,1,0,0,0|3,0,0]=4 513 B11R1.53 C=C(C)c1ncccc1C#N 271570a_100000694244_100000211984 [0,0,1,0,0,0|2,0,1]=4 514 B11R1.53 C=C(C)c1ncccc1C=O 271570a_100000694244_100009816751 [0,0,1,0,0,0|2,0,0]=3 515 B11R1.53 C=C(C)c1ncccc1CN 271570a_100000694244_100015189234 [0,0,1,0,0,0|2,0,1]=4 516 B11R1.53 C=C(C)c1ncccc1CO 271570a_100000694244_100000748726 [0,0,1,0,0,0|2,0,1]=4 517 B11R1.53 C=C(C)c1ncccc1NC 271570a_100000694244_200011806188 [0,0,1,0,0,0|2,0,1]=4 518 B11R1.53 C=C(C)c1ncccc1OC 271570a_100000694244_100000690851 [0,0,1,0,0,0|2,0,1]=4 519 B11R1.53 C=Cc1ccccc1B(O)O 271570a_100011290941_100000693059 [0,0,1,0,0,0|3,0,0]=4 520 B11R1.53 C=Cc1ccccc1C(=O)C 1458a_100011830265_200000210301 [0,0,1,0,0,0|1,0,2]=4 521 B11R1.53 C=Cc1ccccc1C(=O)C 271570a_100011290941_100000751169 [0,0,1,0,0,0|1,0,2]=4 522 B11R1.53 C=Cc1ccccc1C(=O)N 271570a_100011290941_100000162227 [0,0,1,0,0,0|2,0,1]=4 523 B11R1.53 C=Cc1ccccc1C(=O)[13CH3] 1458a_100011830265_200025704644 [0,0,1,0,0,0|1,0,2]=4 524 B11R1.53 C=Cc1ccccc1C(C)O 271570a_100011290941_100000702211 [0,0,1,0,0,0|1,0,2]=4 525 B11R1.53 C=Cc1cccnc1C(=O)C 271570a_100011290941_100012348690 [0,0,1,0,0,0|0,0,2]=3 526 B11R1.53 C=Cc1cccnc1C(=O)N 271570a_100011290941_200012359670 [0,0,1,0,0,0|1,0,1]=3 527 B11R1.53 C=Cc1cccnc1C(C)N 271570a_100011290941_100159271932 [0,0,1,0,0,0|1,0,2]=4 528 B11R1.53 C=Cc1cccnc1C(F)F 271570a_100011290941_100010079810 [0,0,1,0,0,0|2,0,1]=4 529 B11R1.53 C=Cc1cccnc1N(C)C 271570a_100011290941_100011465059 [0,0,1,0,0,0|2,0,1]=4 530 B11R1.53 C=Cc1cccnc1[C@H](C)O 271570a_100011290941_100013325542 [0,0,1,0,0,0|0,0,2]=3 531 B11R1.53 C=Cc1nccnc1C(=O)C 271570a_100011290941_100000099859 [0,0,1,0,0,0|1,0,2]=4 532 B11R1.53 C=Cc1nccnc1C(=O)N 271570a_100011290941_100000094861 [0,0,1,0,0,0|2,0,1]=4 533 B11R1.265 C=Cc1c(cccc1C#N)O 271570a_100011290941_100009818990 [0,0,1,0,0,0|2,0,1]=4 534 B11R1.265 C=Cc1c(cccc1C=O)F 271570a_100011290941_100011998484 [0,0,1,0,0,0|3,0,0]=4 535 B11R1.265 C=Cc1c(cccc1C=O)O 271570a_100011290941_100009816417 [0,0,1,0,0,0|2,0,0]=3 536 B11R1.265 C=Cc1c(cccc1OC)O 271570a_100011290941_100010202623 [0,0,1,0,0,0|2,0,1]=4 537 B11R1.265 C=Cc1cccc(c1C#N)Br 271570a_100011290941_100010071968 [0,0,1,0,0,0|3,0,0]=4 538 B11R1.265 C=Cc1cccc(c1C#N)C 271570a_100011290941_100009819585 [0,0,1,0,0,0|3,0,0]=4 539 B11R1.265 C=Cc1cccc(c1C#N)Cl 271570a_100011290941_200000049503 [0,0,1,0,0,0|3,0,0]=4 540 B11R1.265 C=Cc1cccc(c1C#N)F 271570a_100011290941_100000699744 [0,0,1,0,0,0|3,0,0]=4 541 B11R1.265 C=Cc1cccc(c1C#N)N 271570a_100011290941_100011935054 [0,0,1,0,0,0|3,0,0]=4 542 B11R1.265 C=Cc1cccc(c1C#N)O 271570a_100011290941_100012180507 [0,0,1,0,0,0|2,0,0]=3 543 B11R1.265 C=Cc1cccc(c1C=O)C 271570a_100011290941_100000041122 [0,0,1,0,0,0|3,0,0]=4 544 B11R1.265 C=Cc1cccc(c1C=O)Cl 271570a_100011290941_100010147682 [0,0,1,0,0,0|3,0,0]=4 545 B11R1.265 C=Cc1cccc(c1C=O)F 271570a_100011290941_100000210083 [0,0,1,0,0,0|3,0,0]=4 546 B11R1.265 C=Cc1cccc(c1C=O)N 271570a_100011290941_100010232536 [0,0,1,0,0,0|3,0,0]=4 547 B11R1.265 C=Cc1cccc(c1C=O)O 271570a_100011290941_100009814793 [0,0,1,0,0,0|2,0,0]=3 548 B11R1.265 C=Cc1cccc(c1CN)F 271570a_100011290941_100012349121 [0,0,1,0,0,0|3,0,0]=4 549 B11R1.265 C=Cc1cccc(c1CO)F 271570a_100011290941_100012355691 [0,0,1,0,0,0|3,0,0]=4 550 B11R1.265 C=Cc1cccc(c1CO)N 271570a_100011290941_100000747656 [0,0,1,0,0,0|3,0,0]=4 551 B11R1.265 C=Cc1cccc(c1NC)N 271570a_100011290941_100010510394 [0,0,1,0,0,0|1,0,2]=4 552 B11R1.265 C=Cc1cccc(c1NN)F 271570a_100011290941_100016994982 [0,0,1,0,0,0|2,0,1]=4 553 B11R1.265 C=Cc1cccc(c1OC)Br 271570a_100011290941_100010146560 [0,0,1,0,0,0|2,0,1]=4 554 B11R1.265 C=Cc1cccc(c1OC)C 271570a_100011290941_100010141385 [0,0,1,0,0,0|2,0,1]=4 555 B11R1.265 C=Cc1cccc(c1OC)Cl 271570a_100011290941_100010147678 [0,0,1,0,0,0|2,0,1]=4 556 B11R1.265 C=Cc1cccc(c1OC)F 271570a_100011290941_100009816759 [0,0,1,0,0,0|2,0,1]=4 557 B11R1.265 C=Cc1cccc(c1OC)N 271570a_100011290941_100011935253 [0,0,1,0,0,0|2,0,1]=4 558 B11R1.265 C=Cc1cccc(c1OC)O 271570a_100011290941_100010234590 [0,0,1,0,0,0|1,0,1]=3 559 B11R1.265 C=Cc1cccc(c1SC)F 271570a_100011290941_200010709249 [0,0,1,0,0,0|2,0,1]=4 560 B11R1.265 C=Cc1nccc(c1C=O)O 271570a_100011290941_200010729673 [0,0,1,0,0,0|3,0,0]=4 561 B11R1.265 C=Cc1nccc(c1OC)O 271570a_100011290941_100000104430 [0,0,1,0,0,0|2,0,1]=4 562 B11R1.265 COc1c(cccc1C=O)O 271570a_203496583355_100000692592 [0,0,1,0,0,0|2,0,1]=4 563 B11R1.265 CSc1c(cccc1C=O)O 62a_100009816417_200000210301 [0,0,1,0,0,0|2,0,1]=4 564 B11R1.265 CSc1c(cccc1C=O)O 62a_200000210301_100009816417 [0,0,1,0,0,0|2,0,1]=4 565 B11R1.265 N#Cc1c(cccc1C=O)O 271570a_203496583355_100000100183 [0,0,1,0,0,0|3,0,0]=4 566 B11R1.265 [13CH3]Sc1c(cccc1C=O)O 62a_100009816417_200025704644 [0,0,1,0,0,0|2,0,1]=4 567 B11R1.265 [13CH3]Sc1c(cccc1C=O)O 62a_200025704644_100009816417 [0,0,1,0,0,0|2,0,1]=4 568 B11R1.605 C=C=Cc1c(cccc1Br)O 271570a_100015277604_100010187912 [0,0,1,0,0,0|2,0,1]=4 569 B11R1.605 C=C=Cc1c(cccc1Cl)O 271570a_100015277604_100000050174 [0,0,1,0,0,0|2,0,1]=4 570 B11R1.605 C=C=Cc1c(cccc1F)O 271570a_100015277604_100009820682 [0,0,1,0,0,0|2,0,1]=4 571 B11R1.605 C=C=Cc1c(cccc1O)C 271570a_100015277604_100000686692 [0,0,1,0,0,0|1,0,2]=4 572 B11R1.605 C=C=Cc1c(cccc1O)N 271570a_100015277604_100012183704 [0,0,1,0,0,0|2,0,1]=4 573 B11R1.605 C=C=Cc1c(cccc1O)O 271570a_100015277604_100010205330 [0,0,1,0,0,0|2,0,1]=4 574 B11R1.605 C=CCc1c(ccnc1F)O 271570a_203496583355_200010238768 [0,0,1,0,0,0|3,0,0]=4 575 B11R1.605 CC=Cc1c(cccc1Br)O 271570a_100016259895_100010187912 [0,0,1,0,0,0|2,0,1]=4 576 B11R1.605 CC=Cc1c(cccc1Cl)O 271570a_100016259895_100000050174 [0,0,1,0,0,0|2,0,1]=4 577 B11R1.605 CC=Cc1c(cccc1F)O 271570a_100016259895_100009820682 [0,0,1,0,0,0|2,0,1]=4 578 B11R1.605 CC=Cc1c(cccc1O)C 271570a_100016259895_100000686692 [0,0,1,0,0,0|1,0,2]=4 579 B11R1.605 CC=Cc1c(cccc1O)N 271570a_100016259895_100012183704 [0,0,1,0,0,0|2,0,1]=4 580 B11R1.605 CC=Cc1c(cccc1O)O 271570a_100016259895_100010205330 [0,0,1,0,0,0|2,0,1]=4 581 B11R1.605 [N-]=[N+]=Nc1c(cccc1F)O 271570a_203496583355_100102717373 [0,0,1,0,0,0|3,0,0]=4 582 B11R2.1 Oc1c[nH]c2c1cccn2 271570a_203496583355_100011934613 [0,0,0,0,1,0|3,0,0]=4 583 B11R2.1 Oc1c[nH]c2c1ccnc2 271570a_203496583355_100010232032 [0,0,0,0,1,0|3,0,0]=4 584 B11R2.1 Oc1c[nH]c2c1cncc2 271570a_203496583355_100011934843 [0,0,0,0,1,0|3,0,0]=4 585 B11R2.1 Oc1c[nH]c2c1nccc2 271570a_203496583355_100009817151 [0,0,0,0,1,0|1,0,0]=2 586 B11R2.1 Oc1cnc2n1cccc2 271570a_203496583355_100011219245 [0,0,0,0,1,0|3,0,0]=4 587 B11R2.1 Oc1cnc2n1nccc2 271570a_203496583355_100009819068 [0,0,0,0,1,0|2,0,0]=3 588 B11R2.1 Oc1cnn2c1cccc2 271570a_203496583355_100009817726 [0,0,0,0,1,0|3,0,0]=4 589 B11R2.1 Oc1cnn2c1nccc2 271570a_203496583355_100009819579 [0,0,0,0,1,0|2,0,0]=3 590 B11R2.1 Oc1coc2c1cccc2 271570a_203496583355_100009812202 [0,0,0,0,1,0|2,0,0]=3 591 B11R2.1 Oc1coc2c1nccc2 271570a_203496583355_100009889148 [0,0,0,0,1,0|1,0,0]=2 592 B11R2.1 Oc1csc2c1cccc2 271570a_203496583355_100009813928 [0,0,0,0,1,0|2,0,0]=3 593 B11R2.1 Oc1csc2c1cccn2 271570a_203496583355_100009830249 [0,0,0,0,1,0|3,0,0]=4 594 B11R2.1 Oc1csc2c1ccnc2 271570a_203496583355_100009817111 [0,0,0,0,1,0|3,0,0]=4 595 B11R2.1 Oc1csc2c1cncc2 271570a_203496583355_100010247091 [0,0,0,0,1,0|3,0,0]=4 596 B11R2.1 Oc1csc2c1nccc2 271570a_203496583355_100010247092 [0,0,0,0,1,0|1,0,0]=2 597 B11R2.1 Oc1csc2c1nccn2 271570a_203496583355_100010174841 [0,0,0,0,1,0|2,0,0]=3 598 B11R2.1 Oc1n[nH]c2c1cccc2 271570a_203496583355_100000050141 [0,0,0,0,1,0|3,0,0]=4 599 B11R2.1 Oc1n[nH]c2c1nccc2 271570a_203496583355_100009817118 [0,0,0,0,1,0|2,0,0]=3 600 B11R2.1 Oc1n[nH]c2c1nccn2 271570a_203496583355_100009819591 [0,0,0,0,1,0|3,0,0]=4 601 B11R2.1 Oc1ncn2c1cccc2 271570a_203496583355_100000688344 [0,0,0,0,1,0|3,0,0]=4 602 B11R2.106 Oc1cccc2c1CC=C2 271570a_203496583355_100009844718 [0,0,0,0,1,0|0,0,1]=2 603 B11R2.106 Oc1cccc2c1CCC2 271570a_203496583355_100010343934 [0,0,0,0,1,0|0,0,3]=4 604 B11R2.106 Oc1cccc2c1CCN2 271570a_203496583355_100009817896 [0,0,0,0,1,0|1,0,2]=4 605 B11R2.106 Oc1cccc2c1CCO2 271570a_203496583355_100009819624 [0,0,0,0,1,0|1,0,2]=4 606 B11R2.106 Oc1cccc2c1CNC2 271570a_203496583355_100000703859 [0,0,0,0,1,0|1,0,2]=4 607 B11R2.106 Oc1cccc2c1COC2 271570a_203496583355_100010384907 [0,0,0,0,1,0|1,0,2]=4 608 B11R2.106 Oc1cccc2c1NCC2 271570a_203496583355_100016995435 [0,0,0,0,1,0|0,0,3]=4 609 B11R2.106 Oc1cccc2c1OCC2 271570a_203496583355_100009818991 [0,0,0,0,1,0|1,0,2]=4 610 B11R2.106 Oc1cccc2c1OCO2 271570a_203496583355_100009814252 [0,0,0,0,1,0|2,0,1]=4 611 B11R2.106 Oc1cccc2c1[nH]cc2 271570a_203496583355_100009813418 [0,0,0,0,1,0|0,0,1]=2 612 B11R2.106 Oc1cccc2c1[nH]nc2 271570a_203496583355_100009816125 [0,0,0,0,1,0|1,0,1]=3 613 B11R2.106 Oc1cccc2c1[nH]nn2 271570a_203496583355_100009820029 [0,0,0,0,1,0|2,0,1]=4 614 B11R2.106 Oc1cccc2c1cc[nH]2 271570a_203496583355_100000685724 [0,0,0,0,1,0|1,0,0]=2 615 B11R2.106 Oc1cccc2c1cco2 271570a_203496583355_100000756496 [0,0,0,0,1,0|1,0,0]=2 616 B11R2.106 Oc1cccc2c1ccs2 271570a_203496583355_100009816950 [0,0,0,0,1,0|1,0,0]=2 617 B11R2.106 Oc1cccc2c1cn[nH]2 271570a_203496583355_100000753301 [0,0,0,0,1,0|2,0,0]=3 618 B11R2.106 Oc1cccc2c1cno2 271570a_203496583355_100009818589 [0,0,0,0,1,0|2,0,0]=3 619 B11R2.106 Oc1cccc2c1nc[nH]2 271570a_203496583355_100011935113 [0,0,0,0,1,0|1,0,0]=2 620 B11R2.106 Oc1cccc2c1nco2 271570a_203496583355_100009816834 [0,0,0,0,1,0|1,0,0]=2 621 B11R2.106 Oc1cccc2c1ncs2 271570a_203496583355_100000726125 [0,0,0,0,1,0|1,0,0]=2 622 B11R2.106 Oc1cccc2c1non2 271570a_203496583355_100009820244 [0,0,0,0,1,0|2,0,0]=3 623 B11R2.106 Oc1cccc2c1nsn2 271570a_203496583355_100000742359 [0,0,0,0,1,0|2,0,0]=3 624 B11R2.106 Oc1cccc2c1occ2 271570a_203496583355_100011935138 [0,0,0,0,1,0|1,0,0]=2 625 B11R2.106 Oc1cccc2c1ocn2 271570a_203496583355_100000728214 [0,0,0,0,1,0|2,0,0]=3 626 B11R2.106 Oc1cccc2c1onc2 271570a_203496583355_100000765530 [0,0,0,0,1,0|2,0,0]=3 627 B11R2.106 Oc1cccc2c1scc2 271570a_203496583355_100000766737 [0,0,0,0,1,0|1,0,0]=2 628 B11R2.106 Oc1cccc2c1scn2 271570a_203496583355_100010246326 [0,0,0,0,1,0|2,0,0]=3 629 B11R2.106 Oc1cccc2n1ccn2 271570a_203496583355_100000762677 [0,0,0,0,1,0|2,0,0]=3 630 B11R2.106 Oc1cccc2n1cnc2 271570a_203496583355_100009817730 [0,0,0,0,1,0|2,0,0]=3 631 B11R2.106 Oc1cccc2n1cnn2 271570a_203496583355_100009819885 [0,0,0,0,1,0|3,0,0]=4 632 B11R2.106 Oc1cccc2n1ncc2 271570a_203496583355_100009817731 [0,0,0,0,1,0|1,0,0]=2 633 B11R2.106 Oc1cccc2n1ncn2 271570a_203496583355_100009819724 [0,0,0,0,1,0|2,0,0]=3 634 B11R2.106 Oc1cccn2c1ccn2 271570a_203496583355_100010767162 [0,0,0,0,1,0|2,0,0]=3 635 B11R2.106 Oc1cccn2c1cnc2 271570a_203496583355_100009857155 [0,0,0,0,1,0|2,0,0]=3 636 B11R2.106 Oc1cccn2c1ncc2 271570a_203496583355_100011934911 [0,0,0,0,1,0|1,0,0]=2 637 B11R2.106 Oc1cccn2c1ncn2 271570a_203496583355_100009819722 [0,0,0,0,1,0|2,0,0]=3 638 B11R2.106 Oc1cccn2c1nnc2 271570a_203496583355_100000764285 [0,0,0,0,1,0|2,0,0]=3 639 B11R2.106 Oc1cccn2c1nnn2 271570a_203496583355_100009852330 [0,0,0,0,1,0|3,0,0]=4 640 B11R2.106 Oc1ccnc2c1[nH]cc2 271570a_203496583355_100009863063 [0,0,0,0,1,0|1,0,1]=3 641 B11R2.106 Oc1ccnc2c1[nH]nc2 271570a_203496583355_100000112858 [0,0,0,0,1,0|2,0,1]=4 642 B11R2.106 Oc1ccnc2c1cc[nH]2 271570a_203496583355_100000049914 [0,0,0,0,1,0|2,0,0]=3 643 B11R2.106 Oc1ccnc2c1ccs2 271570a_203496583355_100009861243 [0,0,0,0,1,0|2,0,0]=3 644 B11R2.106 Oc1ccnc2c1cn[nH]2 271570a_203496583355_100009819725 [0,0,0,0,1,0|3,0,0]=4 645 B11R2.106 Oc1ccnc2c1nc[nH]2 271570a_203496583355_100009820729 [0,0,0,0,1,0|2,0,0]=3 646 B11R2.106 Oc1ccnc2c1nn[nH]2 271570a_203496583355_100009853804 [0,0,0,0,1,0|3,0,0]=4 647 B11R2.106 Oc1ccnc2c1occ2 271570a_203496583355_100009853057 [0,0,0,0,1,0|2,0,0]=3 648 B11R2.106 Oc1ccnc2c1scc2 271570a_203496583355_100000723842 [0,0,0,0,1,0|2,0,0]=3 649 B11R2.106 Oc1ccnc2n1ncc2 271570a_203496583355_100000080991 [0,0,0,0,1,0|2,0,0]=3 650 B11R2.106 Oc1cncc2c1[nH]cc2 271570a_203496583355_100000217057 [0,0,0,0,1,0|1,0,1]=3 651 B11R2.106 Oc1cncc2c1[nH]cn2 271570a_203496583355_100000759552 [0,0,0,0,1,0|2,0,1]=4 652 B11R2.106 Oc1cncc2c1[nH]nc2 271570a_203496583355_100009857261 [0,0,0,0,1,0|2,0,1]=4 653 B11R2.106 Oc1cncc2c1cc[nH]2 271570a_203496583355_100009840476 [0,0,0,0,1,0|2,0,0]=3 654 B11R2.106 Oc1cncc2c1cn[nH]2 271570a_203496583355_100009819959 [0,0,0,0,1,0|3,0,0]=4 655 B11R2.106 Oc1cncc2n1ccn2 271570a_203496583355_100009818520 [0,0,0,0,1,0|3,0,0]=4 656 B11R2.106 Oc1cncn2c1nnc2 271570a_203496583355_100009864847 [0,0,0,0,1,0|3,0,0]=4 657 B11R2.106 Oc1nc[nH]c-2nccc12 271570a_203496583355_100015350423 [0,0,0,0,1,0|3,0,0]=4 658 B11R2.106 Oc1nccc2c1[nH]cc2 271570a_203496583355_100009816714 [0,0,0,0,1,0|1,0,1]=3 659 B11R2.106 Oc1nccc2c1[nH]nc2 271570a_203496583355_100009852419 [0,0,0,0,1,0|2,0,1]=4 660 B11R2.106 Oc1nccc2c1cc[nH]2 271570a_203496583355_100000086534 [0,0,0,0,1,0|2,0,0]=3 661 B11R2.106 Oc1nccc2c1cco2 271570a_203496583355_100000041166 [0,0,0,0,1,0|2,0,0]=3 662 B11R2.106 Oc1nccc2c1ccs2 271570a_203496583355_100000047778 [0,0,0,0,1,0|2,0,0]=3 663 B11R2.106 Oc1nccc2c1cn[nH]2 271570a_203496583355_100102525074 [0,0,0,0,1,0|3,0,0]=4 664 B11R2.106 Oc1nccc2c1nc[nH]2 271570a_203496583355_100009820035 [0,0,0,0,1,0|2,0,0]=3 665 B11R2.106 Oc1nccc2c1scc2 271570a_203496583355_100000117209 [0,0,0,0,1,0|2,0,0]=3 666 B11R2.106 Oc1nccn2c1ccc2 271570a_203496583355_100000094558 [0,0,0,0,1,0|2,0,0]=3 667 B11R2.106 Oc1nccn2c1ccn2 271570a_203496583355_100009846796 [0,0,0,0,1,0|3,0,0]=4 668 B11R2.106 Oc1nccn2c1cnc2 271570a_203496583355_100009989554 [0,0,0,0,1,0|3,0,0]=4 669 B11R2.106 Oc1nccn2c1ncc2 271570a_203496583355_100009887225 [0,0,0,0,1,0|2,0,0]=3 670 B11R2.106 Oc1nccn2c1ncn2 271570a_203496583355_100000094309 [0,0,0,0,1,0|3,0,0]=4 671 B11R2.106 Oc1nccn2c1nnc2 271570a_203496583355_100000757256 [0,0,0,0,1,0|3,0,0]=4 672 B11R2.106 Oc1ncnc2c1[nH]cc2 271570a_203496583355_100000084117 [0,0,0,0,1,0|2,0,1]=4 673 B11R2.106 Oc1ncnc2c1cco2 271570a_203496583355_100000094286 [0,0,0,0,1,0|3,0,0]=4 674 B11R2.106 Oc1ncnc2c1ccs2 271570a_203496583355_100000183654 [0,0,0,0,1,0|3,0,0]=4 675 B11R2.106 Oc1ncnc2c1ncs2 271570a_203496583355_100009860286 [0,0,0,0,1,0|3,0,0]=4 676 B11R2.106 Oc1ncnc2c1scc2 271570a_203496583355_100000234879 [0,0,0,0,1,0|3,0,0]=4 677 B11R2.106 Oc1ncnn2c1ccc2 271570a_203496583355_100000104113 [0,0,0,0,1,0|3,0,0]=4 678 B10R1.2 C=Cc1cccc(c1Br)O 271570a_100011290941_100010187914 [1,0,1,0,0,0|1,0,0]=3 679 B10R1.2 C=Cc1cccc(c1C)Br 271570a_100011290941_100012353703 [1,0,1,0,0,0|1,0,1]=4 680 B10R1.2 C=Cc1cccc(c1C)C 271570a_100011290941_100011214922 [1,0,1,0,0,0|1,0,1]=4 681 B10R1.2 C=Cc1cccc(c1C)Cl 271570a_100011290941_100000726075 [1,0,1,0,0,0|1,0,1]=4 682 B10R1.2 C=Cc1cccc(c1C)F 271570a_100011290941_100011216893 [1,0,1,0,0,0|1,0,1]=4 683 B10R1.2 C=Cc1cccc(c1C)N 271570a_100011290941_100000761887 [1,0,1,0,0,0|1,0,1]=4 684 B10R1.2 C=Cc1cccc(c1C)O 271570a_100011290941_100012002258 [1,0,1,0,0,0|0,0,1]=3 685 B10R1.2 C=Cc1cccc(c1Cl)Br 271570a_100011290941_100010142854 [1,0,1,0,0,0|2,0,0]=4 686 B10R1.2 C=Cc1cccc(c1Cl)C 271570a_100011290941_200012352035 [1,0,1,0,0,0|2,0,0]=4 687 B10R1.2 C=Cc1cccc(c1Cl)Cl 271570a_100011290941_100011215384 [1,0,1,0,0,0|2,0,0]=4 688 B10R1.2 C=Cc1cccc(c1Cl)F 271570a_100011290941_200010234923 [1,0,1,0,0,0|2,0,0]=4 689 B10R1.2 C=Cc1cccc(c1Cl)O 271570a_100011290941_100000049636 [1,0,1,0,0,0|1,0,0]=3 690 B10R1.2 C=Cc1cccc(c1F)Br 271570a_100011290941_100000702267 [1,0,1,0,0,0|2,0,0]=4 691 B10R1.2 C=Cc1cccc(c1F)C 271570a_100011290941_100000717567 [1,0,1,0,0,0|2,0,0]=4 692 B10R1.2 C=Cc1cccc(c1F)Cl 271570a_100011290941_100011217346 [1,0,1,0,0,0|2,0,0]=4 693 B10R1.2 C=Cc1cccc(c1F)F 271570a_100011290941_100000694657 [1,0,1,0,0,0|2,0,0]=4 694 B10R1.2 C=Cc1cccc(c1F)N 271570a_100011290941_100011935091 [1,0,1,0,0,0|2,0,0]=4 695 B10R1.2 C=Cc1cccc(c1F)O 271570a_100011290941_100009817021 [1,0,1,0,0,0|1,0,0]=3 696 B10R1.2 C=Cc1cccc(c1N)Br 271570a_100011290941_100010146558 [1,0,1,0,0,0|1,0,1]=4 697 B10R1.2 C=Cc1cccc(c1N)C 271570a_100011290941_100011834072 [1,0,1,0,0,0|1,0,1]=4 698 B10R1.2 C=Cc1cccc(c1N)Cl 271570a_100011290941_100010190421 [1,0,1,0,0,0|1,0,1]=4 699 B10R1.2 C=Cc1cccc(c1N)F 271570a_100011290941_100000042321 [1,0,1,0,0,0|1,0,1]=4 700 B10R1.2 C=Cc1cccc(c1N)N 271570a_100011290941_100015191791 [1,0,1,0,0,0|1,0,1]=4 701 B10R1.2 C=Cc1cccc(c1N)O 271570a_100011290941_100011934926 [1,0,1,0,0,0|0,0,1]=3 702 B10R1.2 C=Cc1cccc(c1O)Br 271570a_100011290941_100010084509 [1,0,1,0,0,0|2,0,0]=4 703 B10R1.2 C=Cc1cccc(c1O)C 271570a_100011290941_100009817157 [1,0,1,0,0,0|2,0,0]=4 704 B10R1.2 C=Cc1cccc(c1O)Cl 271570a_100011290941_100010202889 [1,0,1,0,0,0|2,0,0]=4 705 B10R1.2 C=Cc1cccc(c1O)F 271570a_100011290941_100009813666 [1,0,1,0,0,0|2,0,0]=4 706 B10R1.2 C=Cc1cccc(c1O)N 271570a_100011290941_100011934915 [1,0,1,0,0,0|2,0,0]=4 707 B10R1.2 C=Cc1cccc(c1O)O 271570a_100011290941_100009815950 [1,0,1,0,0,0|1,0,0]=3 708 B10R1.2 C=Cc1ccnc(c1C)O 271570a_100011290941_100009858498 [1,0,1,0,0,0|1,0,1]=4 709 B10R1.2 C=Cc1nccc(c1F)O 271570a_100011290941_100009876375 [1,0,1,0,0,0|2,0,0]=4 710 B10R1.2 C=Cc1nccc(c1N)O 271570a_100011290941_100000128729 [1,0,1,0,0,0|1,0,1]=4 711 B10R1.2 Cc1c(cccc1C=O)O 271570a_203496583355_100012179384 [1,0,1,0,0,0|1,0,1]=4 712 B10R1.2 Nc1c(cccc1C=O)O 271570a_203496583355_100010144990 [1,0,1,0,0,0|1,0,1]=4 713 B10R1.2 O=Cc1cccc(c1F)O 271570a_203496583355_100000766533 [1,0,1,0,0,0|2,0,0]=4 714 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100000737635 [1,0,1,0,0,0|2,0,0]=4 715 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100009816417 [1,0,1,0,0,0|2,0,0]=4 716 B10R1.4 C=C=Cc1ccccc1Br 271570a_100015277604_100000695589 [1,0,1,0,0,0|1,0,1]=4 717 B10R1.4 C=C=Cc1ccccc1C 271570a_100015277604_100000210755 [1,0,1,0,0,0|1,0,1]=4 718 B10R1.4 C=C=Cc1ccccc1Cl 271570a_100015277604_100000764095 [1,0,1,0,0,0|1,0,1]=4 719 B10R1.4 C=C=Cc1ccccc1F 271570a_100015277604_100011215700 [1,0,1,0,0,0|1,0,1]=4 720 B10R1.4 C=C=Cc1ccccc1N 271570a_100015277604_100000210017 [1,0,1,0,0,0|0,0,2]=4 721 B10R1.4 C=C=Cc1ccccc1O 271570a_100015277604_100000739446 [1,0,1,0,0,0|0,0,1]=3 722 B10R1.4 C=C=Cc1cccnc1Br 271570a_100015277604_100010202626 [1,0,1,0,0,0|1,0,1]=4 723 B10R1.4 C=C=Cc1cccnc1C 271570a_100015277604_100000751574 [1,0,1,0,0,0|0,0,2]=4 724 B10R1.4 C=C=Cc1cccnc1Cl 271570a_100015277604_100000036424 [1,0,1,0,0,0|1,0,1]=4 725 B10R1.4 C=C=Cc1cccnc1F 271570a_100015277604_100009816115 [1,0,1,0,0,0|1,0,1]=4 726 B10R1.4 C=C=Cc1cccnc1N 271570a_100015277604_100000045569 [1,0,1,0,0,0|1,0,1]=4 727 B10R1.4 C=C=Cc1ccncc1O 271570a_100015277604_100009817591 [1,0,1,0,0,0|1,0,1]=4 728 B10R1.4 C=C=Cc1cncnc1O 271570a_100015277604_100000751107 [1,0,1,0,0,0|1,0,1]=4 729 B10R1.4 C=C=Cc1ncccc1Br 271570a_100015277604_100000696092 [1,0,1,0,0,0|1,0,1]=4 730 B10R1.4 C=C=Cc1ncccc1C 271570a_100015277604_100000751373 [1,0,1,0,0,0|0,0,2]=4 731 B10R1.4 C=C=Cc1ncccc1Cl 271570a_100015277604_100011356963 [1,0,1,0,0,0|1,0,1]=4 732 B10R1.4 C=C=Cc1ncccc1F 271570a_100015277604_100000685392 [1,0,1,0,0,0|1,0,1]=4 733 B10R1.4 C=C=Cc1ncccc1N 271570a_100015277604_100000688686 [1,0,1,0,0,0|1,0,1]=4 734 B10R1.4 C=C=Cc1ncccc1O 271570a_100015277604_100000034122 [1,0,1,0,0,0|1,0,1]=4 735 B10R1.4 C=CCc1ccccc1O 271570a_203496583355_100009828059 [1,0,1,0,0,0|0,0,1]=3 736 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [1,0,1,0,0,0|1,0,1]=4 737 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [1,0,1,0,0,0|1,0,1]=4 738 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [1,0,1,0,0,0|1,0,1]=4 739 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [1,0,1,0,0,0|1,0,1]=4 740 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [1,0,1,0,0,0|0,0,2]=4 741 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [1,0,1,0,0,0|0,0,1]=3 742 B10R1.4 CC=Cc1cccnc1Br 271570a_100016259895_100010202626 [1,0,1,0,0,0|1,0,1]=4 743 B10R1.4 CC=Cc1cccnc1C 271570a_100016259895_100000751574 [1,0,1,0,0,0|0,0,2]=4 744 B10R1.4 CC=Cc1cccnc1Cl 271570a_100016259895_100000036424 [1,0,1,0,0,0|1,0,1]=4 745 B10R1.4 CC=Cc1cccnc1F 271570a_100016259895_100009816115 [1,0,1,0,0,0|1,0,1]=4 746 B10R1.4 CC=Cc1cccnc1N 271570a_100016259895_100000045569 [1,0,1,0,0,0|1,0,1]=4 747 B10R1.4 CC=Cc1ccncc1O 271570a_100016259895_100009817591 [1,0,1,0,0,0|1,0,1]=4 748 B10R1.4 CC=Cc1cncnc1O 271570a_100016259895_100000751107 [1,0,1,0,0,0|1,0,1]=4 749 B10R1.4 CC=Cc1ncccc1Br 271570a_100016259895_100000696092 [1,0,1,0,0,0|1,0,1]=4 750 B10R1.4 CC=Cc1ncccc1C 271570a_100016259895_100000751373 [1,0,1,0,0,0|0,0,2]=4 751 B10R1.4 CC=Cc1ncccc1Cl 271570a_100016259895_100011356963 [1,0,1,0,0,0|1,0,1]=4 752 B10R1.4 CC=Cc1ncccc1F 271570a_100016259895_100000685392 [1,0,1,0,0,0|1,0,1]=4 753 B10R1.4 CC=Cc1ncccc1N 271570a_100016259895_100000688686 [1,0,1,0,0,0|1,0,1]=4 754 B10R1.4 CC=Cc1ncccc1O 271570a_100016259895_100000034122 [1,0,1,0,0,0|1,0,1]=4 755 B10R1.4 [N-]=[N+]=Nc1ccccc1O 271570a_203496583355_100000762926 [1,0,1,0,0,0|2,0,0]=4 756 B10R1.10 C=C=Cc1cc(ccn1)O 271570a_100015277604_100000762945 [1,0,1,0,0,0|1,0,1]=4 757 B10R1.10 C=C=Cc1cccc(c1)Br 271570a_100015277604_100000691529 [1,0,1,0,0,0|1,0,1]=4 758 B10R1.10 C=C=Cc1cccc(c1)C 271570a_100015277604_100011215228 [1,0,1,0,0,0|1,0,1]=4 759 B10R1.10 C=C=Cc1cccc(c1)Cl 271570a_100015277604_100000699651 [1,0,1,0,0,0|1,0,1]=4 760 B10R1.10 C=C=Cc1cccc(c1)F 271570a_100015277604_100000685547 [1,0,1,0,0,0|1,0,1]=4 761 B10R1.10 C=C=Cc1cccc(c1)N 271570a_100015277604_100000210019 [1,0,1,0,0,0|1,0,1]=4 762 B10R1.10 C=C=Cc1cccc(c1)O 271570a_100015277604_100000211634 [1,0,1,0,0,0|0,0,1]=3 763 B10R1.10 C=C=Cc1cccc(c1)[S] 271570a_100015277604_114929384022 [1,0,1,0,0,0|0,1,1]=4 764 B10R1.10 C=C=Cc1cncc(c1)O 271570a_100015277604_100000754920 [1,0,1,0,0,0|1,0,1]=4 765 B10R1.10 C=CCc1cccc(c1)O 271570a_203496583355_100009816576 [1,0,1,0,0,0|0,0,1]=3 766 B10R1.10 CC=Cc1cc(ccn1)O 271570a_100016259895_100000762945 [1,0,1,0,0,0|1,0,1]=4 767 B10R1.10 CC=Cc1cccc(c1)Br 271570a_100016259895_100000691529 [1,0,1,0,0,0|1,0,1]=4 768 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [1,0,1,0,0,0|1,0,1]=4 769 B10R1.10 CC=Cc1cccc(c1)Cl 271570a_100016259895_100000699651 [1,0,1,0,0,0|1,0,1]=4 770 B10R1.10 CC=Cc1cccc(c1)F 271570a_100016259895_100000685547 [1,0,1,0,0,0|1,0,1]=4 771 B10R1.10 CC=Cc1cccc(c1)N 271570a_100016259895_100000210019 [1,0,1,0,0,0|1,0,1]=4 772 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [1,0,1,0,0,0|0,0,1]=3 773 B10R1.10 CC=Cc1cccc(c1)[S] 271570a_100016259895_114929384022 [1,0,1,0,0,0|0,1,1]=4 774 B10R1.10 CC=Cc1cncc(c1)O 271570a_100016259895_100000754920 [1,0,1,0,0,0|1,0,1]=4 775 B10R1.10 O=CCc1cccc(c1)O 271570a_203496583355_200000698211 [1,0,1,0,0,0|1,0,1]=4 776 B10R1.17 C=CCNc1ccccc1 34a_100000106764_100015514636 [1,0,1,0,0,0|0,0,2]=4 777 B10R1.17 C=CCOc1ccccc1 34a_100000210340_100015514636 [1,0,1,0,0,0|1,0,1]=4 778 B10R1.17 C=CCOc1ccccc1 7a_100000210340_100015514636 [1,0,1,0,0,0|1,0,1]=4 779 B10R1.17 C=CCOc1cccnc1 34a_100000210849_100015514636 [1,0,1,0,0,0|1,0,1]=4 780 B10R1.17 C=CCOc1cccnc1 7a_100000210849_100015514636 [1,0,1,0,0,0|1,0,1]=4 781 B10R1.17 C=CCSc1ccccc1 62a_100000210623_100000041952 [1,0,1,0,0,0|1,0,1]=4 782 B10R1.17 C=CCSc1ccccc1 62a_100000719477_100000210623 [1,0,1,0,0,0|1,0,1]=4 783 B10R1.17 C=CCSc1ccccn1 62a_100000210623_100011216584 [1,0,1,0,0,0|1,0,1]=4 784 B10R1.17 C=CCSc1ccccn1 62a_100011216584_100000210623 [1,0,1,0,0,0|1,0,1]=4 785 B10R1.17 C=CCSc1cccnc1 62a_100000210063_100000210623 [1,0,1,0,0,0|1,0,1]=4 786 B10R1.17 C=CCSc1cccnc1 62a_100000210623_100000210063 [1,0,1,0,0,0|1,0,1]=4 787 B10R1.20 C=Cc1ccccc1C#N 271570a_100011290941_100000188569 [1,0,1,0,0,0|2,0,0]=4 788 B10R1.20 C=Cc1ccccc1C=O 271570a_100011290941_100000211189 [1,0,1,0,0,0|1,0,1]=4 789 B10R1.20 C=Cc1ccccc1CC 271570a_100011290941_100011215823 [1,0,1,0,0,0|1,0,1]=4 790 B10R1.20 C=Cc1ccccc1CN 271570a_100011290941_100000689332 [1,0,1,0,0,0|2,0,0]=4 791 B10R1.20 C=Cc1ccccc1CO 271570a_100011290941_100000187465 [1,0,1,0,0,0|1,0,1]=4 792 B10R1.20 C=Cc1ccccc1NC 271570a_100011290941_100020606079 [1,0,1,0,0,0|0,0,2]=4 793 B10R1.20 C=Cc1ccccc1NC 34a_100012022501_200000210301 [1,0,1,0,0,0|0,0,2]=4 794 B10R1.20 C=Cc1ccccc1NN 271570a_100011290941_100000241748 [1,0,1,0,0,0|1,0,1]=4 795 B10R1.20 C=Cc1ccccc1N[13CH3] 34a_100012022501_200025704644 [1,0,1,0,0,0|0,0,2]=4 796 B10R1.20 C=Cc1ccccc1OC 271570a_100011290941_100000174000 [1,0,1,0,0,0|1,0,1]=4 797 B10R1.20 C=Cc1ccccc1SC 271570a_100011290941_100011217816 [1,0,1,0,0,0|1,0,1]=4 798 B10R1.20 C=Cc1ccccc1SC 62a_100011218376_200000210301 [1,0,1,0,0,0|1,0,1]=4 799 B10R1.20 C=Cc1ccccc1SC 62a_200000210301_100011218376 [1,0,1,0,0,0|1,0,1]=4 800 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_100011218376_200025704644 [1,0,1,0,0,0|1,0,1]=4 801 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_200025704644_100011218376 [1,0,1,0,0,0|1,0,1]=4 802 B10R1.20 C=Cc1cccnc1C#N 271570a_100011290941_100000685805 [1,0,1,0,0,0|1,0,1]=4 803 B10R1.20 C=Cc1cccnc1C=O 271570a_100011290941_100011934733 [1,0,1,0,0,0|0,0,1]=3 804 B10R1.20 C=Cc1cccnc1CC 271570a_100011290941_100009877225 [1,0,1,0,0,0|0,0,2]=4 805 B10R1.20 C=Cc1cccnc1CN 271570a_100011290941_100020591323 [1,0,1,0,0,0|1,0,1]=4 806 B10R1.20 C=Cc1cccnc1CO 271570a_100011290941_100011996772 [1,0,1,0,0,0|0,0,1]=3 807 B10R1.20 C=Cc1cccnc1NC 271570a_100011290941_100000700899 [1,0,1,0,0,0|1,0,1]=4 808 B10R1.20 C=Cc1cccnc1NN 271570a_100011290941_100011464834 [1,0,1,0,0,0|2,0,0]=4 809 B10R1.20 C=Cc1cccnc1OC 271570a_100011290941_100000047025 [1,0,1,0,0,0|1,0,1]=4 810 B10R1.20 C=Cc1cccnc1SC 271570a_100011290941_100011465278 [1,0,1,0,0,0|1,0,1]=4 811 B10R1.20 C=Cc1ncccc1C#N 271570a_100011290941_100000211984 [1,0,1,0,0,0|1,0,1]=4 812 B10R1.20 C=Cc1ncccc1C=O 271570a_100011290941_100009816751 [1,0,1,0,0,0|1,0,0]=3 813 B10R1.20 C=Cc1ncccc1CN 271570a_100011290941_100015189234 [1,0,1,0,0,0|1,0,1]=4 814 B10R1.20 C=Cc1ncccc1CO 271570a_100011290941_100000748726 [1,0,1,0,0,0|1,0,1]=4 815 B10R1.20 C=Cc1ncccc1NC 271570a_100011290941_200011806188 [1,0,1,0,0,0|1,0,1]=4 816 B10R1.20 C=Cc1ncccc1OC 271570a_100011290941_100000690851 [1,0,1,0,0,0|1,0,1]=4 817 B10R1.20 C=Cc1nccnc1CO 271570a_100011290941_100000057004 [1,0,1,0,0,0|1,0,1]=4 818 B10R1.61 C=C(C)c1ncccc1Br 271570a_100000694244_100000696092 [1,0,1,0,0,0|2,0,0]=4 819 B10R1.61 C=C(C)c1ncccc1C 271570a_100000694244_100000751373 [1,0,1,0,0,0|1,0,1]=4 820 B10R1.61 C=C(C)c1ncccc1Cl 271570a_100000694244_100011356963 [1,0,1,0,0,0|2,0,0]=4 821 B10R1.61 C=C(C)c1ncccc1F 271570a_100000694244_100000685392 [1,0,1,0,0,0|2,0,0]=4 822 B10R1.61 C=C(C)c1ncccc1N 271570a_100000694244_100000688686 [1,0,1,0,0,0|2,0,0]=4 823 B10R1.61 C=C(C)c1ncccc1O 271570a_100000694244_100000034122 [1,0,1,0,0,0|2,0,0]=4 824 B10R1.245 C=Cc1c(cccc1Br)Br 271570a_100011290941_100009994525 [1,0,1,0,0,0|2,0,0]=4 825 B10R1.245 C=Cc1c(cccc1Br)Cl 271570a_100011290941_100010214488 [1,0,1,0,0,0|2,0,0]=4 826 B10R1.245 C=Cc1c(cccc1Br)F 271570a_100011290941_100011219512 [1,0,1,0,0,0|2,0,0]=4 827 B10R1.245 C=Cc1c(cccc1Br)N 271570a_100011290941_100020590159 [1,0,1,0,0,0|2,0,0]=4 828 B10R1.245 C=Cc1c(cccc1Br)O 271570a_100011290941_100010187912 [1,0,1,0,0,0|1,0,0]=3 829 B10R1.245 C=Cc1c(cccc1C)C 271570a_100011290941_100000033847 [1,0,1,0,0,0|1,0,1]=4 830 B10R1.245 C=Cc1c(cccc1Cl)C 271570a_100011290941_100000043165 [1,0,1,0,0,0|1,0,1]=4 831 B10R1.245 C=Cc1c(cccc1Cl)Cl 271570a_100011290941_100000034237 [1,0,1,0,0,0|2,0,0]=4 832 B10R1.245 C=Cc1c(cccc1Cl)F 271570a_100011290941_100000050007 [1,0,1,0,0,0|2,0,0]=4 833 B10R1.245 C=Cc1c(cccc1Cl)N 271570a_100011290941_100000049713 [1,0,1,0,0,0|2,0,0]=4 834 B10R1.245 C=Cc1c(cccc1Cl)O 271570a_100011290941_100000050174 [1,0,1,0,0,0|1,0,0]=3 835 B10R1.245 C=Cc1c(cccc1F)C 271570a_100011290941_100012349962 [1,0,1,0,0,0|1,0,1]=4 836 B10R1.245 C=Cc1c(cccc1F)F 271570a_100011290941_100000693133 [1,0,1,0,0,0|2,0,0]=4 837 B10R1.245 C=Cc1c(cccc1F)N 271570a_100011290941_100011934729 [1,0,1,0,0,0|2,0,0]=4 838 B10R1.245 C=Cc1c(cccc1F)O 271570a_100011290941_100009820682 [1,0,1,0,0,0|1,0,0]=3 839 B10R1.245 C=Cc1c(cccc1N)C 271570a_100011290941_100000684715 [1,0,1,0,0,0|1,0,1]=4 840 B10R1.245 C=Cc1c(cccc1O)C 271570a_100011290941_100000686692 [1,0,1,0,0,0|0,0,1]=3 841 B10R1.245 C=Cc1c(cccc1O)N 271570a_100011290941_100012183704 [1,0,1,0,0,0|1,0,0]=3 842 B10R1.245 C=Cc1c(cccc1O)O 271570a_100011290941_100010205330 [1,0,1,0,0,0|1,0,0]=3 843 B10R1.245 C=Cc1c(ccnc1O)C 271570a_100011290941_100012000493 [1,0,1,0,0,0|1,0,1]=4 844 B10R1.245 C=Cc1c(ccnc1O)O 271570a_100011290941_200009817435 [1,0,1,0,0,0|2,0,0]=4 845 B10R1.245 Cc1cccc(c1C=O)O 271570a_203496583355_100000041122 [1,0,1,0,0,0|1,0,1]=4 846 B10R1.245 Nc1cccc(c1C=O)O 271570a_203496583355_100010232536 [1,0,1,0,0,0|2,0,0]=4 847 B10R1.245 O=Cc1c(cccc1Cl)O 271570a_203496583355_100010147682 [1,0,1,0,0,0|2,0,0]=4 848 B10R1.245 O=Cc1c(cccc1F)O 271570a_203496583355_100000210083 [1,0,1,0,0,0|2,0,0]=4 849 B10R1.245 O=Cc1c(cccc1O)O 271570a_203496583355_100009814793 [1,0,1,0,0,0|2,0,0]=4 850 B12R1.25 C=CCNc1cccc(c1Br)O 34a_100012183704_100015514636 [0,1,1,0,0,0|1,0,1]=4 851 B12R1.25 C=CCNc1cccc(c1Br)O 7a_100012183704_100015514636 [0,1,1,0,0,0|1,0,1]=4 852 B12R1.25 C=CCNc1cccc(c1C)O 34a_100011216573_100015514636 [0,1,1,0,0,0|1,0,1]=4 853 B12R1.25 C=CCNc1cccc(c1C)O 7a_100011216573_100015514636 [0,1,1,0,0,0|1,0,1]=4 854 B12R1.25 C=CCNc1cccc(c1Cl)O 34a_100012002038_100015514636 [0,1,1,0,0,0|1,0,1]=4 855 B12R1.25 C=CCNc1cccc(c1Cl)O 7a_100012002038_100015514636 [0,1,1,0,0,0|1,0,1]=4 856 B12R1.25 C=CCSc1cccc(c1Br)O 62a_100000210623_100010187914 [0,1,1,0,0,0|1,0,1]=4 857 B12R1.25 C=CCSc1cccc(c1Br)O 62a_100010187914_100000210623 [0,1,1,0,0,0|1,0,1]=4 858 B12R1.25 C=CCSc1cccc(c1C)O 62a_100000210623_100012002258 [0,1,1,0,0,0|1,0,1]=4 859 B12R1.25 C=CCSc1cccc(c1C)O 62a_100012002258_100000210623 [0,1,1,0,0,0|1,0,1]=4 860 B12R1.25 C=CCSc1cccc(c1Cl)O 62a_100000210623_100000049636 [0,1,1,0,0,0|1,0,1]=4 861 B12R1.25 C=CCSc1cccc(c1F)O 62a_100000210623_100009817021 [0,1,1,0,0,0|1,0,1]=4 862 B12R1.25 C=CCSc1cccc(c1F)O 62a_100009817021_100000210623 [0,1,1,0,0,0|1,0,1]=4 863 B12R1.25 C=CCSc1cccc(c1N)O 62a_100000210623_100011934926 [0,1,1,0,0,0|0,0,2]=4 864 B12R1.25 C=CCSc1cccc(c1O)O 62a_100000210623_100009815950 [0,1,1,0,0,0|1,0,1]=4 865 B12R1.224 CC(=Cc1cccc(c1Br)O)C 271570a_100102525489_100010187914 [0,1,1,0,0,0|1,0,1]=4 866 B12R1.224 CC(=Cc1cccc(c1C)O)C 271570a_100102525489_100012002258 [0,1,1,0,0,0|1,0,1]=4 867 B12R1.224 CC(=Cc1cccc(c1Cl)O)C 271570a_100102525489_100000049636 [0,1,1,0,0,0|1,0,1]=4 868 B12R1.224 CC(=Cc1cccc(c1F)O)C 271570a_100102525489_100009817021 [0,1,1,0,0,0|1,0,1]=4 869 B12R1.224 CC(=Cc1cccc(c1N)O)C 271570a_100102525489_100011934926 [0,1,1,0,0,0|0,0,2]=4 870 B12R1.224 CC(=Cc1cccc(c1O)O)C 271570a_100102525489_100009815950 [0,1,1,0,0,0|1,0,1]=4 871 B12R1.280 C=C=Cc1cccc(c1Br)CO 271570a_100015277604_100010240205 [0,1,1,0,0,0|1,0,1]=4 872 B12R1.280 C=C=Cc1cccc(c1C)CO 271570a_100015277604_100000694458 [0,1,1,0,0,0|1,0,1]=4 873 B12R1.280 C=C=Cc1cccc(c1C)OC 271570a_100015277604_100010002647 [0,1,1,0,0,0|1,0,1]=4 874 B12R1.280 C=C=Cc1cccc(c1Cl)OC 271570a_100015277604_100010147677 [0,1,1,0,0,0|1,0,1]=4 875 B12R1.280 C=C=Cc1cccc(c1F)CO 271570a_100015277604_100011935076 [0,1,1,0,0,0|1,0,1]=4 876 B12R1.280 C=C=Cc1cccc(c1F)OC 271570a_100015277604_100010185846 [0,1,1,0,0,0|1,0,1]=4 877 B12R1.280 C=C=Cc1cccc(c1N)CO 271570a_100015277604_100012349457 [0,1,1,0,0,0|0,0,2]=4 878 B12R1.280 C=C=Cc1cccc(c1N)OC 271570a_100015277604_100000708083 [0,1,1,0,0,0|0,0,2]=4 879 B12R1.280 C=C=Cc1cccc(c1O)OC 271570a_100015277604_100000686866 [0,1,1,0,0,0|1,0,1]=4 880 B12R1.280 CC=Cc1cccc(c1Br)CO 271570a_100016259895_100010240205 [0,1,1,0,0,0|1,0,1]=4 881 B12R1.280 CC=Cc1cccc(c1C)CO 271570a_100016259895_100000694458 [0,1,1,0,0,0|1,0,1]=4 882 B12R1.280 CC=Cc1cccc(c1C)OC 271570a_100016259895_100010002647 [0,1,1,0,0,0|1,0,1]=4 883 B12R1.280 CC=Cc1cccc(c1Cl)OC 271570a_100016259895_100010147677 [0,1,1,0,0,0|1,0,1]=4 884 B12R1.280 CC=Cc1cccc(c1F)CO 271570a_100016259895_100011935076 [0,1,1,0,0,0|1,0,1]=4 885 B12R1.280 CC=Cc1cccc(c1F)OC 271570a_100016259895_100010185846 [0,1,1,0,0,0|1,0,1]=4 886 B12R1.280 CC=Cc1cccc(c1N)CO 271570a_100016259895_100012349457 [0,1,1,0,0,0|0,0,2]=4 887 B12R1.280 CC=Cc1cccc(c1N)OC 271570a_100016259895_100000708083 [0,1,1,0,0,0|0,0,2]=4 888 B12R1.280 CC=Cc1cccc(c1O)OC 271570a_100016259895_100000686866 [0,1,1,0,0,0|1,0,1]=4 889 B12R1.497 C=C=Cc1c(ccc(c1C)O)C 271570a_100015277604_100010659238 [0,1,1,0,0,0|1,0,1]=4 890 B12R1.497 CC=Cc1c(ccc(c1C)O)C 271570a_100016259895_100010659238 [0,1,1,0,0,0|1,0,1]=4 891 B12R1.542 C=C=Cc1cccc(c1C#N)O 271570a_100015277604_100012180507 [0,1,1,0,0,0|0,0,2]=4 892 B12R1.542 C=C=Cc1cccc(c1C=O)O 271570a_100015277604_100009814793 [0,1,1,0,0,0|1,0,1]=4 893 B12R1.542 C=C=Cc1cccc(c1OC)O 271570a_100015277604_100010234590 [0,1,1,0,0,0|1,0,1]=4 894 B12R1.542 CC=Cc1cccc(c1C#N)O 271570a_100016259895_100012180507 [0,1,1,0,0,0|0,0,2]=4 895 B12R1.542 CC=Cc1cccc(c1C=O)O 271570a_100016259895_100009814793 [0,1,1,0,0,0|1,0,1]=4 896 B12R1.542 CC=Cc1cccc(c1OC)O 271570a_100016259895_100010234590 [0,1,1,0,0,0|1,0,1]=4 897 B12R1.544 C=C=Cc1ccc(c(c1F)O)Br 271570a_100015277604_200010782288 [0,1,1,0,0,0|1,0,1]=4 898 B12R1.544 C=C=Cc1ccc(c(c1F)O)F 271570a_100015277604_100010167067 [0,1,1,0,0,0|1,0,1]=4 899 B12R1.544 C=C=Cc1ccc(c(c1N)O)Br 271570a_100015277604_100020748643 [0,1,1,0,0,0|0,0,2]=4 900 B12R1.544 CC=Cc1ccc(c(c1F)O)Br 271570a_100016259895_200010782288 [0,1,1,0,0,0|1,0,1]=4 901 B12R1.544 CC=Cc1ccc(c(c1F)O)F 271570a_100016259895_100010167067 [0,1,1,0,0,0|1,0,1]=4 902 B12R1.544 CC=Cc1ccc(c(c1N)O)Br 271570a_100016259895_100020748643 [0,1,1,0,0,0|0,0,2]=4 903 B12R1.69 C=CCNc1ccc(cc1O)Br 34a_100000739049_100015514636 [0,1,1,0,0,0|0,0,2]=4 904 B12R1.69 C=CCNc1ccc(cc1O)C 34a_100000211527_100015514636 [0,1,1,0,0,0|0,0,2]=4 905 B12R1.69 C=CCNc1ccc(cc1O)Cl 34a_100000185728_100015514636 [0,1,1,0,0,0|0,0,2]=4 906 B12R1.69 C=CCNc1ccc(cc1O)F 34a_100000753323_100015514636 [0,1,1,0,0,0|0,0,2]=4 907 B12R1.69 C=CCNc1ccc(cc1O)O 34a_100000106777_100015514636 [0,1,1,0,0,0|0,0,2]=4 908 B12R1.69 C=CCSc1ccc(cc1O)Br 62a_100000210623_100012344904 [0,1,1,0,0,0|1,0,1]=4 909 B12R1.69 C=CCSc1ccc(cc1O)Br 62a_100012344904_100000210623 [0,1,1,0,0,0|1,0,1]=4 910 B12R1.69 C=CCSc1ccc(cc1O)C 62a_100000210623_100012002257 [0,1,1,0,0,0|1,0,1]=4 911 B12R1.69 C=CCSc1ccc(cc1O)C 62a_100012002257_100000210623 [0,1,1,0,0,0|1,0,1]=4 912 B12R1.69 C=CCSc1ccc(cc1O)Cl 62a_100000050036_100000210623 [0,1,1,0,0,0|1,0,1]=4 913 B12R1.69 C=CCSc1ccc(cc1O)Cl 62a_100000210623_100000050036 [0,1,1,0,0,0|1,0,1]=4 914 B12R1.69 C=CCSc1ccc(cc1O)F 62a_100000210623_100000690578 [0,1,1,0,0,0|1,0,1]=4 915 B12R1.69 C=CCSc1ccc(cc1O)F 62a_100000690578_100000210623 [0,1,1,0,0,0|1,0,1]=4 916 B12R1.69 C=CCSc1ccc(cc1O)O 62a_100000210623_100009813921 [0,1,1,0,0,0|1,0,1]=4 917 B12R1.121 C=CCNc1ccccc1CO 34a_100000212039_100015514636 [0,1,1,0,0,0|0,0,2]=4 918 B12R1.121 C=CCNc1ccccc1OC 34a_100000210025_100015514636 [0,1,1,0,0,0|0,0,2]=4 919 B12R1.121 C=CCOc1ccccc1CO 34a_100011216872_100015514636 [0,1,1,0,0,0|1,0,1]=4 920 B12R1.121 C=CCOc1ccccc1OC 34a_100000210385_100015514636 [0,1,1,0,0,0|1,0,1]=4 921 B12R1.121 C=CCOc1ccccc1OC 34a_200011262142_200000210301 [0,1,1,0,0,0|1,0,1]=4 922 B12R1.121 C=CCOc1ccccc1OC 7a_200011262142_200000210301 [0,1,1,0,0,0|1,0,1]=4 923 B12R1.121 C=CCOc1ccccc1O[13CH3] 34a_200011262142_200025704644 [0,1,1,0,0,0|1,0,1]=4 924 B12R1.121 C=CCOc1ccccc1O[13CH3] 7a_200011262142_200025704644 [0,1,1,0,0,0|1,0,1]=4 925 B12R1.121 C=CCSc1ccccc1CO 62a_100000187465_100000210623 [0,1,1,0,0,0|1,0,1]=4 926 B12R1.121 C=CCSc1ccccc1CO 62a_100000210623_100000187465 [0,1,1,0,0,0|1,0,1]=4 927 B12R1.121 C=CCSc1ccccc1OC 62a_100000210334_100000210623 [0,1,1,0,0,0|1,0,1]=4 928 B12R1.121 C=CCSc1ccccc1OC 62a_100000210623_100000210334 [0,1,1,0,0,0|1,0,1]=4 929 B12R1.125 C=C(C)CNc1ccccc1O 34a_100000185747_100000748629 [0,1,1,0,0,0|0,0,2]=4 930 B12R1.125 C=C(C)CSc1ccccc1O 62a_100000739446_100000211660 [0,1,1,0,0,0|1,0,1]=4 931 B12R1.125 C=C(C)CSc1ccccc1O 62a_100000748629_100000739446 [0,1,1,0,0,0|1,0,1]=4 932 B12R1.125 C=C(F)CNc1ccccc1O 34a_100000185747_100009893438 [0,1,1,0,0,0|0,0,2]=4 933 B12R1.125 C=C(F)CSc1ccccc1O 62a_100000042424_100000739446 [0,1,1,0,0,0|1,0,1]=4 934 B12R1.125 C=C(F)CSc1ccccc1O 62a_100000739446_100000042424 [0,1,1,0,0,0|1,0,1]=4 935 B12R1.125 CC(=O)C=Cc1ccccc1O 1458a_100016263591_200000210301 [0,1,1,0,0,0|1,0,1]=4 936 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1O 1458a_100016263591_200025704644 [0,1,1,0,0,0|1,0,1]=4 937 B12R1.267 C/C=C/CNc1ccccc1O 34a_100000185747_100102629194 [0,1,1,0,0,0|0,0,2]=4 938 B12R1.267 C/C=C/CSc1ccccc1O 62a_100000739446_100102629194 [0,1,1,0,0,0|1,0,1]=4 939 B12R1.267 C/C=C/CSc1ccccc1O 62a_100102629194_100000739446 [0,1,1,0,0,0|1,0,1]=4 940 B12R1.267 C=CCCNc1ccccc1O 34a_100000185747_100000754431 [0,1,1,0,0,0|0,0,2]=4 941 B12R1.267 C=CCCSc1ccccc1O 62a_100000739446_100000754431 [0,1,1,0,0,0|1,0,1]=4 942 B12R1.267 C=CCCSc1ccccc1O 62a_100000754431_100000739446 [0,1,1,0,0,0|1,0,1]=4 943 B12R1.267 C=CCNCc1ccccc1O 34a_100000185550_100015514636 [0,1,1,0,0,0|0,0,2]=4 944 B12R1.267 CC=CCNc1ccccc1O 34a_100000185747_100000070051 [0,1,1,0,0,0|0,0,2]=4 945 B12R1.267 CC=CCSc1ccccc1O 62a_100000070051_100000739446 [0,1,1,0,0,0|1,0,1]=4 946 B12R1.267 CC=CCSc1ccccc1O 62a_100000739446_100000070051 [0,1,1,0,0,0|1,0,1]=4 947 B12R1.371 C=CC(=O)Cc1ccccc1Br 1458a_100000185746_100000184730 [0,1,1,0,0,0|2,0,0]=4 948 B12R1.371 C=CC(=O)Cc1ccccc1C 1458a_100000185746_100000211839 [0,1,1,0,0,0|2,0,0]=4 949 B12R1.371 C=CC(=O)Cc1ccccc1Cl 1458a_100000185746_100000187162 [0,1,1,0,0,0|2,0,0]=4 950 B12R1.371 C=CC(=O)Cc1ccccc1F 1458a_100000185746_100000187165 [0,1,1,0,0,0|2,0,0]=4 951 B12R1.371 C=CC(=O)Cc1ccccc1I 1458a_100000185746_100011216222 [0,1,1,0,0,0|2,0,0]=4 952 B12R1.371 C=CC(=O)Cc1ncccc1O 1458a_100000185746_200020655725 [0,1,1,0,0,0|2,0,0]=4 953 B12R1.371 C=CC(=O)Nc1ccccc1Br 1626a_100000210017_100000185746 [0,1,1,0,0,0|1,0,1]=4 954 B12R1.371 C=CC(=O)Nc1ccccc1C 1626a_100015192222_100000185746 [0,1,1,0,0,0|1,0,1]=4 955 B12R1.371 C=CC(=O)Nc1ccccc1C 22a_100015192222_100000185746 [0,1,1,0,0,0|1,0,1]=4 956 B12R1.371 C=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000185746 [0,1,1,0,0,0|1,0,1]=4 957 B12R1.371 C=CC(=O)Nc1ccccc1Cl 22a_100000185783_100000185746 [0,1,1,0,0,0|1,0,1]=4 958 B12R1.371 C=CC(=O)Nc1ccccc1F 1626a_100000210422_100000185746 [0,1,1,0,0,0|1,0,1]=4 959 B12R1.371 C=CC(=O)Nc1ccccc1F 22a_100000210422_100000185746 [0,1,1,0,0,0|1,0,1]=4 960 B12R1.371 C=CC(=O)Nc1ccccc1I 1626a_100000210053_100000185746 [0,1,1,0,0,0|1,0,1]=4 961 B12R1.371 C=CC(=O)Nc1ccccc1O 22a_100000185747_100000185746 [0,1,1,0,0,0|0,0,1]=3 962 B12R1.371 C=CC(C)Sc1ccccc1O 62a_100011215867_100000739446 [0,1,1,0,0,0|1,0,1]=4 963 B12R1.374 C=CCNc1cc(ccc1O)Br 34a_100000752626_100015514636 [0,1,1,0,0,0|0,0,2]=4 964 B12R1.374 C=CCNc1cc(ccc1O)C 34a_100011215204_100015514636 [0,1,1,0,0,0|0,0,2]=4 965 B12R1.374 C=CCNc1cc(ccc1O)Cl 34a_100000210500_100015514636 [0,1,1,0,0,0|0,0,2]=4 966 B12R1.374 C=CCNc1cc(ccc1O)F 34a_100000759472_100015514636 [0,1,1,0,0,0|0,0,2]=4 967 B12R1.374 C=CCSc1cc(ccc1O)Br 62a_100000210623_100012355227 [0,1,1,0,0,0|1,0,1]=4 968 B12R1.374 C=CCSc1cc(ccc1O)Br 62a_100012355227_100000210623 [0,1,1,0,0,0|1,0,1]=4 969 B12R1.374 C=CCSc1cc(ccc1O)C 62a_100000210623_100000765521 [0,1,1,0,0,0|1,0,1]=4 970 B12R1.374 C=CCSc1cc(ccc1O)C 62a_100000765521_100000210623 [0,1,1,0,0,0|1,0,1]=4 971 B12R1.374 C=CCSc1cc(ccc1O)Cl 62a_100000210623_100011356953 [0,1,1,0,0,0|1,0,1]=4 972 B12R1.374 C=CCSc1cc(ccc1O)Cl 62a_100011356953_100000210623 [0,1,1,0,0,0|1,0,1]=4 973 B12R1.374 C=CCSc1cc(ccc1O)F 62a_100000210623_100000211999 [0,1,1,0,0,0|1,0,1]=4 974 B12R1.374 C=CCSc1cc(ccc1O)F 62a_100000211999_100000210623 [0,1,1,0,0,0|1,0,1]=4 975 B12R1.374 C=CCSc1cc(ccc1O)N 62a_100000210623_100011534360 [0,1,1,0,0,0|1,0,1]=4 976 B12R1.374 C=CCSc1cc(ccc1O)N 62a_100011534360_100000210623 [0,1,1,0,0,0|1,0,1]=4 977 B12R1.374 C=CCSc1cc(ccc1O)O 62a_100000210623_100009813629 [0,1,1,0,0,0|1,0,1]=4 978 B12R1.1631 C=CCNc1c(cccc1Br)O 34a_100011934926_100015514636 [0,1,1,0,0,0|0,0,2]=4 979 B12R1.1631 C=CCNc1c(cccc1Cl)O 34a_100012022510_100015514636 [0,1,1,0,0,0|0,0,2]=4 980 B12R1.1631 C=CCNc1c(cccc1F)O 34a_100020591140_100015514636 [0,1,1,0,0,0|0,0,2]=4 981 B12R1.1631 C=CCNc1c(cccc1O)C 34a_100000743429_100015514636 [0,1,1,0,0,0|0,0,2]=4 982 B12R1.1631 C=CCSc1c(cccc1Br)O 62a_100000210623_100010187912 [0,1,1,0,0,0|1,0,1]=4 983 B12R1.1631 C=CCSc1c(cccc1Br)O 62a_100010187912_100000210623 [0,1,1,0,0,0|1,0,1]=4 984 B12R1.1631 C=CCSc1c(cccc1Cl)O 62a_100000210623_100000050174 [0,1,1,0,0,0|1,0,1]=4 985 B12R1.1631 C=CCSc1c(cccc1F)O 62a_100000210623_100009820682 [0,1,1,0,0,0|1,0,1]=4 986 B12R1.1631 C=CCSc1c(cccc1F)O 62a_100009820682_100000210623 [0,1,1,0,0,0|1,0,1]=4 987 B12R1.1631 C=CCSc1c(cccc1O)C 62a_100000210623_100000686692 [0,1,1,0,0,0|1,0,1]=4 988 B12R1.1631 C=CCSc1c(cccc1O)C 62a_100000686692_100000210623 [0,1,1,0,0,0|1,0,1]=4 989 B12R1.1631 C=CCSc1c(cccc1O)N 62a_100000210623_100012183704 [0,1,1,0,0,0|1,0,1]=4 990 B12R1.1631 C=CCSc1c(cccc1O)N 62a_100012183704_100000210623 [0,1,1,0,0,0|1,0,1]=4 991 B12R1.1631 C=CCSc1c(cccc1O)O 62a_100000210623_100010205330 [0,1,1,0,0,0|1,0,1]=4 992 B12R1.28 C/C=C/CNc1cccc(c1)O 34a_100000210217_100102629194 [0,1,1,0,0,0|1,0,1]=4 993 B12R1.28 C/C=C/CSc1cccc(c1)O 62a_100102629194_100000211634 [0,1,1,0,0,0|1,0,1]=4 994 B12R1.28 CC=CCNc1cccc(c1)O 34a_100000210217_100000070051 [0,1,1,0,0,0|1,0,1]=4 995 B12R1.28 CC=CCSc1cccc(c1)O 62a_100000070051_100000211634 [0,1,1,0,0,0|1,0,1]=4 996 B12R1.28 CCCC=Cc1cccc(c1)O 271570a_100016258520_100000211634 [0,1,1,0,0,0|1,0,1]=4 997 B12R1.28 CCOC=Cc1cccc(c1)O 271570a_100016256518_100000211634 [0,1,1,0,0,0|1,0,1]=4 998 B12R1.28 COCC=Cc1cccc(c1)O 271570a_100016286323_100000211634 [0,1,1,0,0,0|1,0,1]=4 999 B12R1.50 C=CC(=O)Cc1cccc(c1)O 1458a_100000185746_100011660834 [0,1,1,0,0,0|1,0,1]=4 1000 B12R1.50 C=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100000185746 [0,1,1,0,0,0|2,0,0]=4 1001 B12R1.50 C=CC(=O)Nc1cccc(c1)O 22a_100000210217_100000185746 [0,1,1,0,0,0|2,0,0]=4 1002 B12R1.226 CC(=O)/C=C/c1cccc(c1)O 271570a_203496583355_200016266566 [0,1,1,0,0,0|1,0,0]=3 1003 B12R1.226 CC(=O)C=Cc1cccc(c1)Br 1458a_100016258244_200000210301 [0,1,1,0,0,0|2,0,0]=4 1004 B12R1.226 CC(=O)C=Cc1cccc(c1)C 1458a_100000690095_200000210301 [0,1,1,0,0,0|2,0,0]=4 1005 B12R1.226 CC(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_200000210301 [0,1,1,0,0,0|2,0,0]=4 1006 B12R1.226 CC(=O)C=Cc1cccc(c1)F 1458a_100000718793_200000210301 [0,1,1,0,0,0|2,0,0]=4 1007 B12R1.226 CC(=O)C=Cc1cccc(c1)I 1458a_100020647043_200000210301 [0,1,1,0,0,0|2,0,0]=4 1008 B12R1.226 CC(C)C=Cc1cccc(c1)O 271570a_100016257149_100000211634 [0,1,1,0,0,0|1,0,1]=4 1009 B12R1.226 CC(O)C=Cc1cccc(c1)O 271570a_200011019289_100000211634 [0,1,1,0,0,0|1,0,1]=4 1010 B12R1.226 Cc1cccc(c1)C=CC(=O)[13CH3] 1458a_100000690095_200025704644 [0,1,1,0,0,0|2,0,0]=4 1011 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)Br 1458a_100016258244_200025704644 [0,1,1,0,0,0|2,0,0]=4 1012 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_200025704644 [0,1,1,0,0,0|2,0,0]=4 1013 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)F 1458a_100000718793_200025704644 [0,1,1,0,0,0|2,0,0]=4 1014 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)I 1458a_100020647043_200025704644 [0,1,1,0,0,0|2,0,0]=4 1015 B12R1.27 CCC(=O)C=Cc1cccnc1 1458a_100000735890_100000210202 [0,1,1,0,0,0|1,0,1]=4 1016 B12R1.27 CNC(=O)C=Cc1cccnc1 11a_106832991635_100000735890 [0,1,1,0,0,0|2,0,0]=4 1017 B12R1.27 CNC(=O)C=Cc1cccnc1 240690a_100102657272_100000735890 [0,1,1,0,0,0|2,0,0]=4 1018 B12R1.27 O=C(C=Cc1cccnc1)CF 1458a_100000735890_100015361967 [0,1,1,0,0,0|1,0,1]=4 1019 B12R1.32 CC=CC(=O)Cc1cccnc1 1458a_100000210699_100000733263 [0,1,1,0,0,0|1,0,1]=4 1020 B12R1.32 O=C(C=CBr)Cc1cccnc1 1458a_100016273825_100000733263 [0,1,1,0,0,0|1,0,1]=4 1021 B12R1.32 O=C(C=CCl)Cc1cccnc1 1458a_200016279998_100000733263 [0,1,1,0,0,0|1,0,1]=4 1022 B12R1.32 O=C(C=CI)Cc1cccnc1 1458a_100016256311_100000733263 [0,1,1,0,0,0|1,0,1]=4 1023 B12R1.75 CC(=Cc1cccnc1C=O)C 271570a_100102525489_100011934733 [0,1,1,0,0,0|0,0,2]=4 1024 B12R1.75 CC(=Cc1cccnc1CO)C 271570a_100102525489_100011996772 [0,1,1,0,0,0|0,0,2]=4 1025 B12R1.112 C=C=Cc1ccc(nc1C=O)C 271570a_100015277604_100010173661 [0,1,1,0,0,0|0,0,2]=4 1026 B12R1.112 C=C=Cc1ccc(nc1CO)C 271570a_100015277604_100010074375 [0,1,1,0,0,0|0,0,2]=4 1027 B12R1.112 C=C=Cc1ccc(nc1CO)F 271570a_100015277604_100000701195 [0,1,1,0,0,0|0,0,2]=4 1028 B12R1.112 CC=Cc1ccc(nc1C=O)C 271570a_100016259895_100010173661 [0,1,1,0,0,0|0,0,2]=4 1029 B12R1.112 CC=Cc1ccc(nc1CO)C 271570a_100016259895_100010074375 [0,1,1,0,0,0|0,0,2]=4 1030 B12R1.112 CC=Cc1ccc(nc1CO)F 271570a_100016259895_100000701195 [0,1,1,0,0,0|0,0,2]=4 1031 B12R1.283 C=C=Cc1cccnc1C(=O)C 271570a_100015277604_100012348690 [0,1,1,0,0,0|0,0,2]=4 1032 B12R1.283 C=C=Cc1cccnc1C(=O)N 271570a_100015277604_200012359670 [0,1,1,0,0,0|0,0,2]=4 1033 B12R1.283 C=C=Cc1cccnc1[C@H](C)O 271570a_100015277604_100013325542 [0,1,1,0,0,0|0,0,2]=4 1034 B12R1.283 CC=Cc1cccnc1C(=O)C 271570a_100016259895_100012348690 [0,1,1,0,0,0|0,0,2]=4 1035 B12R1.283 CC=Cc1cccnc1C(=O)N 271570a_100016259895_200012359670 [0,1,1,0,0,0|0,0,2]=4 1036 B12R1.283 CC=Cc1cccnc1[C@H](C)O 271570a_100016259895_100013325542 [0,1,1,0,0,0|0,0,2]=4 1037 B12R1.46 C=C(C)c1nc(ccc1C=O)C 271570a_100000694244_100000085379 [0,1,1,0,0,0|2,0,0]=4 1038 B12R1.46 C=C(C)c1nc(ccc1C=O)F 271570a_100000694244_100009846357 [0,1,1,0,0,0|2,0,0]=4 1039 B12R1.57 C=C(C)c1ncc(cc1C=O)C 271570a_100000694244_100000050350 [0,1,1,0,0,0|2,0,0]=4 1040 B12R1.57 C=C(C)c1ncc(cc1C=O)F 271570a_100000694244_100000079965 [0,1,1,0,0,0|2,0,0]=4 1041 B12R1.76 C=Cc1cccnc1C(C)(C)O 271570a_100011290941_200010080787 [0,1,1,0,0,0|0,0,2]=4 1042 B12R1.87 C=C(C)c1nccc(c1C=O)O 271570a_100000694244_200010729673 [0,1,1,0,0,0|2,0,0]=4 1043 B12R1.261 C=C(C)c1cccnc1C(=O)C 271570a_100000694244_100012348690 [0,1,1,0,0,0|0,0,2]=4 1044 B12R1.261 C=C(C)c1cccnc1C(=O)N 271570a_100000694244_200012359670 [0,1,1,0,0,0|1,0,1]=4 1045 B12R1.261 C=C(C)c1cccnc1[C@H](C)O 271570a_100000694244_100013325542 [0,1,1,0,0,0|0,0,2]=4 1046 B12R1.261 C=C(C)c1ncccc1C(=O)C 271570a_100000694244_100000753718 [0,1,1,0,0,0|1,0,1]=4 1047 B12R1.261 C=C(C)c1ncccc1C(=O)N 271570a_100000694244_100000162199 [0,1,1,0,0,0|2,0,0]=4 1048 B12R1.652 C=Cc1ccc(c(c1OC)O)F 271570a_100011290941_200010167157 [0,1,1,0,0,0|1,0,1]=4 1049 B12R1.741 C=Cc1c(ccc(c1C=O)O)F 271570a_100011290941_100010762561 [0,1,1,0,0,0|2,0,0]=4 1050 B12R1.741 C=Cc1c(ccc(c1C=O)O)O 271570a_100011290941_100010184888 [0,1,1,0,0,0|2,0,0]=4 1051 B12R1.1879 C=Cc1cccc(c1C#N)OC 271570a_100011290941_100012356440 [0,1,1,0,0,0|2,0,0]=4 1052 B12R1.1879 C=Cc1cccc(c1C=O)OC 271570a_100011290941_100009814803 [0,1,1,0,0,0|2,0,0]=4 1053 B12R1.1879 C=Cc1cccc(c1OC)CO 271570a_100011290941_100000704359 [0,1,1,0,0,0|1,0,1]=4 1054 B12R1.1879 C=Cc1cccc(c1OC)OC 271570a_100011290941_100009815961 [0,1,1,0,0,0|1,0,1]=4 1055 B12R2.24 Oc1cc2ccccc2cn1 271570a_203496583355_100000047361 [1,1,0,0,0,0|2,0,0]=4 1056 B12R2.24 Oc1cc2nccnc2cn1 271570a_203496583355_100010370699 [1,1,0,0,0,0|2,0,0]=4 1057 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [1,1,0,0,0,0|1,0,0]=3 1058 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [1,1,0,0,0,0|0,0,0]=2 1059 B12R2.24 Oc1ccc2cccnc2c1 271570a_203496583355_100009816655 [1,1,0,0,0,0|0,0,0]=2 1060 B12R2.24 Oc1ccc2cccnc2n1 271570a_203496583355_100009888989 [1,1,0,0,0,0|1,0,0]=3 1061 B12R2.24 Oc1ccc2ccncc2c1 271570a_203496583355_100000686496 [1,1,0,0,0,0|2,0,0]=4 1062 B12R2.24 Oc1ccc2ccncc2n1 271570a_203496583355_100000020162 [1,1,0,0,0,0|1,0,0]=3 1063 B12R2.24 Oc1ccc2cnccc2c1 271570a_203496583355_100009816743 [1,1,0,0,0,0|2,0,0]=4 1064 B12R2.24 Oc1ccc2cncnc2c1 271570a_203496583355_100010185614 [1,1,0,0,0,0|1,0,0]=3 1065 B12R2.24 Oc1ccc2ncccc2c1 271570a_203496583355_100000754243 [1,1,0,0,0,0|0,0,0]=2 1066 B12R2.24 Oc1ccc2ncccc2n1 271570a_203496583355_100000073381 [1,1,0,0,0,0|1,0,0]=3 1067 B12R2.24 Oc1ccc2nccnc2c1 271570a_203496583355_100011219451 [1,1,0,0,0,0|1,0,0]=3 1068 B12R2.24 Oc1ccc2nccnc2n1 271570a_203496583355_100012351543 [1,1,0,0,0,0|2,0,0]=4 1069 B12R2.24 Oc1ccc2ncncc2c1 271570a_203496583355_100009989443 [1,1,0,0,0,0|1,0,0]=3 1070 B12R2.24 Oc1ccc2nnccc2c1 271570a_203496583355_100010209549 [1,1,0,0,0,0|1,0,0]=3 1071 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [1,1,0,0,0,0|0,0,0]=2 1072 B12R2.24 Oc1cnc2ccccc2n1 271570a_203496583355_100000756483 [1,1,0,0,0,0|1,0,0]=3 1073 B12R2.24 Oc1cnc2cccnc2c1 271570a_203496583355_100010246316 [1,1,0,0,0,0|1,0,0]=3 1074 B12R2.24 Oc1cnc2ncccc2n1 271570a_203496583355_100000084304 [1,1,0,0,0,0|2,0,0]=4 1075 B12R2.24 Oc1cnc2nccnc2c1 271570a_203496583355_100000753224 [1,1,0,0,0,0|2,0,0]=4 1076 B12R2.24 Oc1ncc2ccccc2n1 271570a_203496583355_100000097389 [1,1,0,0,0,0|1,0,0]=3 1077 B12R2.1 C=Cc1c[nH]c2c1nccc2 271570a_100011290941_100009817151 [0,1,0,0,1,0|2,0,0]=4 1078 B12R2.1 C=Cc1coc2c1nccc2 271570a_100011290941_100009889148 [0,1,0,0,1,0|2,0,0]=4 1079 B12R2.1 C=Cc1csc2c1nccc2 271570a_100011290941_100010247092 [0,1,0,0,1,0|2,0,0]=4 1080 B12R2.1 COc1csc2c1cccc2 34a_100000077758_200000210301 [0,1,0,0,1,0|2,0,0]=4 1081 B12R2.1 COc1csc2c1cccc2 7a_100000077758_200000210301 [0,1,0,0,1,0|2,0,0]=4 1082 B12R2.1 CSc1c[nH]c2c1nccc2 62a_200000210301_100009817151 [0,1,0,0,1,0|1,1,0]=4 1083 B12R2.1 CSc1coc2c1nccc2 62a_200000210301_100009889148 [0,1,0,0,1,0|1,1,0]=4 1084 B12R2.1 CSc1csc2c1nccc2 62a_200000210301_100010247092 [0,1,0,0,1,0|1,1,0]=4 1085 B12R2.1 [13CH3]Oc1csc2c1cccc2 34a_100000077758_200025704644 [0,1,0,0,1,0|2,0,0]=4 1086 B12R2.1 [13CH3]Oc1csc2c1cccc2 7a_100000077758_200025704644 [0,1,0,0,1,0|2,0,0]=4 1087 B12R2.1 [13CH3]Sc1c[nH]c2c1nccc2 62a_200025704644_100009817151 [0,1,0,0,1,0|1,1,0]=4 1088 B12R2.1 [13CH3]Sc1coc2c1nccc2 62a_200025704644_100009889148 [0,1,0,0,1,0|1,1,0]=4 1089 B12R2.1 [13CH3]Sc1csc2c1nccc2 62a_200025704644_100010247092 [0,1,0,0,1,0|1,1,0]=4 1090 B12R2.18 Cc1nc2cccnn2c1O 271570a_203496583355_200010336598 [0,1,0,0,1,0|2,0,0]=4 1091 B12R2.18 Cc1nn2cccnc2c1O 271570a_203496583355_100010221215 [0,1,0,0,1,0|2,0,0]=4 1092 B12R2.18 Cc1oc2ccccc2c1O 271570a_203496583355_200010236113 [0,1,0,0,1,0|2,0,0]=4 1093 B12R2.18 Cc1sc2ccccc2c1O 271570a_203496583355_100010002616 [0,1,0,0,1,0|2,0,0]=4 1094 B12R2.132 Nc1ccc2ncc(n2n1)O 271570a_203496583355_100010240408 [0,1,0,0,1,0|2,0,0]=4 1095 B12R2.132 Nc1ccc2scc(c2c1)O 271570a_203496583355_100011178648 [0,1,0,0,1,0|2,0,0]=4 1096 B12R2.132 Oc1cnn2c1nc(cc2)Cl 271570a_203496583355_100010174842 [0,1,0,0,1,0|2,0,0]=4 1097 B12R2.132 Oc1n[nH]c2c1nc(cc2)Br 271570a_203496583355_200010370904 [0,1,0,0,1,0|2,0,0]=4 1098 B12R2.196 Cn1ccc2c1nccc2O 271570a_203496583355_100010168893 [0,1,0,0,1,0|2,0,0]=4 1099 B12R2.196 Nc1ncnc2c1scc2O 271570a_203496583355_100010254332 [0,1,0,0,1,0|2,0,0]=4 1100 B12R2.196 Nc1ncnn2c1ccc2O 271570a_203496583355_100010200936 [0,1,0,0,1,0|2,0,0]=4 1101 B12R2.196 O=c1[nH]cnn2c1ccc2O 271570a_203496583355_100000724678 [0,1,0,0,1,0|2,0,0]=4 1102 B12R2.196 Oc1csc2c1ncnc2O 271570a_203496583355_100010075196 [0,1,0,0,1,0|2,0,0]=4 1103 B12R2.612 Cn1ccc2c1ncc(c2)O 271570a_203496583355_100010191616 [0,1,0,0,1,0|2,0,0]=4 1104 B12R2.612 O=C1C=Cc2c1ccc(c2)O 271570a_203496583355_100010210589 [0,1,0,0,1,0|1,0,1]=4 1105 B12R2.612 Oc1cnn2c1ncc(c2)Br 271570a_203496583355_100010128760 [0,1,0,0,1,0|2,0,0]=4 1106 B12R2.612 Oc1n[nH]c2c1ncc(c2)Br 271570a_203496583355_100010289622 [0,1,0,0,1,0|2,0,0]=4 1107 B12R2.2028 Cn1cc(c2c1nccc2)O 271570a_203496583355_100010205794 [0,1,0,0,1,0|2,0,0]=4 1108 B12R2.2028 Cn1nc(c2c1cccn2)O 271570a_203496583355_100000761950 [0,1,0,0,1,0|2,0,0]=4 1109 B12R2.82 Cc1c(ccc2c1[nH]cc2)O 271570a_203496583355_100009816929 [0,1,0,0,1,0|1,0,1]=4 1110 B12R2.82 Cc1c(ccc2c1cc[nH]2)O 271570a_203496583355_100010731972 [0,1,0,0,1,0|2,0,0]=4 1111 B12R2.82 Cc1c(ccc2c1nc[nH]2)O 271570a_203496583355_100010009745 [0,1,0,0,1,0|2,0,0]=4 1112 B12R2.82 Cc1c(ccc2n1ncc2)O 271570a_203496583355_100010767214 [0,1,0,0,1,0|2,0,0]=4 1113 B12R2.82 Cc1ccc2[nH]ccc2c1O 271570a_203496583355_100010248896 [0,1,0,0,1,0|1,0,0]=3 1114 B12R2.82 Cc1ccc2[nH]ncc2c1O 271570a_203496583355_100009817104 [0,1,0,0,1,0|2,0,0]=4 1115 B12R2.82 Cc1ccc2cc[nH]c2c1O 271570a_203496583355_100010717004 [0,1,0,0,1,0|0,0,1]=3 1116 B12R2.82 Cc1ccc2cn[nH]c2c1O 271570a_203496583355_100009817202 [0,1,0,0,1,0|1,0,1]=4 1117 B12R2.82 Cc1ccc2nccn2c1O 271570a_203496583355_100010765079 [0,1,0,0,1,0|2,0,0]=4 1118 B12R2.82 Cc1cnc2[nH]ccc2c1O 271570a_203496583355_100000097406 [0,1,0,0,1,0|2,0,0]=4 1119 B12R2.82 Cc1ncc2[nH]ccc2c1O 271570a_203496583355_100011015088 [0,1,0,0,1,0|2,0,0]=4 1120 B12R2.82 Nc1ccc2[nH]cnc2c1O 271570a_203496583355_100009816657 [0,1,0,0,1,0|1,0,0]=3 1121 B12R2.82 Nc1ccc2ncsc2c1O 271570a_203496583355_100010007894 [0,1,0,0,1,0|2,0,0]=4 1122 B12R2.82 Nc1ccc2scnc2c1O 271570a_203496583355_100009816736 [0,1,0,0,1,0|1,0,0]=3 1123 B12R2.82 Oc1c(ccc2c1[nH]nc2)F 271570a_203496583355_100010762478 [0,1,0,0,1,0|1,0,1]=4 1124 B12R2.82 Oc1c(ccc2c1cc[nH]2)F 271570a_203496583355_100102525403 [0,1,0,0,1,0|1,0,0]=3 1125 B12R2.82 Oc1c(ccc2c1cn[nH]2)F 271570a_203496583355_200010080415 [0,1,0,0,1,0|2,0,0]=4 1126 B12R2.82 Oc1c(ccc2c1nc[nH]2)F 271570a_203496583355_200010369618 [0,1,0,0,1,0|1,0,0]=3 1127 B12R2.82 Oc1c(ccc2c1ocn2)F 271570a_203496583355_100010870391 [0,1,0,0,1,0|2,0,0]=4 1128 B12R2.82 Oc1c(cnc2c1[nH]cc2)F 271570a_203496583355_100009883597 [0,1,0,0,1,0|1,0,1]=4 1129 B12R2.82 Oc1c(cnc2c1cc[nH]2)F 271570a_203496583355_100000118126 [0,1,0,0,1,0|2,0,0]=4 1130 B12R2.82 Oc1ccc2[nH]ccc2c1F 271570a_203496583355_100000700836 [0,1,0,0,1,0|2,0,0]=4 1131 B12R2.202 CC1=Cc2cccc(c2C1)O 271570a_203496583355_100010271545 [0,1,0,0,1,0|0,0,1]=3 1132 B12R2.202 Cc1cc2c(cccc2[nH]1)O 271570a_203496583355_100010143266 [0,1,0,0,1,0|1,0,0]=3 1133 B12R2.202 Cc1cc2c(ccnc2[nH]1)O 271570a_203496583355_100010202352 [0,1,0,0,1,0|2,0,0]=4 1134 B12R2.202 Cc1cccc2c1nc(s2)O 271570a_203496583355_100010008827 [0,1,0,0,1,0|2,0,0]=4 1135 B12R2.202 Cc1cn2c(cccc2n1)O 271570a_203496583355_100009817088 [0,1,0,0,1,0|2,0,0]=4 1136 B12R2.202 Cc1cn2ccnc(c2n1)O 271570a_203496583355_100000098434 [0,1,0,0,1,0|2,0,0]=4 1137 B12R2.202 Cc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012360556 [0,1,0,0,1,0|1,0,0]=3 1138 B12R2.202 Cc1nc2c(cccc2o1)O 271570a_203496583355_100010883239 [0,1,0,0,1,0|1,0,0]=3 1139 B12R2.202 Cc1nc2c(cccc2s1)O 271570a_203496583355_100010236672 [0,1,0,0,1,0|1,0,0]=3 1140 B12R2.202 Cc1nc2cccc(c2o1)O 271570a_203496583355_100010168998 [0,1,0,0,1,0|2,0,0]=4 1141 B12R2.202 Cc1nc2cccc(c2s1)O 271570a_203496583355_100010236699 [0,1,0,0,1,0|2,0,0]=4 1142 B12R2.202 Cn1cc2c(cccc2n1)O 271570a_203496583355_100009817162 [0,1,0,0,1,0|2,0,0]=4 1143 B12R2.202 Cn1cc2cccc(c2n1)O 271570a_203496583355_100009817170 [0,1,0,0,1,0|1,0,0]=3 1144 B12R2.202 Cn1cc2ccnc(c2n1)O 271570a_203496583355_100010890759 [0,1,0,0,1,0|2,0,0]=4 1145 B12R2.202 Nc1cc2cccc(c2s1)O 271570a_203496583355_100010090802 [0,1,0,0,1,0|1,0,0]=3 1146 B12R2.202 Nc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012356985 [0,1,0,0,1,0|1,0,0]=3 1147 B12R2.202 Nc1nc2c(cccc2s1)O 271570a_203496583355_100000724365 [0,1,0,0,1,0|1,0,0]=3 1148 B12R2.202 Nc1nc2c(cccn2n1)O 271570a_203496583355_100012344205 [0,1,0,0,1,0|2,0,0]=4 1149 B12R2.202 Nc1nc2cccc(c2o1)O 271570a_203496583355_100012347120 [0,1,0,0,1,0|2,0,0]=4 1150 B12R2.202 Nc1nc2cccc(c2s1)O 271570a_203496583355_100010235960 [0,1,0,0,1,0|2,0,0]=4 1151 B12R2.202 Nc1nc2cccc(n2n1)O 271570a_203496583355_100010243777 [0,1,0,0,1,0|2,0,0]=4 1152 B12R2.202 O=C1Cc2c(cccc2N1)O 271570a_203496583355_100009816812 [0,1,0,0,1,0|1,0,1]=4 1153 B12R2.202 O=C1Cc2cccc(c2C1)O 271570a_203496583355_100010205903 [0,1,0,0,1,0|0,0,2]=4 1154 B12R2.202 O=C1Cc2cccc(c2N1)O 271570a_203496583355_100000767046 [0,1,0,0,1,0|0,0,2]=4 1155 B12R2.202 O=c1[nH]c2cccc(c2o1)O 271570a_203496583355_100012360093 [0,1,0,0,1,0|2,0,0]=4 1156 B12R2.202 Oc1cc2c(nccc2s1)O 271570a_203496583355_100010116216 [0,1,0,0,1,0|2,0,0]=4 1157 B12R2.202 Oc1cc2cccc(c2[nH]1)Br 271570a_203496583355_100135389745 [0,1,0,0,1,0|1,0,1]=4 1158 B12R2.202 Oc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012347640 [0,1,0,0,1,0|1,0,0]=3 1159 B12R2.202 Oc1nc2c(cccc2s1)F 271570a_203496583355_100010008856 [0,1,0,0,1,0|2,0,0]=4 1160 B12R2.202 Oc1nc2c(cncc2[nH]1)O 271570a_203496583355_100012340553 [0,1,0,0,1,0|2,0,0]=4 1161 B12R2.221 Cc1ccc(c2c1[nH]cc2)O 271570a_203496583355_100009820812 [0,1,0,0,1,0|1,0,0]=3 1162 B12R2.221 Cc1ccc(c2c1[nH]nc2)O 271570a_203496583355_100009817120 [0,1,0,0,1,0|2,0,0]=4 1163 B12R2.221 Cc1ccc(c2c1cc[nH]2)O 271570a_203496583355_100010219157 [0,1,0,0,1,0|0,0,1]=3 1164 B12R2.221 Cc1ccc(c2c1cco2)O 271570a_203496583355_100010253976 [0,1,0,0,1,0|1,0,0]=3 1165 B12R2.221 Cc1ccc(c2c1nsn2)O 271570a_203496583355_100010200902 [0,1,0,0,1,0|2,0,0]=4 1166 B12R2.221 Cc1ccc(c2n1ccn2)O 271570a_203496583355_200015695500 [0,1,0,0,1,0|1,0,0]=3 1167 B12R2.221 Cc1ccc(c2n1ncn2)O 271570a_203496583355_100010254782 [0,1,0,0,1,0|2,0,0]=4 1168 B12R2.221 Cc1cnc(c2c1[nH]cc2)O 271570a_203496583355_100010244391 [0,1,0,0,1,0|2,0,0]=4 1169 B12R2.221 Cc1ncc(c2c1cc[nH]2)O 271570a_203496583355_100010244396 [0,1,0,0,1,0|1,0,1]=4 1170 B12R2.221 O=c1[nH]cc(c2c1cco2)O 271570a_203496583355_100010244693 [0,1,0,0,1,0|2,0,0]=4 1171 B12R2.221 O=c1[nH]cc(c2c1ccs2)O 271570a_203496583355_100000692125 [0,1,0,0,1,0|2,0,0]=4 1172 B12R2.221 Oc1ccc(c2c1[nH]cc2)F 271570a_203496583355_100010138378 [0,1,0,0,1,0|0,0,1]=3 1173 B12R2.221 Oc1ccc(c2c1[nH]nc2)F 271570a_203496583355_100010206778 [0,1,0,0,1,0|1,0,1]=4 1174 B12R2.221 Oc1ccc(c2c1cc[nH]2)F 271570a_203496583355_100010006601 [0,1,0,0,1,0|1,0,0]=3 1175 B12R2.221 Oc1ccc(c2c1cco2)F 271570a_203496583355_100010248603 [0,1,0,0,1,0|1,0,0]=3 1176 B12R2.221 Oc1ccc(c2c1cco2)O 271570a_203496583355_200020711608 [0,1,0,0,1,0|1,0,0]=3 1177 B12R2.221 Oc1ccc(c2c1cn[nH]2)F 271570a_203496583355_100010074603 [0,1,0,0,1,0|2,0,0]=4 1178 B12R2.221 Oc1ccc(c2c1occ2)F 271570a_203496583355_100012355473 [0,1,0,0,1,0|1,0,0]=3 1179 B12R2.221 Oc1ccc(n2c1ncc2)Cl 271570a_203496583355_100010184985 [0,1,0,0,1,0|1,0,0]=3 1180 B12R2.221 Oc1cnc(n2c1ncc2)Cl 271570a_203496583355_102125931470 [0,1,0,0,1,0|2,0,0]=4 1181 B12R2.221 Oc1ncc(c2c1nc[nH]2)F 271570a_203496583355_100009853726 [0,1,0,0,1,0|2,0,0]=4 1182 B12R2.246 Cc1cc(c2[nH]cnc2c1)O 271570a_203496583355_100010107307 [0,1,0,0,1,0|1,0,1]=4 1183 B12R2.246 Cc1cc(c2[nH]ncc2c1)O 271570a_203496583355_100009816732 [0,1,0,0,1,0|1,0,1]=4 1184 B12R2.246 Cc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100010186026 [0,1,0,0,1,0|1,0,0]=3 1185 B12R2.246 Cc1cc(c2cc[nH]c2n1)O 271570a_203496583355_100000095047 [0,1,0,0,1,0|2,0,0]=4 1186 B12R2.246 Cc1cc(c2cn[nH]c2c1)O 271570a_203496583355_100009816876 [0,1,0,0,1,0|2,0,0]=4 1187 B12R2.246 Cc1cc(c2nccn2c1)O 271570a_203496583355_100025775375 [0,1,0,0,1,0|1,0,0]=3 1188 B12R2.246 Cc1cc(c2ncnn2c1)O 271570a_203496583355_100009817174 [0,1,0,0,1,0|2,0,0]=4 1189 B12R2.246 Cc1cc(c2occc2c1)O 271570a_203496583355_100012361857 [0,1,0,0,1,0|1,0,0]=3 1190 B12R2.246 Cc1cc(cc2c1[nH]cc2)O 271570a_203496583355_100009817142 [0,1,0,0,1,0|1,0,1]=4 1191 B12R2.246 Cc1cc(cc2c1nc[nH]2)O 271570a_203496583355_100000239325 [0,1,0,0,1,0|2,0,0]=4 1192 B12R2.246 Cc1cc(cc2c1occ2)O 271570a_203496583355_100012361858 [0,1,0,0,1,0|2,0,0]=4 1193 B12R2.246 Cc1cc(cn2c1ncc2)O 271570a_203496583355_100000701042 [0,1,0,0,1,0|2,0,0]=4 1194 B12R2.246 Nc1cc(c2[nH]ncc2c1)O 271570a_203496583355_100010188536 [0,1,0,0,1,0|1,0,1]=4 1195 B12R2.246 Nc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100010006569 [0,1,0,0,1,0|1,0,0]=3 1196 B12R2.246 Nc1cc(c2cc[nH]c2n1)O 271570a_203496583355_100009864914 [0,1,0,0,1,0|2,0,0]=4 1197 B12R2.246 Nc1cc(c2cn[nH]c2c1)O 271570a_203496583355_100010185947 [0,1,0,0,1,0|2,0,0]=4 1198 B12R2.246 Nc1cc(c2scnc2c1)O 271570a_203496583355_200010333430 [0,1,0,0,1,0|2,0,0]=4 1199 B12R2.246 Nc1cc(cc2c1[nH]cc2)O 271570a_203496583355_100009813507 [0,1,0,0,1,0|1,0,1]=4 1200 B12R2.246 Nc1cc(cc2c1cc[nH]2)O 271570a_203496583355_106744500199 [0,1,0,0,1,0|2,0,0]=4 1201 B12R2.246 Nc1cc(cn2c1ncc2)O 271570a_203496583355_100009816852 [0,1,0,0,1,0|2,0,0]=4 1202 B12R2.246 Oc1cc(c2[nH]ccc2c1)F 271570a_203496583355_100010138380 [0,1,0,0,1,0|1,0,1]=4 1203 B12R2.246 Oc1cc(c2[nH]ncc2c1)O 271570a_203496583355_100015619115 [0,1,0,0,1,0|1,0,1]=4 1204 B12R2.246 Oc1cc(c2cc[nH]c2c1)Br 271570a_203496583355_100009814775 [0,1,0,0,1,0|2,0,0]=4 1205 B12R2.246 Oc1cc(c2cc[nH]c2c1)F 271570a_203496583355_100010186028 [0,1,0,0,1,0|2,0,0]=4 1206 B12R2.246 Oc1cc(c2cn[nH]c2c1)O 271570a_203496583355_100010185960 [0,1,0,0,1,0|2,0,0]=4 1207 B12R2.246 Oc1cc(c2nccn2c1)F 271570a_203496583355_100010174814 [0,1,0,0,1,0|2,0,0]=4 1208 B12R2.246 Oc1cc(c2nccn2c1)O 271570a_203496583355_100010074634 [0,1,0,0,1,0|1,0,0]=3 1209 B12R2.246 Oc1cc(c2occc2c1)F 271570a_203496583355_100012355474 [0,1,0,0,1,0|2,0,0]=4 1210 B12R2.246 Oc1cc(c2occc2c1)O 271570a_203496583355_200010248604 [0,1,0,0,1,0|1,0,0]=3 1211 B12R2.246 Oc1cc(cc2c1[nH]cc2)F 271570a_203496583355_100010138379 [0,1,0,0,1,0|0,0,1]=3 1212 B12R2.246 Oc1cc(cc2c1[nH]nc2)Br 271570a_203496583355_100000729393 [0,1,0,0,1,0|1,0,1]=4 1213 B12R2.246 Oc1cc(cc2c1cc[nH]2)Br 271570a_203496583355_100009814761 [0,1,0,0,1,0|1,0,0]=3 1214 B12R2.246 Oc1cc(cc2c1cc[nH]2)F 271570a_203496583355_100010188273 [0,1,0,0,1,0|1,0,0]=3 1215 B12R2.246 Oc1cc(cc2c1cn[nH]2)Br 271570a_203496583355_100009814777 [0,1,0,0,1,0|2,0,0]=4 1216 B12R2.246 Oc1cc(cc2c1cn[nH]2)Cl 271570a_203496583355_100000050163 [0,1,0,0,1,0|2,0,0]=4 1217 B12R2.246 Oc1cc(cc2c1cn[nH]2)F 271570a_203496583355_100010185992 [0,1,0,0,1,0|2,0,0]=4 1218 B12R2.246 Oc1cc(cc2c1nc[nH]2)F 271570a_203496583355_100010192642 [0,1,0,0,1,0|1,0,0]=3 1219 B12R2.246 Oc1cc(cc2c1nco2)F 271570a_203496583355_100016120941 [0,1,0,0,1,0|1,0,0]=3 1220 B12R2.246 Oc1cc(cc2c1occ2)F 271570a_203496583355_100011935139 [0,1,0,0,1,0|1,0,0]=3 1221 B12R2.246 Oc1cc(cn2c1ncc2)Br 271570a_203496583355_100000687079 [0,1,0,0,1,0|1,0,0]=3 1222 B12R2.246 Oc1cc(cn2c1ncc2)Cl 271570a_203496583355_100010232167 [0,1,0,0,1,0|1,0,0]=3 1223 B12R2.246 Oc1cc(cn2c1ncc2)F 271570a_203496583355_100010289905 [0,1,0,0,1,0|1,0,0]=3 1224 B12R2.246 Oc1cc(cn2c1ncn2)Cl 271570a_203496583355_100011099881 [0,1,0,0,1,0|2,0,0]=4 1225 B12R2.315 C=Cc1cccc2c1CC=C2 271570a_100011290941_100009844718 [0,1,0,0,1,0|1,0,1]=4 1226 B12R2.315 C=Cc1cccc2c1[nH]cc2 271570a_100011290941_100009813418 [0,1,0,0,1,0|1,0,1]=4 1227 B12R2.315 C=Cc1cccc2c1cc[nH]2 271570a_100011290941_100000685724 [0,1,0,0,1,0|2,0,0]=4 1228 B12R2.315 C=Cc1cccc2c1cco2 271570a_100011290941_100000756496 [0,1,0,0,1,0|2,0,0]=4 1229 B12R2.315 C=Cc1cccc2c1ccs2 271570a_100011290941_100009816950 [0,1,0,0,1,0|2,0,0]=4 1230 B12R2.315 C=Cc1cccc2c1nc[nH]2 271570a_100011290941_100011935113 [0,1,0,0,1,0|2,0,0]=4 1231 B12R2.315 C=Cc1cccc2c1nco2 271570a_100011290941_100009816834 [0,1,0,0,1,0|2,0,0]=4 1232 B12R2.315 C=Cc1cccc2c1ncs2 271570a_100011290941_100000726125 [0,1,0,0,1,0|2,0,0]=4 1233 B12R2.315 C=Cc1cccc2c1occ2 271570a_100011290941_100011935138 [0,1,0,0,1,0|2,0,0]=4 1234 B12R2.315 C=Cc1cccc2c1scc2 271570a_100011290941_100000766737 [0,1,0,0,1,0|2,0,0]=4 1235 B12R2.315 C=Cc1cccc2n1ncc2 271570a_100011290941_100009817731 [0,1,0,0,1,0|2,0,0]=4 1236 B12R2.315 C=Cc1cccn2c1ncc2 271570a_100011290941_100011934911 [0,1,0,0,1,0|2,0,0]=4 1237 B12R2.315 CNc1cccc2c1ccs2 34a_100020628958_200000210301 [0,1,0,0,1,0|2,0,0]=4 1238 B12R2.315 CNc1cccc2c1nco2 34a_100000717946_200000210301 [0,1,0,0,1,0|2,0,0]=4 1239 B12R2.315 COc1cccc2c1cc[nH]2 34a_100000763377_200000210301 [0,1,0,0,1,0|1,0,0]=3 1240 B12R2.315 COc1cccc2c1ccs2 34a_100000077759_200000210301 [0,1,0,0,1,0|1,0,0]=3 1241 B12R2.315 COc1cccc2c1ccs2 7a_100000077759_200000210301 [0,1,0,0,1,0|1,0,0]=3 1242 B12R2.315 COc1cccc2c1ncs2 34a_100000101385_200000210301 [0,1,0,0,1,0|1,0,0]=3 1243 B12R2.315 COc1cccc2c1ncs2 7a_100000101385_200000210301 [0,1,0,0,1,0|1,0,0]=3 1244 B12R2.315 COc1cccn2c1ncc2 34a_100000068405_200000210301 [0,1,0,0,1,0|1,0,0]=3 1245 B12R2.315 COc1cccn2c1ncc2 7a_100000068405_200000210301 [0,1,0,0,1,0|1,0,0]=3 1246 B12R2.315 COc1ccnc2c1scc2 34a_100000759877_200000210301 [0,1,0,0,1,0|2,0,0]=4 1247 B12R2.315 CSc1cccc2c1CC=C2 62a_100009844718_200000210301 [0,1,0,0,1,0|0,1,1]=4 1248 B12R2.315 CSc1cccc2c1CC=C2 62a_200000210301_100009844718 [0,1,0,0,1,0|0,1,1]=4 1249 B12R2.315 CSc1cccc2c1[nH]cc2 62a_200000210301_100009813418 [0,1,0,0,1,0|0,1,1]=4 1250 B12R2.315 CSc1cccc2c1cc[nH]2 62a_200000210301_100000685724 [0,1,0,0,1,0|1,1,0]=4 1251 B12R2.315 CSc1cccc2c1cco2 62a_200000210301_100000756496 [0,1,0,0,1,0|1,1,0]=4 1252 B12R2.315 CSc1cccc2c1ccs2 62a_200000210301_100009816950 [0,1,0,0,1,0|1,1,0]=4 1253 B12R2.315 CSc1cccc2c1nc[nH]2 62a_200000210301_100011935113 [0,1,0,0,1,0|1,1,0]=4 1254 B12R2.315 CSc1cccc2c1nco2 62a_200000210301_100009816834 [0,1,0,0,1,0|1,1,0]=4 1255 B12R2.315 CSc1cccc2c1ncs2 62a_200000210301_100000726125 [0,1,0,0,1,0|1,1,0]=4 1256 B12R2.315 CSc1cccc2c1occ2 62a_200000210301_100011935138 [0,1,0,0,1,0|1,1,0]=4 1257 B12R2.315 CSc1cccc2c1scc2 62a_200000210301_100000766737 [0,1,0,0,1,0|1,1,0]=4 1258 B12R2.315 CSc1cccc2n1ncc2 62a_200000210301_100009817731 [0,1,0,0,1,0|1,1,0]=4 1259 B12R2.315 CSc1cccn2c1ncc2 62a_200000210301_100011934911 [0,1,0,0,1,0|1,1,0]=4 1260 B12R2.315 [13CH3]Nc1cccc2c1ccs2 34a_100020628958_200025704644 [0,1,0,0,1,0|2,0,0]=4 1261 B12R2.315 [13CH3]Nc1cccc2c1nco2 34a_100000717946_200025704644 [0,1,0,0,1,0|2,0,0]=4 1262 B12R2.315 [13CH3]Oc1cccc2c1cc[nH]2 34a_100000763377_200025704644 [0,1,0,0,1,0|1,0,0]=3 1263 B12R2.315 [13CH3]Oc1cccc2c1ccs2 34a_100000077759_200025704644 [0,1,0,0,1,0|1,0,0]=3 1264 B12R2.315 [13CH3]Oc1cccc2c1ccs2 7a_100000077759_200025704644 [0,1,0,0,1,0|1,0,0]=3 1265 B12R2.315 [13CH3]Oc1cccc2c1ncs2 34a_100000101385_200025704644 [0,1,0,0,1,0|1,0,0]=3 1266 B12R2.315 [13CH3]Oc1cccc2c1ncs2 7a_100000101385_200025704644 [0,1,0,0,1,0|1,0,0]=3 1267 B12R2.315 [13CH3]Oc1cccn2c1ncc2 34a_100000068405_200025704644 [0,1,0,0,1,0|1,0,0]=3 1268 B12R2.315 [13CH3]Oc1cccn2c1ncc2 7a_100000068405_200025704644 [0,1,0,0,1,0|1,0,0]=3 1269 B12R2.315 [13CH3]Oc1ccnc2c1scc2 34a_100000759877_200025704644 [0,1,0,0,1,0|2,0,0]=4 1270 B12R2.315 [13CH3]Sc1cccc2c1CC=C2 62a_100009844718_200025704644 [0,1,0,0,1,0|0,1,1]=4 1271 B12R2.315 [13CH3]Sc1cccc2c1CC=C2 62a_200025704644_100009844718 [0,1,0,0,1,0|0,1,1]=4 1272 B12R2.315 [13CH3]Sc1cccc2c1[nH]cc2 62a_200025704644_100009813418 [0,1,0,0,1,0|0,1,1]=4 1273 B12R2.315 [13CH3]Sc1cccc2c1cc[nH]2 62a_200025704644_100000685724 [0,1,0,0,1,0|1,1,0]=4 1274 B12R2.315 [13CH3]Sc1cccc2c1cco2 62a_200025704644_100000756496 [0,1,0,0,1,0|1,1,0]=4 1275 B12R2.315 [13CH3]Sc1cccc2c1ccs2 62a_200025704644_100009816950 [0,1,0,0,1,0|1,1,0]=4 1276 B12R2.315 [13CH3]Sc1cccc2c1nc[nH]2 62a_200025704644_100011935113 [0,1,0,0,1,0|1,1,0]=4 1277 B12R2.315 [13CH3]Sc1cccc2c1nco2 62a_200025704644_100009816834 [0,1,0,0,1,0|1,1,0]=4 1278 B12R2.315 [13CH3]Sc1cccc2c1ncs2 62a_200025704644_100000726125 [0,1,0,0,1,0|1,1,0]=4 1279 B12R2.315 [13CH3]Sc1cccc2c1occ2 62a_200025704644_100011935138 [0,1,0,0,1,0|1,1,0]=4 1280 B12R2.315 [13CH3]Sc1cccc2c1scc2 62a_200025704644_100000766737 [0,1,0,0,1,0|1,1,0]=4 1281 B12R2.315 [13CH3]Sc1cccc2n1ncc2 62a_200025704644_100009817731 [0,1,0,0,1,0|1,1,0]=4 1282 B12R2.315 [13CH3]Sc1cccn2c1ncc2 62a_200025704644_100011934911 [0,1,0,0,1,0|1,1,0]=4 1283 B14R2.92 C=Cc1ccc2ccccc2c1Br 271570a_100011290941_200010089984 [0,2,0,0,0,0|2,0,0]=4 1284 B14R2.92 C=Cc1ccc2ccccc2c1C 271570a_100011290941_100010221197 [0,2,0,0,0,0|2,0,0]=4 1285 B14R2.92 C=Cc1ccc2ccccc2c1F 271570a_100011290941_100009832041 [0,2,0,0,0,0|2,0,0]=4 1286 B14R2.92 C=Cc1ccc2ccccc2c1N 271570a_100011290941_100009817101 [0,2,0,0,0,0|2,0,0]=4 1287 B14R2.92 C=Cc1ccc2ccccc2c1O 271570a_100011290941_100009996032 [0,2,0,0,0,0|1,0,0]=3 1288 B14R2.92 C=Cc1ccc2cccnc2c1C 271570a_100011290941_100010214467 [0,2,0,0,0,0|1,0,0]=3 1289 B14R2.92 C=Cc1ccc2cccnc2c1F 271570a_100011290941_100010751467 [0,2,0,0,0,0|1,0,0]=3 1290 B14R2.92 C=Cc1ccc2cccnc2c1O 271570a_100011290941_100009816563 [0,2,0,0,0,0|0,0,0]=2 1291 B14R2.92 C=Cc1ccc2nccnc2c1C 271570a_100011290941_100135414757 [0,2,0,0,0,0|2,0,0]=4 1292 B14R2.92 CNc1ccc2ccccc2c1Br 34a_100000705303_200000210301 [0,2,0,0,0,0|2,0,0]=4 1293 B14R2.92 CNc1ccc2ccccc2c1Cl 34a_100000075557_200000210301 [0,2,0,0,0,0|2,0,0]=4 1294 B14R2.92 CNc1ccc2ccccc2c1O 34a_100000007060_200000210301 [0,2,0,0,0,0|1,0,0]=3 1295 B14R2.92 CNc1ccc2nccnc2c1C 27a_100102657272_100135414757 [0,2,0,0,0,0|2,0,0]=4 1296 B14R2.92 COc1ccc2ccccc2c1Br 34a_100000183829_200000210301 [0,2,0,0,0,0|2,0,0]=4 1297 B14R2.92 COc1ccc2ccccc2c1Br 7a_100000183829_200000210301 [0,2,0,0,0,0|2,0,0]=4 1298 B14R2.92 COc1ccc2ccccc2c1C 34a_100009830054_200000210301 [0,2,0,0,0,0|2,0,0]=4 1299 B14R2.92 COc1ccc2ccccc2c1C 7a_100009830054_200000210301 [0,2,0,0,0,0|2,0,0]=4 1300 B14R2.92 COc1ccc2ccccc2c1Cl 34a_100000029778_200000210301 [0,2,0,0,0,0|2,0,0]=4 1301 B14R2.92 COc1ccc2ccccc2c1Cl 7a_100000029778_200000210301 [0,2,0,0,0,0|2,0,0]=4 1302 B14R2.92 COc1ccc2ccccc2c1I 34a_100000041551_200000210301 [0,2,0,0,0,0|2,0,0]=4 1303 B14R2.92 COc1ccc2ccccc2c1I 7a_100000041551_200000210301 [0,2,0,0,0,0|2,0,0]=4 1304 B14R2.92 COc1ccc2ccccc2c1N 34a_100000007056_200000210301 [0,2,0,0,0,0|2,0,0]=4 1305 B14R2.92 COc1ccc2ccccc2c1N 7a_100000007056_200000210301 [0,2,0,0,0,0|2,0,0]=4 1306 B14R2.92 COc1ccc2ccccc2c1O 271570a_203496583355_100000173347 [0,2,0,0,0,0|1,0,0]=3 1307 B14R2.92 COc1ccc2cccnc2c1Br 34a_100010173343_200000210301 [0,2,0,0,0,0|1,0,0]=3 1308 B14R2.92 COc1ccc2cccnc2c1Br 7a_100010173343_200000210301 [0,2,0,0,0,0|1,0,0]=3 1309 B14R2.92 COc1ccc2cccnc2c1O 271570a_203496583355_100010071576 [0,2,0,0,0,0|0,0,0]=2 1310 B14R2.92 CSc1ccc2ccccc2c1Br 62a_200000210301_200010089984 [0,2,0,0,0,0|2,0,0]=4 1311 B14R2.92 CSc1ccc2ccccc2c1Br 62a_200010089984_200000210301 [0,2,0,0,0,0|2,0,0]=4 1312 B14R2.92 CSc1ccc2ccccc2c1C 62a_100010221197_200000210301 [0,2,0,0,0,0|2,0,0]=4 1313 B14R2.92 CSc1ccc2ccccc2c1C 62a_200000210301_100010221197 [0,2,0,0,0,0|2,0,0]=4 1314 B14R2.92 CSc1ccc2ccccc2c1F 62a_100009832041_200000210301 [0,2,0,0,0,0|2,0,0]=4 1315 B14R2.92 CSc1ccc2ccccc2c1F 62a_200000210301_100009832041 [0,2,0,0,0,0|2,0,0]=4 1316 B14R2.92 CSc1ccc2ccccc2c1N 62a_100009817101_200000210301 [0,2,0,0,0,0|2,0,0]=4 1317 B14R2.92 CSc1ccc2ccccc2c1O 62a_200000210301_100009996032 [0,2,0,0,0,0|1,0,0]=3 1318 B14R2.92 CSc1ccc2cccnc2c1C 62a_200000210301_100010214467 [0,2,0,0,0,0|1,0,0]=3 1319 B14R2.92 CSc1ccc2cccnc2c1F 62a_100010751467_200000210301 [0,2,0,0,0,0|1,0,0]=3 1320 B14R2.92 CSc1ccc2cccnc2c1F 62a_200000210301_100010751467 [0,2,0,0,0,0|1,0,0]=3 1321 B14R2.92 CSc1ccc2cccnc2c1O 62a_200000210301_100009816563 [0,2,0,0,0,0|0,0,0]=2 1322 B14R2.92 CSc1ccc2nccnc2c1C 62a_100135414757_200000210301 [0,2,0,0,0,0|2,0,0]=4 1323 B14R2.92 CSc1ccc2nccnc2c1C 62a_200000210301_100135414757 [0,2,0,0,0,0|2,0,0]=4 1324 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 34a_100009830054_200025704644 [0,2,0,0,0,0|2,0,0]=4 1325 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 7a_100009830054_200025704644 [0,2,0,0,0,0|2,0,0]=4 1326 B14R2.92 Cc1c(ccc2c1cccc2)S[13CH3] 62a_100010221197_200025704644 [0,2,0,0,0,0|2,0,0]=4 1327 B14R2.92 Cc1c(ccc2c1cccc2)S[13CH3] 62a_200025704644_100010221197 [0,2,0,0,0,0|2,0,0]=4 1328 B14R2.92 Cc1c(ccc2c1nccc2)S[13CH3] 62a_200025704644_100010214467 [0,2,0,0,0,0|1,0,0]=3 1329 B14R2.92 Cc1c(ccc2c1nccn2)S[13CH3] 62a_100135414757_200025704644 [0,2,0,0,0,0|2,0,0]=4 1330 B14R2.92 Cc1c(ccc2c1nccn2)S[13CH3] 62a_200025704644_100135414757 [0,2,0,0,0,0|2,0,0]=4 1331 B14R2.92 N#Cc1cnc2ccccc2c1O 271570a_203496583355_100000741524 [0,2,0,0,0,0|2,0,0]=4 1332 B14R2.92 O=Cc1ccc2ccccc2c1O 271570a_203496583355_100009813496 [0,2,0,0,0,0|1,0,0]=3 1333 B14R2.92 [13CH3]Nc1ccc2ccccc2c1Br 34a_100000705303_200025704644 [0,2,0,0,0,0|2,0,0]=4 1334 B14R2.92 [13CH3]Nc1ccc2ccccc2c1Cl 34a_100000075557_200025704644 [0,2,0,0,0,0|2,0,0]=4 1335 B14R2.92 [13CH3]Nc1ccc2ccccc2c1O 34a_100000007060_200025704644 [0,2,0,0,0,0|1,0,0]=3 1336 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Br 34a_100000183829_200025704644 [0,2,0,0,0,0|2,0,0]=4 1337 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Br 7a_100000183829_200025704644 [0,2,0,0,0,0|2,0,0]=4 1338 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Cl 34a_100000029778_200025704644 [0,2,0,0,0,0|2,0,0]=4 1339 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Cl 7a_100000029778_200025704644 [0,2,0,0,0,0|2,0,0]=4 1340 B14R2.92 [13CH3]Oc1ccc2ccccc2c1I 34a_100000041551_200025704644 [0,2,0,0,0,0|2,0,0]=4 1341 B14R2.92 [13CH3]Oc1ccc2ccccc2c1I 7a_100000041551_200025704644 [0,2,0,0,0,0|2,0,0]=4 1342 B14R2.92 [13CH3]Oc1ccc2ccccc2c1N 34a_100000007056_200025704644 [0,2,0,0,0,0|2,0,0]=4 1343 B14R2.92 [13CH3]Oc1ccc2ccccc2c1N 7a_100000007056_200025704644 [0,2,0,0,0,0|2,0,0]=4 1344 B14R2.92 [13CH3]Oc1ccc2cccnc2c1Br 34a_100010173343_200025704644 [0,2,0,0,0,0|1,0,0]=3 1345 B14R2.92 [13CH3]Oc1ccc2cccnc2c1Br 7a_100010173343_200025704644 [0,2,0,0,0,0|1,0,0]=3 1346 B14R2.92 [13CH3]Sc1ccc2ccccc2c1Br 62a_200010089984_200025704644 [0,2,0,0,0,0|2,0,0]=4 1347 B14R2.92 [13CH3]Sc1ccc2ccccc2c1Br 62a_200025704644_200010089984 [0,2,0,0,0,0|2,0,0]=4 1348 B14R2.92 [13CH3]Sc1ccc2ccccc2c1F 62a_100009832041_200025704644 [0,2,0,0,0,0|2,0,0]=4 1349 B14R2.92 [13CH3]Sc1ccc2ccccc2c1F 62a_200025704644_100009832041 [0,2,0,0,0,0|2,0,0]=4 1350 B14R2.92 [13CH3]Sc1ccc2ccccc2c1N 62a_100009817101_200025704644 [0,2,0,0,0,0|2,0,0]=4 1351 B14R2.92 [13CH3]Sc1ccc2ccccc2c1O 62a_200025704644_100009996032 [0,2,0,0,0,0|1,0,0]=3 1352 B14R2.92 [13CH3]Sc1ccc2cccnc2c1F 62a_100010751467_200025704644 [0,2,0,0,0,0|1,0,0]=3 1353 B14R2.92 [13CH3]Sc1ccc2cccnc2c1F 62a_200025704644_100010751467 [0,2,0,0,0,0|1,0,0]=3 1354 B14R2.92 [13CH3]Sc1ccc2cccnc2c1O 62a_200025704644_100009816563 [0,2,0,0,0,0|0,0,0]=2 1355 B14R2.203 C=Cc1c(ccc2c1cccc2)Br 271570a_100011290941_100010090040 [0,2,0,0,0,0|2,0,0]=4 1356 B14R2.203 C=Cc1c(ccc2c1cccc2)C 271570a_100011290941_100000759710 [0,2,0,0,0,0|2,0,0]=4 1357 B14R2.203 C=Cc1c(ccc2c1cccc2)N 271570a_100011290941_100000705303 [0,2,0,0,0,0|2,0,0]=4 1358 B14R2.203 C=Cc1c(ccc2c1cccc2)O 271570a_100011290941_100000183829 [0,2,0,0,0,0|2,0,0]=4 1359 B14R2.203 C=Cc1c(ccc2c1nccc2)O 271570a_100011290941_100010173343 [0,2,0,0,0,0|1,0,0]=3 1360 B14R2.203 C=Cc1c(ccc2c1nccn2)N 271570a_100011290941_100000729981 [0,2,0,0,0,0|2,0,0]=4 1361 B14R2.203 C=Cc1c(cnc2c1nccc2)N 271570a_100011290941_100009889961 [0,2,0,0,0,0|2,0,0]=4 1362 B14R2.203 CNc1c(ccc2c1cccc2)Br 34a_100009817101_200000210301 [0,2,0,0,0,0|2,0,0]=4 1363 B14R2.203 CNc1c(ccc2c1cccc2)C 34a_100000688109_200000210301 [0,2,0,0,0,0|2,0,0]=4 1364 B14R2.203 CNc1c(ccc2c1cccc2)Cl 34a_200009860907_200000210301 [0,2,0,0,0,0|2,0,0]=4 1365 B14R2.203 CNc1c(ccc2c1cccc2)O 34a_100000007056_200000210301 [0,2,0,0,0,0|2,0,0]=4 1366 B14R2.203 CNc1c(ccc2c1nccc2)C 34a_100000065890_200000210301 [0,2,0,0,0,0|1,0,0]=3 1367 B14R2.203 CNc1c(ccc2c1nccn2)N 27a_100102657272_100000729981 [0,2,0,0,0,0|2,0,0]=4 1368 B14R2.203 COc1c(ccc2c1cccc2)Br 34a_100009996032_200000210301 [0,2,0,0,0,0|1,0,0]=3 1369 B14R2.203 COc1c(ccc2c1cccc2)Br 7a_100009996032_200000210301 [0,2,0,0,0,0|1,0,0]=3 1370 B14R2.203 COc1c(ccc2c1cccc2)C 34a_100000039261_200000210301 [0,2,0,0,0,0|1,0,0]=3 1371 B14R2.203 COc1c(ccc2c1cccc2)C 7a_100000039261_200000210301 [0,2,0,0,0,0|1,0,0]=3 1372 B14R2.203 COc1c(ccc2c1cccc2)N 34a_100000007060_200000210301 [0,2,0,0,0,0|1,0,0]=3 1373 B14R2.203 COc1c(ccc2c1cccc2)O 271570a_203496583355_100010089960 [0,2,0,0,0,0|1,0,0]=3 1374 B14R2.203 COc1c(ccc2c1nccc2)Br 34a_100009816563_200000210301 [0,2,0,0,0,0|0,0,0]=2 1375 B14R2.203 COc1c(ccc2c1nccc2)Cl 34a_100000700379_200000210301 [0,2,0,0,0,0|0,0,0]=2 1376 B14R2.203 COc1c(ccc2c1nccc2)Cl 7a_100000700379_200000210301 [0,2,0,0,0,0|0,0,0]=2 1377 B14R2.203 COc1c(ccc2c1nccc2)O 271570a_203496583355_100010256708 [0,2,0,0,0,0|0,0,0]=2 1378 B14R2.203 CSc1c(ccc2c1cccc2)Br 62a_100010090040_200000210301 [0,2,0,0,0,0|1,1,0]=4 1379 B14R2.203 CSc1c(ccc2c1cccc2)Br 62a_200000210301_100010090040 [0,2,0,0,0,0|1,1,0]=4 1380 B14R2.203 CSc1c(ccc2c1cccc2)C 62a_100000759710_200000210301 [0,2,0,0,0,0|1,1,0]=4 1381 B14R2.203 CSc1c(ccc2c1cccc2)C 62a_200000210301_100000759710 [0,2,0,0,0,0|1,1,0]=4 1382 B14R2.203 CSc1c(ccc2c1cccc2)N 62a_100000705303_200000210301 [0,2,0,0,0,0|1,1,0]=4 1383 B14R2.203 CSc1c(ccc2c1cccc2)N 62a_200000210301_100000705303 [0,2,0,0,0,0|1,1,0]=4 1384 B14R2.203 CSc1c(ccc2c1cccc2)O 62a_200000210301_100000183829 [0,2,0,0,0,0|1,1,0]=4 1385 B14R2.203 CSc1c(ccc2c1nccc2)O 62a_200000210301_100010173343 [0,2,0,0,0,0|0,1,0]=3 1386 B14R2.203 CSc1c(ccc2c1nccn2)N 62a_100000729981_200000210301 [0,2,0,0,0,0|1,1,0]=4 1387 B14R2.203 CSc1c(ccc2c1nccn2)N 62a_200000210301_100000729981 [0,2,0,0,0,0|1,1,0]=4 1388 B14R2.203 CSc1c(cnc2c1nccc2)N 62a_200000210301_100009889961 [0,2,0,0,0,0|1,1,0]=4 1389 B14R2.203 Cc1ccc2ccccc2c1N[13CH3] 34a_100000688109_200025704644 [0,2,0,0,0,0|2,0,0]=4 1390 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 34a_100000039261_200025704644 [0,2,0,0,0,0|1,0,0]=3 1391 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 7a_100000039261_200025704644 [0,2,0,0,0,0|1,0,0]=3 1392 B14R2.203 Cc1ccc2ccccc2c1S[13CH3] 62a_100000759710_200025704644 [0,2,0,0,0,0|1,1,0]=4 1393 B14R2.203 Cc1ccc2ccccc2c1S[13CH3] 62a_200025704644_100000759710 [0,2,0,0,0,0|1,1,0]=4 1394 B14R2.203 Cc1ccc2cccnc2c1N[13CH3] 34a_100000065890_200025704644 [0,2,0,0,0,0|1,0,0]=3 1395 B14R2.203 O=Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010090029 [0,2,0,0,0,0|1,0,1]=4 1396 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)Br 34a_100009817101_200025704644 [0,2,0,0,0,0|2,0,0]=4 1397 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)Cl 34a_200009860907_200025704644 [0,2,0,0,0,0|2,0,0]=4 1398 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)O 34a_100000007056_200025704644 [0,2,0,0,0,0|2,0,0]=4 1399 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 34a_100009996032_200025704644 [0,2,0,0,0,0|1,0,0]=3 1400 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 7a_100009996032_200025704644 [0,2,0,0,0,0|1,0,0]=3 1401 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)N 34a_100000007060_200025704644 [0,2,0,0,0,0|1,0,0]=3 1402 B14R2.203 [13CH3]Oc1c(ccc2c1nccc2)Br 34a_100009816563_200025704644 [0,2,0,0,0,0|0,0,0]=2 1403 B14R2.203 [13CH3]Oc1c(ccc2c1nccc2)Cl 34a_100000700379_200025704644 [0,2,0,0,0,0|0,0,0]=2 1404 B14R2.203 [13CH3]Oc1c(ccc2c1nccc2)Cl 7a_100000700379_200025704644 [0,2,0,0,0,0|0,0,0]=2 1405 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)Br 62a_100010090040_200025704644 [0,2,0,0,0,0|1,1,0]=4 1406 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)Br 62a_200025704644_100010090040 [0,2,0,0,0,0|1,1,0]=4 1407 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)N 62a_100000705303_200025704644 [0,2,0,0,0,0|1,1,0]=4 1408 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)N 62a_200025704644_100000705303 [0,2,0,0,0,0|1,1,0]=4 1409 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)O 62a_200025704644_100000183829 [0,2,0,0,0,0|1,1,0]=4 1410 B14R2.203 [13CH3]Sc1c(ccc2c1nccc2)O 62a_200025704644_100010173343 [0,2,0,0,0,0|0,1,0]=3 1411 B14R2.203 [13CH3]Sc1c(ccc2c1nccn2)N 62a_100000729981_200025704644 [0,2,0,0,0,0|1,1,0]=4 1412 B14R2.203 [13CH3]Sc1c(ccc2c1nccn2)N 62a_200025704644_100000729981 [0,2,0,0,0,0|1,1,0]=4 1413 B14R2.203 [13CH3]Sc1c(cnc2c1nccc2)N 62a_200025704644_100009889961 [0,2,0,0,0,0|1,1,0]=4 1414 B14R2.7724 Cn1c(=O)cc(c2c1cccc2)O 271570a_203496583355_100000041018 [0,2,0,0,0,0|2,0,0]=4 1415 B14R2.7724 Cn1cc(c2ccccc2c1=O)O 271570a_203496583355_100000239302 [0,2,0,0,0,0|2,0,0]=4 1416 B14R2.7724 Oc1cc(c2cccnc2c1O)Cl 271570a_203496583355_100000211503 [0,2,0,0,0,0|0,0,0]=2 1417 B14R2.7724 Oc1cc(c2ncccc2c1F)F 271570a_203496583355_200009817093 [0,2,0,0,0,0|1,0,0]=3 1418 B14R2.8038 Cc1c(ccc2c1nccc2O)F 271570a_203496583355_100011516163 [0,2,0,0,0,0|1,0,0]=3 1419 B14R2.8038 Cc1ccc2c(ccnc2c1C)O 271570a_203496583355_100011310510 [0,2,0,0,0,0|1,0,0]=3 1420 B14R2.8038 Cc1ccc2c(nccc2c1O)N 271570a_203496583355_100010201667 [0,2,0,0,0,0|2,0,0]=4 1421 B14R2.8038 O=c1c(c[nH]c2c1cccc2F)O 271570a_203496583355_100012351745 [0,2,0,0,0,0|1,0,1]=4 1422 B14R2.8038 O=c1cc[nH]c2c1ccc(c2F)O 271570a_203496583355_100022010583 [0,2,0,0,0,0|1,0,1]=4 1423 B14R2.28523 Cn1ccc2cccc(c2c1=O)O 271570a_203496583355_100010332868 [0,2,0,0,0,0|2,0,0]=4 1424 B14R2.29369 Cc1ccc2c(c(ccc2n1)F)O 271570a_203496583355_100010730238 [0,2,0,0,0,0|2,0,0]=4 1425 B14R2.29369 Cc1ccc2c(c(ccc2n1)O)O 271570a_203496583355_100010269489 [0,2,0,0,0,0|2,0,0]=4 1426 B14R2.29369 O=C1C=Cc2cc(ccc2C1=O)O 271570a_203496583355_100009812793 [0,2,0,0,0,0|1,0,1]=4 1427 B14R2.29369 Oc1ccc2c(c(ccc2c1)O)F 271570a_203496583355_100010730138 [0,2,0,0,0,0|2,0,0]=4 1428 B14R2.142 C=Cc1ccc2cccc(c2c1)C 271570a_100011290941_100010089936 [0,2,0,0,0,0|2,0,0]=4 1429 B14R2.142 C=Cc1ccc2cccc(c2c1)N 271570a_100011290941_100010090012 [0,2,0,0,0,0|2,0,0]=4 1430 B14R2.142 C=Cc1ccc2cccc(c2c1)O 271570a_100011290941_100010089991 [0,2,0,0,0,0|1,0,0]=3 1431 B14R2.142 C=Cc1ccc2cccc(c2n1)C 271570a_100011290941_100012002297 [0,2,0,0,0,0|1,0,0]=3 1432 B14R2.142 C=Cc1ccc2cccc(c2n1)F 271570a_100011290941_100012017632 [0,2,0,0,0,0|1,0,0]=3 1433 B14R2.142 C=Cc1ccc2cccc(c2n1)O 271570a_100011290941_100010153751 [0,2,0,0,0,0|0,0,0]=2 1434 B14R2.142 C=Cc1ccc2ccnc(c2c1)O 271570a_100011290941_100000010956 [0,2,0,0,0,0|2,0,0]=4 1435 B14R2.142 C=Cc1ccc2cncc(c2c1)O 271570a_100011290941_100010136424 [0,2,0,0,0,0|2,0,0]=4 1436 B14R2.142 C=Cc1cnc2cccc(c2c1)O 271570a_100011290941_200010153752 [0,2,0,0,0,0|2,0,0]=4 1437 B14R2.142 C=Cc1ncc2cccc(c2n1)O 271570a_100011290941_100010674811 [0,2,0,0,0,0|1,0,0]=3 1438 B14R2.142 CNc1ccc2cccc(c2c1)O 34a_100132313934_200000210301 [0,2,0,0,0,0|1,0,0]=3 1439 B14R2.142 CNc1ccc2cccc(c2n1)C 27a_100102657272_100012002297 [0,2,0,0,0,0|1,0,0]=3 1440 B14R2.142 CNc1ccc2cccc(c2n1)O 27a_100102657272_100010153751 [0,2,0,0,0,0|0,0,0]=2 1441 B14R2.142 COc1cc2c(cccc2cn1)O 271570a_203496583355_100010126886 [0,2,0,0,0,0|2,0,0]=4 1442 B14R2.142 COc1ccc2cccc(c2c1)Br 34a_100010169565_200000210301 [0,2,0,0,0,0|2,0,0]=4 1443 B14R2.142 COc1ccc2cccc(c2c1)Br 7a_100010169565_200000210301 [0,2,0,0,0,0|2,0,0]=4 1444 B14R2.142 COc1ccc2cccc(c2c1)C 34a_200000091600_200000210301 [0,2,0,0,0,0|2,0,0]=4 1445 B14R2.142 COc1ccc2cccc(c2c1)C 7a_200000091600_200000210301 [0,2,0,0,0,0|2,0,0]=4 1446 B14R2.142 COc1ccc2cccc(c2c1)F 34a_100000091619_200000210301 [0,2,0,0,0,0|2,0,0]=4 1447 B14R2.142 COc1ccc2cccc(c2c1)F 7a_100000091619_200000210301 [0,2,0,0,0,0|2,0,0]=4 1448 B14R2.142 COc1ccc2cccc(c2c1)N 34a_100000034012_200000210301 [0,2,0,0,0,0|2,0,0]=4 1449 B14R2.142 COc1ccc2cccc(c2c1)N 7a_100000034012_200000210301 [0,2,0,0,0,0|2,0,0]=4 1450 B14R2.142 COc1ccc2cccc(c2c1)O 271570a_203496583355_100010178974 [0,2,0,0,0,0|1,0,0]=3 1451 B14R2.142 COc1ccc2ccnc(c2c1)O 271570a_203496583355_100012348807 [0,2,0,0,0,0|2,0,0]=4 1452 B14R2.142 COc1ccc2nccc(c2c1)O 271570a_203496583355_100011310462 [0,2,0,0,0,0|2,0,0]=4 1453 B14R2.142 COc1ccc2nccc(c2n1)O 271570a_203496583355_100000090520 [0,2,0,0,0,0|1,0,0]=3 1454 B14R2.142 CSc1ccc2cccc(c2c1)C 62a_200000210301_100010089936 [0,2,0,0,0,0|2,0,0]=4 1455 B14R2.142 CSc1ccc2cccc(c2c1)N 62a_100010090012_200000210301 [0,2,0,0,0,0|2,0,0]=4 1456 B14R2.142 CSc1ccc2cccc(c2c1)N 62a_200000210301_100010090012 [0,2,0,0,0,0|2,0,0]=4 1457 B14R2.142 CSc1ccc2cccc(c2c1)O 62a_200000210301_100010089991 [0,2,0,0,0,0|1,0,0]=3 1458 B14R2.142 CSc1ccc2cccc(c2n1)C 62a_200000210301_100012002297 [0,2,0,0,0,0|1,0,0]=3 1459 B14R2.142 CSc1ccc2cccc(c2n1)F 62a_200000210301_100012017632 [0,2,0,0,0,0|1,0,0]=3 1460 B14R2.142 CSc1ccc2cccc(c2n1)O 62a_200000210301_100000013812 [0,2,0,0,0,0|0,0,0]=2 1461 B14R2.142 CSc1ccc2ccnc(c2c1)O 62a_200000210301_100000010956 [0,2,0,0,0,0|2,0,0]=4 1462 B14R2.142 CSc1ccc2cncc(c2c1)O 62a_200000210301_100010136424 [0,2,0,0,0,0|2,0,0]=4 1463 B14R2.142 CSc1cnc2cccc(c2c1)O 62a_200000210301_200010153752 [0,2,0,0,0,0|2,0,0]=4 1464 B14R2.142 CSc1ncc2cccc(c2n1)O 62a_200000210301_100010674811 [0,2,0,0,0,0|1,0,0]=3 1465 B14R2.142 Cc1cccc2c1cc(cc2)O[13CH3] 34a_200000091600_200025704644 [0,2,0,0,0,0|2,0,0]=4 1466 B14R2.142 Cc1cccc2c1cc(cc2)O[13CH3] 7a_200000091600_200025704644 [0,2,0,0,0,0|2,0,0]=4 1467 B14R2.142 Cc1cccc2c1cc(cc2)S[13CH3] 62a_200025704644_100010089936 [0,2,0,0,0,0|2,0,0]=4 1468 B14R2.142 Cc1cccc2c1nc(cc2)S[13CH3] 62a_200025704644_100012002297 [0,2,0,0,0,0|1,0,0]=3 1469 B14R2.142 N#Cc1ccc2nccc(c2c1)O 271570a_203496583355_100010204249 [0,2,0,0,0,0|2,0,0]=4 1470 B14R2.142 O=Cc1ccc2ccnc(c2c1)O 271570a_203496583355_100000094387 [0,2,0,0,0,0|2,0,0]=4 1471 B14R2.142 [13CH3]Nc1ccc2cccc(c2c1)O 34a_100132313934_200025704644 [0,2,0,0,0,0|1,0,0]=3 1472 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)Br 34a_100010169565_200025704644 [0,2,0,0,0,0|2,0,0]=4 1473 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)Br 7a_100010169565_200025704644 [0,2,0,0,0,0|2,0,0]=4 1474 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)F 34a_100000091619_200025704644 [0,2,0,0,0,0|2,0,0]=4 1475 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)F 7a_100000091619_200025704644 [0,2,0,0,0,0|2,0,0]=4 1476 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)N 34a_100000034012_200025704644 [0,2,0,0,0,0|2,0,0]=4 1477 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)N 7a_100000034012_200025704644 [0,2,0,0,0,0|2,0,0]=4 1478 B14R2.142 [13CH3]Sc1ccc2cccc(c2c1)N 62a_100010090012_200025704644 [0,2,0,0,0,0|2,0,0]=4 1479 B14R2.142 [13CH3]Sc1ccc2cccc(c2c1)N 62a_200025704644_100010090012 [0,2,0,0,0,0|2,0,0]=4 1480 B14R2.142 [13CH3]Sc1ccc2cccc(c2c1)O 62a_200025704644_100010089991 [0,2,0,0,0,0|1,0,0]=3 1481 B14R2.142 [13CH3]Sc1ccc2cccc(c2n1)F 62a_200025704644_100012017632 [0,2,0,0,0,0|1,0,0]=3 1482 B14R2.142 [13CH3]Sc1ccc2cccc(c2n1)O 62a_200025704644_100000013812 [0,2,0,0,0,0|0,0,0]=2 1483 B14R2.142 [13CH3]Sc1ccc2ccnc(c2c1)O 62a_200025704644_100000010956 [0,2,0,0,0,0|2,0,0]=4 1484 B14R2.142 [13CH3]Sc1ccc2cncc(c2c1)O 62a_200025704644_100010136424 [0,2,0,0,0,0|2,0,0]=4 1485 B14R2.142 [13CH3]Sc1cnc2cccc(c2c1)O 62a_200025704644_200010153752 [0,2,0,0,0,0|2,0,0]=4 1486 B14R2.142 [13CH3]Sc1ncc2cccc(c2n1)O 62a_200025704644_100010674811 [0,2,0,0,0,0|1,0,0]=3 1487 B14R2.8045 Cc1cc(c2cccc(c2n1)C)O 271570a_203496583355_100000757406 [0,2,0,0,0,0|1,0,0]=3 1488 B14R2.8045 Cc1cc(c2cccc(c2n1)F)O 271570a_203496583355_100000689329 [0,2,0,0,0,0|1,0,0]=3 1489 B14R2.8045 Cc1cc(c2cccc(c2n1)O)O 271570a_203496583355_200011333620 [0,2,0,0,0,0|0,0,0]=2 1490 B14R2.8045 Cc1cc(c2nccc(c2c1)O)C 271570a_203496583355_100011310474 [0,2,0,0,0,0|1,0,0]=3 1491 B14R2.8045 Cc1cc(nc2c1cccc2C)O 271570a_203496583355_100000008058 [0,2,0,0,0,0|1,0,0]=3 1492 B14R2.8045 Nc1nc2c(cccc2c(=O)[nH]1)O 271570a_203496583355_100010142784 [0,2,0,0,0,0|1,0,0]=3 1493 B14R2.8045 O=c1[nH]c(=O)c2cccc(c2[nH]1)O 271570a_203496583355_100012357391 [0,2,0,0,0,0|1,0,1]=4 1494 B14R2.8045 O=c1[nH]c2c(cccc2c(=O)o1)O 271570a_203496583355_100000695655 [0,2,0,0,0,0|1,0,1]=4 1495 B14R2.8045 O=c1cc(c2cccc(c2[nH]1)O)O 271570a_203496583355_200010201894 [0,2,0,0,0,0|0,0,1]=3 1496 B14R2.8045 O=c1cc[nH]c2c1cc(cc2F)O 271570a_203496583355_100000749450 [0,2,0,0,0,0|1,0,1]=4 1497 B14R2.8045 Oc1ccnc2c1cc(cc2F)F 271570a_203496583355_100000751274 [0,2,0,0,0,0|1,0,0]=3 1498 B14R2.8235 Cc1cc(c2cc(ccc2n1)F)O 271570a_203496583355_100000689691 [0,2,0,0,0,0|2,0,0]=4 1499 B14R2.8235 Cc1cc(c2nc(ccc2c1)O)C 271570a_203496583355_200012017542 [0,2,0,0,0,0|1,0,0]=3 1500 B14R2.8235 Cc1ccc2nc(cc(c2c1)O)C 271570a_203496583355_100011333704 [0,2,0,0,0,0|2,0,0]=4 1501 B14R2.8235 O=c1cc(c2cc(ccc2[nH]1)O)O 271570a_203496583355_100000695641 [0,2,0,0,0,0|2,0,0]=4 1502 B14R2.8235 O=c1cc(c2cc(ccc2o1)O)O 271570a_203496583355_100009814091 [0,2,0,0,0,0|2,0,0]=4 1503 B14R2.8235 O=c1ccc2cc(cc(c2[nH]1)F)O 271570a_203496583355_100012034177 [0,2,0,0,0,0|1,0,1]=4 1504 B14R2.8235 O=c1ccc2cc(cc(c2[nH]1)O)Cl 271570a_203496583355_200014262637 [0,2,0,0,0,0|0,0,1]=3 1505 B14R2.8235 O=c1ccc2cc(cc(c2[nH]1)O)F 271570a_203496583355_200012639799 [0,2,0,0,0,0|0,0,1]=3 1506 B14R2.8235 Oc1cc(c2cc(ccc2c1)O)F 271570a_203496583355_100010201084 [0,2,0,0,0,0|2,0,0]=4 1507 B14R2.8751 Cc1ccc2c(ccc(c2n1)N)O 271570a_203496583355_100012970290 [0,2,0,0,0,0|1,0,0]=3 1508 B14R2.8751 O=c1[nH]cc(c2c1ccc(c2)F)O 271570a_203496583355_100010191626 [0,2,0,0,0,0|2,0,0]=4 1509 B14R2.11684 C=Cc1cccc2c1[nH]c(=O)cc2 271570a_100011290941_100000688906 [0,2,0,0,0,0|1,0,1]=4 1510 B14R2.11684 C=Cc1cccc2c1cc(cc2)O 271570a_100011290941_100010169565 [0,2,0,0,0,0|2,0,0]=4 1511 B14R2.11684 C=Cc1cccc2c1nc(cc2)C 271570a_100011290941_100011934484 [0,2,0,0,0,0|1,0,0]=3 1512 B14R2.11684 C=Cc1cccc2c1nc(cc2)N 271570a_100011290941_100000687151 [0,2,0,0,0,0|1,0,0]=3 1513 B14R2.11684 C=Cc1cccc2c1nc(nc2)N 271570a_100011290941_200010988910 [0,2,0,0,0,0|2,0,0]=4 1514 B14R2.11684 C=Cc1ccnc2c1nc(cc2)C 271570a_100011290941_100009889967 [0,2,0,0,0,0|2,0,0]=4 1515 B14R2.11684 C=Cc1ccnc2c1nc(cc2)F 271570a_100011290941_100000719316 [0,2,0,0,0,0|2,0,0]=4 1516 B14R2.11684 C=Cc1cncc2c1nc(cc2)O 271570a_100011290941_100009812673 [0,2,0,0,0,0|2,0,0]=4 1517 B14R2.11684 CNc1cccc2c1cc(cc2)Br 34a_100010090012_200000210301 [0,2,0,0,0,0|2,0,0]=4 1518 B14R2.11684 CNc1cccc2c1cc(cc2)O 34a_100000034012_200000210301 [0,2,0,0,0,0|2,0,0]=4 1519 B14R2.11684 CNc1cccc2c1nc(cc2)C 34a_100000019871_200000210301 [0,2,0,0,0,0|1,0,0]=3 1520 B14R2.11684 CNc1ccnc2c1nc(cc2)C 27a_100102657272_100009889967 [0,2,0,0,0,0|2,0,0]=4 1521 B14R2.11684 CNc1ccnc2c1nc(cc2)F 27a_100102657272_100000719316 [0,2,0,0,0,0|2,0,0]=4 1522 B14R2.11684 COc1cccc2c1cc(cc2)Br 34a_100010089991_200000210301 [0,2,0,0,0,0|1,0,0]=3 1523 B14R2.11684 COc1cccc2c1cc(cc2)Br 7a_100010089991_200000210301 [0,2,0,0,0,0|1,0,0]=3 1524 B14R2.11684 COc1cccc2c1cc(cc2)C 34a_100000040781_200000210301 [0,2,0,0,0,0|1,0,0]=3 1525 B14R2.11684 COc1cccc2c1cc(cc2)C 7a_100000040781_200000210301 [0,2,0,0,0,0|1,0,0]=3 1526 B14R2.11684 COc1cccc2c1cc(cc2)Cl 34a_100009840344_200000210301 [0,2,0,0,0,0|1,0,0]=3 1527 B14R2.11684 COc1cccc2c1cc(cc2)Cl 7a_100009840344_200000210301 [0,2,0,0,0,0|1,0,0]=3 1528 B14R2.11684 COc1cccc2c1cc(cc2)F 34a_100009881884_200000210301 [0,2,0,0,0,0|1,0,0]=3 1529 B14R2.11684 COc1cccc2c1cc(cc2)F 7a_100009881884_200000210301 [0,2,0,0,0,0|1,0,0]=3 1530 B14R2.11684 COc1cccc2c1cc(cc2)N 34a_100132313934_200000210301 [0,2,0,0,0,0|1,0,0]=3 1531 B14R2.11684 COc1cccc2c1cc(cc2)N 7a_100132313934_200000210301 [0,2,0,0,0,0|1,0,0]=3 1532 B14R2.11684 COc1cccc2c1cc(cn2)Br 34a_200010153752_200000210301 [0,2,0,0,0,0|2,0,0]=4 1533 B14R2.11684 COc1cccc2c1cc(cn2)Br 7a_200010153752_200000210301 [0,2,0,0,0,0|2,0,0]=4 1534 B14R2.11684 COc1cccc2c1cc(cn2)N 34a_100009853962_200000210301 [0,2,0,0,0,0|2,0,0]=4 1535 B14R2.11684 COc1cccc2c1nc(cc2)Br 34a_100010153751_200000210301 [0,2,0,0,0,0|0,0,0]=2 1536 B14R2.11684 COc1cccc2c1nc(cc2)Br 7a_100010153751_200000210301 [0,2,0,0,0,0|0,0,0]=2 1537 B14R2.11684 COc1cccc2c1nc(cc2)C 34a_100000184714_200000210301 [0,2,0,0,0,0|0,0,0]=2 1538 B14R2.11684 COc1cccc2c1nc(cc2)C 7a_100000184714_200000210301 [0,2,0,0,0,0|0,0,0]=2 1539 B14R2.11684 COc1cccc2c1nc(cc2)Cl 34a_100000013812_200000210301 [0,2,0,0,0,0|0,0,0]=2 1540 B14R2.11684 COc1cccc2c1nc(cc2)Cl 7a_100000013812_200000210301 [0,2,0,0,0,0|0,0,0]=2 1541 B14R2.11684 COc1cccc2c1nc(cc2)N 34a_100000032106_200000210301 [0,2,0,0,0,0|0,0,0]=2 1542 B14R2.11684 COc1cccc2c1nc(cc2)N 7a_100000032106_200000210301 [0,2,0,0,0,0|0,0,0]=2 1543 B14R2.11684 COc1cccc2c1nc(cc2)O 271570a_203496583355_200011787714 [0,2,0,0,0,0|0,0,0]=2 1544 B14R2.11684 COc1cccc2c1nc(cn2)O 271570a_203496583355_100010783442 [0,2,0,0,0,0|1,0,0]=3 1545 B14R2.11684 COc1cccc2c1nc(nc2)Cl 34a_100010674811_200000210301 [0,2,0,0,0,0|1,0,0]=3 1546 B14R2.11684 COc1cccc2c1nc(nc2)Cl 7a_100010674811_200000210301 [0,2,0,0,0,0|1,0,0]=3 1547 B14R2.11684 COc1cccc2c1nc(nc2)O 271570a_203496583355_200000095598 [0,2,0,0,0,0|1,0,0]=3 1548 B14R2.11684 COc1ccnc2c1cc(cc2)C 34a_200011310529_200000210301 [0,2,0,0,0,0|2,0,0]=4 1549 B14R2.11684 COc1ccnc2c1cc(cc2)F 34a_100000004104_200000210301 [0,2,0,0,0,0|2,0,0]=4 1550 B14R2.11684 COc1ccnc2c1cc(cc2)O 271570a_203496583355_100009816692 [0,2,0,0,0,0|2,0,0]=4 1551 B14R2.11684 COc1cncc2c1cc(cc2)Br 34a_100010136424_200000210301 [0,2,0,0,0,0|2,0,0]=4 1552 B14R2.11684 COc1cncc2c1cc(cc2)Br 7a_100010136424_200000210301 [0,2,0,0,0,0|2,0,0]=4 1553 B14R2.11684 COc1nccc2c1cc(cc2)Br 34a_100000010956_200000210301 [0,2,0,0,0,0|2,0,0]=4 1554 B14R2.11684 COc1nccc2c1cc(cc2)Cl 34a_100000005406_200000210301 [0,2,0,0,0,0|2,0,0]=4 1555 B14R2.11684 COc1nccc2c1cc(cc2)O 271570a_203496583355_200011098638 [0,2,0,0,0,0|2,0,0]=4 1556 B14R2.11684 CSc1cccc2c1[nH]c(=O)cc2 62a_200000210301_100000688906 [0,2,0,0,0,0|0,1,1]=4 1557 B14R2.11684 CSc1cccc2c1cc(cc2)O 62a_200000210301_100010169565 [0,2,0,0,0,0|1,1,0]=4 1558 B14R2.11684 CSc1cccc2c1nc(cc2)C 62a_200000210301_100011934484 [0,2,0,0,0,0|0,1,0]=3 1559 B14R2.11684 CSc1cccc2c1nc(cc2)Cl 62a_200000210301_100012034269 [0,2,0,0,0,0|0,1,0]=3 1560 B14R2.11684 CSc1cccc2c1nc(cc2)N 62a_100000687151_200000210301 [0,2,0,0,0,0|0,1,0]=3 1561 B14R2.11684 CSc1cccc2c1nc(nc2)N 62a_200000210301_200010988910 [0,2,0,0,0,0|1,1,0]=4 1562 B14R2.11684 CSc1cccc2c1nc(nc2)N 62a_200010988910_200000210301 [0,2,0,0,0,0|1,1,0]=4 1563 B14R2.11684 CSc1ccnc2c1nc(cc2)C 62a_200000210301_100009889967 [0,2,0,0,0,0|1,1,0]=4 1564 B14R2.11684 CSc1ccnc2c1nc(cc2)F 62a_100000719316_200000210301 [0,2,0,0,0,0|1,1,0]=4 1565 B14R2.11684 CSc1ccnc2c1nc(cc2)F 62a_200000210301_100000719316 [0,2,0,0,0,0|1,1,0]=4 1566 B14R2.11684 CSc1cncc2c1nc(cc2)O 62a_200000210301_100009812673 [0,2,0,0,0,0|1,1,0]=4 1567 B14R2.11684 Cc1ccc2cccc(c2c1)O[13CH3] 34a_100000040781_200025704644 [0,2,0,0,0,0|1,0,0]=3 1568 B14R2.11684 Cc1ccc2cccc(c2c1)O[13CH3] 7a_100000040781_200025704644 [0,2,0,0,0,0|1,0,0]=3 1569 B14R2.11684 Cc1ccc2cccc(c2n1)N[13CH3] 34a_100000019871_200025704644 [0,2,0,0,0,0|1,0,0]=3 1570 B14R2.11684 Cc1ccc2cccc(c2n1)O[13CH3] 34a_100000184714_200025704644 [0,2,0,0,0,0|0,0,0]=2 1571 B14R2.11684 Cc1ccc2cccc(c2n1)O[13CH3] 7a_100000184714_200025704644 [0,2,0,0,0,0|0,0,0]=2 1572 B14R2.11684 Cc1ccc2cccc(c2n1)S[13CH3] 62a_200025704644_100011934484 [0,2,0,0,0,0|0,1,0]=3 1573 B14R2.11684 Cc1ccc2nccc(c2c1)O[13CH3] 34a_200011310529_200025704644 [0,2,0,0,0,0|2,0,0]=4 1574 B14R2.11684 Cc1ccc2nccc(c2n1)S[13CH3] 62a_200025704644_100009889967 [0,2,0,0,0,0|1,1,0]=4 1575 B14R2.11684 [13CH3]Nc1cccc2c1cc(cc2)Br 34a_100010090012_200025704644 [0,2,0,0,0,0|2,0,0]=4 1576 B14R2.11684 [13CH3]Nc1cccc2c1cc(cc2)O 34a_100000034012_200025704644 [0,2,0,0,0,0|2,0,0]=4 1577 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Br 34a_100010089991_200025704644 [0,2,0,0,0,0|1,0,0]=3 1578 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Br 7a_100010089991_200025704644 [0,2,0,0,0,0|1,0,0]=3 1579 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Cl 34a_100009840344_200025704644 [0,2,0,0,0,0|1,0,0]=3 1580 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Cl 7a_100009840344_200025704644 [0,2,0,0,0,0|1,0,0]=3 1581 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)F 34a_100009881884_200025704644 [0,2,0,0,0,0|1,0,0]=3 1582 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)F 7a_100009881884_200025704644 [0,2,0,0,0,0|1,0,0]=3 1583 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)N 34a_100132313934_200025704644 [0,2,0,0,0,0|1,0,0]=3 1584 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)N 7a_100132313934_200025704644 [0,2,0,0,0,0|1,0,0]=3 1585 B14R2.11684 [13CH3]Oc1cccc2c1cc(cn2)Br 34a_200010153752_200025704644 [0,2,0,0,0,0|2,0,0]=4 1586 B14R2.11684 [13CH3]Oc1cccc2c1cc(cn2)Br 7a_200010153752_200025704644 [0,2,0,0,0,0|2,0,0]=4 1587 B14R2.11684 [13CH3]Oc1cccc2c1cc(cn2)N 34a_100009853962_200025704644 [0,2,0,0,0,0|2,0,0]=4 1588 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Br 34a_100010153751_200025704644 [0,2,0,0,0,0|0,0,0]=2 1589 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Br 7a_100010153751_200025704644 [0,2,0,0,0,0|0,0,0]=2 1590 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Cl 34a_100000013812_200025704644 [0,2,0,0,0,0|0,0,0]=2 1591 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Cl 7a_100000013812_200025704644 [0,2,0,0,0,0|0,0,0]=2 1592 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)N 34a_100000032106_200025704644 [0,2,0,0,0,0|0,0,0]=2 1593 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)N 7a_100000032106_200025704644 [0,2,0,0,0,0|0,0,0]=2 1594 B14R2.11684 [13CH3]Oc1cccc2c1nc(nc2)Cl 34a_100010674811_200025704644 [0,2,0,0,0,0|1,0,0]=3 1595 B14R2.11684 [13CH3]Oc1cccc2c1nc(nc2)Cl 7a_100010674811_200025704644 [0,2,0,0,0,0|1,0,0]=3 1596 B14R2.11684 [13CH3]Oc1ccnc2c1cc(cc2)F 34a_100000004104_200025704644 [0,2,0,0,0,0|2,0,0]=4 1597 B14R2.11684 [13CH3]Oc1cncc2c1cc(cc2)Br 34a_100010136424_200025704644 [0,2,0,0,0,0|2,0,0]=4 1598 B14R2.11684 [13CH3]Oc1cncc2c1cc(cc2)Br 7a_100010136424_200025704644 [0,2,0,0,0,0|2,0,0]=4 1599 B14R2.11684 [13CH3]Oc1nccc2c1cc(cc2)Br 34a_100000010956_200025704644 [0,2,0,0,0,0|2,0,0]=4 1600 B14R2.11684 [13CH3]Oc1nccc2c1cc(cc2)Cl 34a_100000005406_200025704644 [0,2,0,0,0,0|2,0,0]=4 1601 B14R2.11684 [13CH3]Sc1cccc2c1[nH]c(=O)cc2 62a_200025704644_100000688906 [0,2,0,0,0,0|0,1,1]=4 1602 B14R2.11684 [13CH3]Sc1cccc2c1cc(cc2)O 62a_200025704644_100010169565 [0,2,0,0,0,0|1,1,0]=4 1603 B14R2.11684 [13CH3]Sc1cccc2c1nc(cc2)Cl 62a_200025704644_100012034269 [0,2,0,0,0,0|0,1,0]=3 1604 B14R2.11684 [13CH3]Sc1cccc2c1nc(cc2)N 62a_100000687151_200025704644 [0,2,0,0,0,0|0,1,0]=3 1605 B14R2.11684 [13CH3]Sc1cccc2c1nc(nc2)N 62a_200010988910_200025704644 [0,2,0,0,0,0|1,1,0]=4 1606 B14R2.11684 [13CH3]Sc1cccc2c1nc(nc2)N 62a_200025704644_200010988910 [0,2,0,0,0,0|1,1,0]=4 1607 B14R2.11684 [13CH3]Sc1ccnc2c1nc(cc2)F 62a_100000719316_200025704644 [0,2,0,0,0,0|1,1,0]=4 1608 B14R2.11684 [13CH3]Sc1ccnc2c1nc(cc2)F 62a_200025704644_100000719316 [0,2,0,0,0,0|1,1,0]=4 1609 B14R2.11684 [13CH3]Sc1cncc2c1nc(cc2)O 62a_200025704644_100009812673 [0,2,0,0,0,0|1,1,0]=4 1610 B14R2.28472 Cc1nc2ccnc(c2nc1C)O 271570a_203496583355_200000029173 [0,2,0,0,0,0|2,0,0]=4 1611 B14R2.28472 Oc1nc2c(cccc2cc1F)O 271570a_203496583355_100010140959 [0,2,0,0,0,0|0,0,0]=2 1612 B14R2.1019 C=Cc1cc(c2ccccc2c1)N 271570a_100011290941_100010171453 [0,2,0,0,0,0|2,0,0]=4 1613 B14R2.1019 C=Cc1cc(c2ccccc2c1)O 271570a_100011290941_100010089979 [0,2,0,0,0,0|1,0,0]=3 1614 B14R2.1019 C=Cc1cc(c2ncccc2c1)C 271570a_100011290941_100010130319 [0,2,0,0,0,0|1,0,0]=3 1615 B14R2.1019 C=Cc1cc(c2ncccc2c1)Cl 271570a_100011290941_200010369337 [0,2,0,0,0,0|1,0,0]=3 1616 B14R2.1019 C=Cc1cc(c2ncccc2c1)F 271570a_100011290941_100010234705 [0,2,0,0,0,0|1,0,0]=3 1617 B14R2.1019 C=Cc1cc(c2ncccc2c1)N 271570a_100011290941_100009814519 [0,2,0,0,0,0|1,0,0]=3 1618 B14R2.1019 C=Cc1cc(c2ncccc2c1)O 271570a_100011290941_100010248853 [0,2,0,0,0,0|0,0,0]=2 1619 B14R2.1019 C=Cc1cc(c2nccnc2c1)C 271570a_100011290941_100010080486 [0,2,0,0,0,0|2,0,0]=4 1620 B14R2.1019 C=Cc1cc(c2nccnc2c1)F 271570a_100011290941_100010079260 [0,2,0,0,0,0|2,0,0]=4 1621 B14R2.1019 CNc1cc(c2ccccc2c1)Br 34a_100010089974_200000210301 [0,2,0,0,0,0|2,0,0]=4 1622 B14R2.1019 CNc1cc(c2ccccc2c1)Br 7a_100010089974_200000210301 [0,2,0,0,0,0|2,0,0]=4 1623 B14R2.1019 CNc1cc(c2ncccc2c1)Cl 34a_200009830422_200000210301 [0,2,0,0,0,0|1,0,0]=3 1624 B14R2.1019 CNc1cc(c2nccnc2c1)C 27a_100102657272_100010080486 [0,2,0,0,0,0|2,0,0]=4 1625 B14R2.1019 CNc1cc(c2nccnc2c1)F 27a_100102657272_100010079260 [0,2,0,0,0,0|2,0,0]=4 1626 B14R2.1019 COc1cc(c2ccccc2c1)Br 34a_100010001680_200000210301 [0,2,0,0,0,0|2,0,0]=4 1627 B14R2.1019 COc1cc(c2ccccc2c1)Br 7a_100010001680_200000210301 [0,2,0,0,0,0|2,0,0]=4 1628 B14R2.1019 COc1cc(c2ccccc2c1)O 271570a_203496583355_100010152498 [0,2,0,0,0,0|1,0,0]=3 1629 B14R2.1019 COc1cc(c2ccccc2n1)O 271570a_203496583355_100009887561 [0,2,0,0,0,0|2,0,0]=4 1630 B14R2.1019 COc1cc(c2cccnc2c1)O 271570a_203496583355_100010248855 [0,2,0,0,0,0|2,0,0]=4 1631 B14R2.1019 COc1cc(c2ncccc2c1)Cl 34a_100000097192_200000210301 [0,2,0,0,0,0|1,0,0]=3 1632 B14R2.1019 COc1cc(c2ncccc2c1)Cl 7a_100000097192_200000210301 [0,2,0,0,0,0|1,0,0]=3 1633 B14R2.1019 COc1cc(c2ncccc2c1)F 34a_100009888031_200000210301 [0,2,0,0,0,0|1,0,0]=3 1634 B14R2.1019 COc1cc(c2ncccc2c1)F 7a_100009888031_200000210301 [0,2,0,0,0,0|1,0,0]=3 1635 B14R2.1019 COc1cc(c2ncccc2c1)N 34a_100000083691_200000210301 [0,2,0,0,0,0|1,0,0]=3 1636 B14R2.1019 COc1cc(c2ncccc2c1)O 271570a_203496583355_200010235761 [0,2,0,0,0,0|0,0,0]=2 1637 B14R2.1019 CSc1cc(c2ccccc2c1)N 62a_100010171453_200000210301 [0,2,0,0,0,0|2,0,0]=4 1638 B14R2.1019 CSc1cc(c2ccccc2c1)N 62a_200000210301_100010171453 [0,2,0,0,0,0|2,0,0]=4 1639 B14R2.1019 CSc1cc(c2ccccc2c1)O 62a_200000210301_100010089979 [0,2,0,0,0,0|1,0,0]=3 1640 B14R2.1019 CSc1cc(c2ncccc2c1)C 62a_200000210301_100010130319 [0,2,0,0,0,0|1,0,0]=3 1641 B14R2.1019 CSc1cc(c2ncccc2c1)Cl 62a_200000210301_200010369337 [0,2,0,0,0,0|1,0,0]=3 1642 B14R2.1019 CSc1cc(c2ncccc2c1)F 62a_100010234705_200000210301 [0,2,0,0,0,0|1,0,0]=3 1643 B14R2.1019 CSc1cc(c2ncccc2c1)F 62a_200000210301_100010234705 [0,2,0,0,0,0|1,0,0]=3 1644 B14R2.1019 CSc1cc(c2ncccc2c1)N 62a_200000210301_100009814519 [0,2,0,0,0,0|1,0,0]=3 1645 B14R2.1019 CSc1cc(c2ncccc2c1)O 62a_200000210301_100010248853 [0,2,0,0,0,0|0,0,0]=2 1646 B14R2.1019 CSc1cc(c2nccnc2c1)C 62a_200000210301_100010080486 [0,2,0,0,0,0|2,0,0]=4 1647 B14R2.1019 CSc1cc(c2nccnc2c1)F 62a_100010079260_200000210301 [0,2,0,0,0,0|2,0,0]=4 1648 B14R2.1019 CSc1cc(c2nccnc2c1)F 62a_200000210301_100010079260 [0,2,0,0,0,0|2,0,0]=4 1649 B14R2.1019 Cc1cc(cc2c1nccc2)S[13CH3] 62a_200025704644_100010130319 [0,2,0,0,0,0|1,0,0]=3 1650 B14R2.1019 Cc1cc(cc2c1nccn2)S[13CH3] 62a_200025704644_100010080486 [0,2,0,0,0,0|2,0,0]=4 1651 B14R2.1019 [13CH3]Nc1cc(c2ccccc2c1)Br 34a_100010089974_200025704644 [0,2,0,0,0,0|2,0,0]=4 1652 B14R2.1019 [13CH3]Nc1cc(c2ccccc2c1)Br 7a_100010089974_200025704644 [0,2,0,0,0,0|2,0,0]=4 1653 B14R2.1019 [13CH3]Nc1cc(c2ncccc2c1)Cl 34a_200009830422_200025704644 [0,2,0,0,0,0|1,0,0]=3 1654 B14R2.1019 [13CH3]Oc1cc(c2ccccc2c1)Br 34a_100010001680_200025704644 [0,2,0,0,0,0|2,0,0]=4 1655 B14R2.1019 [13CH3]Oc1cc(c2ccccc2c1)Br 7a_100010001680_200025704644 [0,2,0,0,0,0|2,0,0]=4 1656 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)Cl 34a_100000097192_200025704644 [0,2,0,0,0,0|1,0,0]=3 1657 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)Cl 7a_100000097192_200025704644 [0,2,0,0,0,0|1,0,0]=3 1658 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)F 34a_100009888031_200025704644 [0,2,0,0,0,0|1,0,0]=3 1659 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)F 7a_100009888031_200025704644 [0,2,0,0,0,0|1,0,0]=3 1660 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)N 34a_100000083691_200025704644 [0,2,0,0,0,0|1,0,0]=3 1661 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)N 62a_100010171453_200025704644 [0,2,0,0,0,0|2,0,0]=4 1662 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)N 62a_200025704644_100010171453 [0,2,0,0,0,0|2,0,0]=4 1663 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)O 62a_200025704644_100010089979 [0,2,0,0,0,0|1,0,0]=3 1664 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)Cl 62a_200025704644_200010369337 [0,2,0,0,0,0|1,0,0]=3 1665 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)F 62a_100010234705_200025704644 [0,2,0,0,0,0|1,0,0]=3 1666 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)F 62a_200025704644_100010234705 [0,2,0,0,0,0|1,0,0]=3 1667 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)N 62a_200025704644_100009814519 [0,2,0,0,0,0|1,0,0]=3 1668 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)O 62a_200025704644_100010248853 [0,2,0,0,0,0|0,0,0]=2 1669 B14R2.1019 [13CH3]Sc1cc(c2nccnc2c1)F 62a_100010079260_200025704644 [0,2,0,0,0,0|2,0,0]=4 1670 B14R2.1019 [13CH3]Sc1cc(c2nccnc2c1)F 62a_200025704644_100010079260 [0,2,0,0,0,0|2,0,0]=4 1671 B14R2.1146 C=Cc1cc(cc2c1cccc2)N 271570a_100011290941_100010089974 [0,2,0,0,0,0|2,0,0]=4 1672 B14R2.1146 C=Cc1cc(cc2c1cccc2)O 271570a_100011290941_100010001680 [0,2,0,0,0,0|2,0,0]=4 1673 B14R2.1146 C=Cc1cc(cc2c1nccc2)Br 271570a_100011290941_100010090713 [0,2,0,0,0,0|1,0,0]=3 1674 B14R2.1146 C=Cc1cc(cc2c1nccc2)C 271570a_100011290941_100010113427 [0,2,0,0,0,0|1,0,0]=3 1675 B14R2.1146 C=Cc1cc(cc2c1nccc2)F 271570a_100011290941_100010214460 [0,2,0,0,0,0|1,0,0]=3 1676 B14R2.1146 C=Cc1cc(cc2c1nccn2)F 271570a_100011290941_100011083936 [0,2,0,0,0,0|2,0,0]=4 1677 B14R2.1146 C=Cc1nc(cc2c1nccc2)N 271570a_100011290941_100010205410 [0,2,0,0,0,0|2,0,0]=4 1678 B14R2.1146 CNc1cc(cc2c1cccc2)Br 34a_100010171453_200000210301 [0,2,0,0,0,0|2,0,0]=4 1679 B14R2.1146 CNc1cc(cc2c1nccc2)Br 27a_100102657272_100010090713 [0,2,0,0,0,0|1,0,0]=3 1680 B14R2.1146 CNc1cc(cc2c1nccc2)Br 34a_100009814519_200000210301 [0,2,0,0,0,0|1,0,0]=3 1681 B14R2.1146 CNc1cc(cc2c1nccc2)Cl 34a_100000026717_200000210301 [0,2,0,0,0,0|1,0,0]=3 1682 B14R2.1146 CNc1cc(cc2c1nccc2)F 27a_100102657272_100010214460 [0,2,0,0,0,0|1,0,0]=3 1683 B14R2.1146 CNc1cc(cc2c1nccc2)F 34a_100000088212_200000210301 [0,2,0,0,0,0|1,0,0]=3 1684 B14R2.1146 CNc1cc(cc2c1nccc2)O 34a_100000083691_200000210301 [0,2,0,0,0,0|1,0,0]=3 1685 B14R2.1146 CNc1cc(cc2c1nccn2)F 27a_100102657272_100011083936 [0,2,0,0,0,0|2,0,0]=4 1686 B14R2.1146 CNc1nc(cc2c1nccc2)N 27a_100102657272_100010205410 [0,2,0,0,0,0|2,0,0]=4 1687 B14R2.1146 COc1cc(cc2c1cccc2)Br 34a_100010089979_200000210301 [0,2,0,0,0,0|1,0,0]=3 1688 B14R2.1146 COc1cc(cc2c1cccc2)Br 7a_100010089979_200000210301 [0,2,0,0,0,0|1,0,0]=3 1689 B14R2.1146 COc1cc(cc2c1cccn2)O 271570a_203496583355_100010248854 [0,2,0,0,0,0|2,0,0]=4 1690 B14R2.1146 COc1cc(cc2c1nccc2)Br 34a_100010248853_200000210301 [0,2,0,0,0,0|0,0,0]=2 1691 B14R2.1146 COc1cc(cc2c1nccc2)Br 7a_100010248853_200000210301 [0,2,0,0,0,0|0,0,0]=2 1692 B14R2.1146 COc1cc(cc2c1nccc2)C 34a_100009888445_200000210301 [0,2,0,0,0,0|0,0,0]=2 1693 B14R2.1146 COc1cc(cc2c1nccc2)C 7a_100009888445_200000210301 [0,2,0,0,0,0|0,0,0]=2 1694 B14R2.1146 COc1cc(cc2c1nccc2)Cl 34a_200000089624_200000210301 [0,2,0,0,0,0|0,0,0]=2 1695 B14R2.1146 COc1cc(cc2c1nccc2)Cl 7a_200000089624_200000210301 [0,2,0,0,0,0|0,0,0]=2 1696 B14R2.1146 COc1cc(cc2c1nccc2)O 271570a_203496583355_100010248852 [0,2,0,0,0,0|0,0,0]=2 1697 B14R2.1146 COc1cc(nc2c1cccc2)C 34a_100000698765_200000210301 [0,2,0,0,0,0|2,0,0]=4 1698 B14R2.1146 COc1cc(nc2c1cccc2)O 271570a_203496583355_200010892118 [0,2,0,0,0,0|2,0,0]=4 1699 B14R2.1146 CSc1cc(cc2c1cccc2)N 62a_100010089974_200000210301 [0,2,0,0,0,0|1,1,0]=4 1700 B14R2.1146 CSc1cc(cc2c1cccc2)N 62a_200000210301_100010089974 [0,2,0,0,0,0|1,1,0]=4 1701 B14R2.1146 CSc1cc(cc2c1cccc2)O 62a_200000210301_100010001680 [0,2,0,0,0,0|1,1,0]=4 1702 B14R2.1146 CSc1cc(cc2c1nccc2)Br 62a_100010090713_200000210301 [0,2,0,0,0,0|0,1,0]=3 1703 B14R2.1146 CSc1cc(cc2c1nccc2)Br 62a_200000210301_100010090713 [0,2,0,0,0,0|0,1,0]=3 1704 B14R2.1146 CSc1cc(cc2c1nccc2)C 62a_200000210301_100010113427 [0,2,0,0,0,0|0,1,0]=3 1705 B14R2.1146 CSc1cc(cc2c1nccc2)F 62a_100010214460_200000210301 [0,2,0,0,0,0|0,1,0]=3 1706 B14R2.1146 CSc1cc(cc2c1nccc2)F 62a_200000210301_100010214460 [0,2,0,0,0,0|0,1,0]=3 1707 B14R2.1146 CSc1cc(cc2c1nccn2)F 62a_100011083936_200000210301 [0,2,0,0,0,0|1,1,0]=4 1708 B14R2.1146 CSc1cc(cc2c1nccn2)F 62a_200000210301_100011083936 [0,2,0,0,0,0|1,1,0]=4 1709 B14R2.1146 CSc1nc(cc2c1nccc2)N 62a_100010205410_200000210301 [0,2,0,0,0,0|1,1,0]=4 1710 B14R2.1146 CSc1nc(cc2c1nccc2)N 62a_200000210301_100010205410 [0,2,0,0,0,0|1,1,0]=4 1711 B14R2.1146 Cc1cc(c2ccccc2n1)O[13CH3] 34a_100000698765_200025704644 [0,2,0,0,0,0|2,0,0]=4 1712 B14R2.1146 Cc1cc(c2ncccc2c1)O[13CH3] 34a_100009888445_200025704644 [0,2,0,0,0,0|0,0,0]=2 1713 B14R2.1146 Cc1cc(c2ncccc2c1)O[13CH3] 7a_100009888445_200025704644 [0,2,0,0,0,0|0,0,0]=2 1714 B14R2.1146 Cc1cc(c2ncccc2c1)S[13CH3] 62a_200025704644_100010113427 [0,2,0,0,0,0|0,1,0]=3 1715 B14R2.1146 [13CH3]Nc1cc(cc2c1cccc2)Br 34a_100010171453_200025704644 [0,2,0,0,0,0|2,0,0]=4 1716 B14R2.1146 [13CH3]Nc1cc(cc2c1nccc2)Br 34a_100009814519_200025704644 [0,2,0,0,0,0|1,0,0]=3 1717 B14R2.1146 [13CH3]Nc1cc(cc2c1nccc2)Cl 34a_100000026717_200025704644 [0,2,0,0,0,0|1,0,0]=3 1718 B14R2.1146 [13CH3]Nc1cc(cc2c1nccc2)F 34a_100000088212_200025704644 [0,2,0,0,0,0|1,0,0]=3 1719 B14R2.1146 [13CH3]Nc1cc(cc2c1nccc2)O 34a_100000083691_200025704644 [0,2,0,0,0,0|1,0,0]=3 1720 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 34a_100010089979_200025704644 [0,2,0,0,0,0|1,0,0]=3 1721 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 7a_100010089979_200025704644 [0,2,0,0,0,0|1,0,0]=3 1722 B14R2.1146 [13CH3]Oc1cc(cc2c1nccc2)Br 34a_100010248853_200025704644 [0,2,0,0,0,0|0,0,0]=2 1723 B14R2.1146 [13CH3]Oc1cc(cc2c1nccc2)Br 7a_100010248853_200025704644 [0,2,0,0,0,0|0,0,0]=2 1724 B14R2.1146 [13CH3]Oc1cc(cc2c1nccc2)Cl 34a_200000089624_200025704644 [0,2,0,0,0,0|0,0,0]=2 1725 B14R2.1146 [13CH3]Oc1cc(cc2c1nccc2)Cl 7a_200000089624_200025704644 [0,2,0,0,0,0|0,0,0]=2 1726 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)N 62a_100010089974_200025704644 [0,2,0,0,0,0|1,1,0]=4 1727 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)N 62a_200025704644_100010089974 [0,2,0,0,0,0|1,1,0]=4 1728 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)O 62a_200025704644_100010001680 [0,2,0,0,0,0|1,1,0]=4 1729 B14R2.1146 [13CH3]Sc1cc(cc2c1nccc2)Br 62a_100010090713_200025704644 [0,2,0,0,0,0|0,1,0]=3 1730 B14R2.1146 [13CH3]Sc1cc(cc2c1nccc2)Br 62a_200025704644_100010090713 [0,2,0,0,0,0|0,1,0]=3 1731 B14R2.1146 [13CH3]Sc1cc(cc2c1nccc2)F 62a_100010214460_200025704644 [0,2,0,0,0,0|0,1,0]=3 1732 B14R2.1146 [13CH3]Sc1cc(cc2c1nccc2)F 62a_200025704644_100010214460 [0,2,0,0,0,0|0,1,0]=3 1733 B14R2.1146 [13CH3]Sc1cc(cc2c1nccn2)F 62a_100011083936_200025704644 [0,2,0,0,0,0|1,1,0]=4 1734 B14R2.1146 [13CH3]Sc1cc(cc2c1nccn2)F 62a_200025704644_100011083936 [0,2,0,0,0,0|1,1,0]=4 1735 B14R2.1146 [13CH3]Sc1nc(cc2c1nccc2)N 62a_100010205410_200025704644 [0,2,0,0,0,0|1,1,0]=4 1736 B14R2.1146 [13CH3]Sc1nc(cc2c1nccc2)N 62a_200025704644_100010205410 [0,2,0,0,0,0|1,1,0]=4 1737 B14R2.28480 Oc1ccnc2c1c(cc(c2)F)F 271570a_203496583355_100011310466 [0,2,0,0,0,0|2,0,0]=4 1738 B14R2.29365 Cc1cc(c2ccc(cc2n1)F)O 271570a_203496583355_100011290880 [0,2,0,0,0,0|2,0,0]=4 1739 B14R2.29365 Nc1cc(c2ncc(cc2c1)O)F 271570a_203496583355_100010780968 [0,2,0,0,0,0|1,0,0]=3 1740 B14R2.29365 O=c1cc(c2ccc(cc2o1)O)O 271570a_203496583355_100010062223 [0,2,0,0,0,0|2,0,0]=4 1741 B14R2.29365 Oc1cnc2c(nc(nc2c1)O)O 271570a_203496583355_100020641529 [0,2,0,0,0,0|2,0,0]=4 1742 B14R2.1078 C=Cc1cccc2c1[nH]ccc2=O 271570a_100011290941_100000749886 [0,2,0,0,0,0|1,0,1]=4 1743 B14R2.1078 C=Cc1cccc2c1cccc2F 271570a_100011290941_100009817034 [0,2,0,0,0,0|2,0,0]=4 1744 B14R2.1078 C=Cc1cccc2c1cccc2N 271570a_100011290941_100009816864 [0,2,0,0,0,0|2,0,0]=4 1745 B14R2.1078 C=Cc1cccc2c1cccc2O 271570a_100011290941_100010003857 [0,2,0,0,0,0|1,0,0]=3 1746 B14R2.1078 C=Cc1cccc2c1nccc2C 271570a_100011290941_100010254272 [0,2,0,0,0,0|1,0,0]=3 1747 B14R2.1078 C=Cc1cccc2c1nccc2N 271570a_100011290941_100011620713 [0,2,0,0,0,0|1,0,0]=3 1748 B14R2.1078 C=Cc1cccc2c1ncnc2N 271570a_100011290941_100010199759 [0,2,0,0,0,0|2,0,0]=4 1749 B14R2.1078 C=Cc1cccc2c1ncnc2O 271570a_100011290941_100010201916 [0,2,0,0,0,0|2,0,0]=4 1750 B14R2.1078 C=Cc1ccnc2c1cccc2C 271570a_100011290941_100000751276 [0,2,0,0,0,0|1,0,0]=3 1751 B14R2.1078 C=Cc1ccnc2c1cccc2F 271570a_100011290941_100011934723 [0,2,0,0,0,0|1,0,0]=3 1752 B14R2.1078 C=Cc1ccnc2c1cccc2N 271570a_100011290941_100009892510 [0,2,0,0,0,0|1,0,0]=3 1753 B14R2.1078 C=Cc1ccnc2c1cccc2O 271570a_100011290941_100000703299 [0,2,0,0,0,0|0,0,0]=2 1754 B14R2.1078 C=Cc1ccnc2c1nccc2C 271570a_100011290941_200013369187 [0,2,0,0,0,0|2,0,0]=4 1755 B14R2.1078 C=Cc1ncnc2c1cccc2C 271570a_100011290941_100000751292 [0,2,0,0,0,0|2,0,0]=4 1756 B14R2.1078 C=Cc1ncnc2c1cccc2F 271570a_100011290941_100000693626 [0,2,0,0,0,0|2,0,0]=4 1757 B14R2.1078 CNc1cccc2c1cccc2Br 34a_100009816864_200000210301 [0,2,0,0,0,0|2,0,0]=4 1758 B14R2.1078 CNc1cccc2c1cccc2Cl 34a_100000077128_200000210301 [0,2,0,0,0,0|2,0,0]=4 1759 B14R2.1078 CNc1cccc2c1cccc2O 34a_100000210686_200000210301 [0,2,0,0,0,0|1,0,0]=3 1760 B14R2.1078 CNc1cccc2c1nc[nH]c2=O 27a_100102657272_100000741247 [0,2,0,0,0,0|2,0,0]=4 1761 B14R2.1078 CNc1cccc2c1nccc2C 27a_100102657272_100010254272 [0,2,0,0,0,0|1,0,0]=3 1762 B14R2.1078 CNc1cccc2c1nccc2C 34a_100011934384_200000210301 [0,2,0,0,0,0|1,0,0]=3 1763 B14R2.1078 CNc1cccc2c1nccc2Cl 34a_100009892510_200000210301 [0,2,0,0,0,0|1,0,0]=3 1764 B14R2.1078 CNc1cccc2c1ncnc2Cl 27a_100102657272_100010219103 [0,2,0,0,0,0|2,0,0]=4 1765 B14R2.1078 CNc1cccc2c1ncnc2N 27a_100102657272_100010199759 [0,2,0,0,0,0|2,0,0]=4 1766 B14R2.1078 CNc1ccnc2c1cccc2C 27a_100102657272_100000751276 [0,2,0,0,0,0|1,0,0]=3 1767 B14R2.1078 CNc1ccnc2c1cccc2F 27a_100102657272_100000751275 [0,2,0,0,0,0|1,0,0]=3 1768 B14R2.1078 CNc1ccnc2c1cccc2N 27a_100102657272_100009892510 [0,2,0,0,0,0|1,0,0]=3 1769 B14R2.1078 CNc1ccnc2c1cccc2O 27a_100102657272_100000703299 [0,2,0,0,0,0|0,0,0]=2 1770 B14R2.1078 CNc1ccnc2c1nccc2C 27a_100102657272_200013369187 [0,2,0,0,0,0|2,0,0]=4 1771 B14R2.1078 CNc1ncnc2c1cccc2C 27a_100102657272_100000751292 [0,2,0,0,0,0|2,0,0]=4 1772 B14R2.1078 CNc1ncnc2c1cccc2F 27a_100102657272_100000693626 [0,2,0,0,0,0|2,0,0]=4 1773 B14R2.1078 COc1cccc2c1cccc2Br 34a_100010003857_200000210301 [0,2,0,0,0,0|1,0,0]=3 1774 B14R2.1078 COc1cccc2c1cccc2Br 7a_100010003857_200000210301 [0,2,0,0,0,0|1,0,0]=3 1775 B14R2.1078 COc1cccc2c1cccc2N 34a_100000210686_200000210301 [0,2,0,0,0,0|1,0,0]=3 1776 B14R2.1078 COc1cccc2c1nccc2Br 34a_100000703299_200000210301 [0,2,0,0,0,0|0,0,0]=2 1777 B14R2.1078 COc1cccc2c1nccc2Br 7a_100000703299_200000210301 [0,2,0,0,0,0|0,0,0]=2 1778 B14R2.1078 COc1cccc2c1nccc2C 7a_100000702989_200000210301 [0,2,0,0,0,0|0,0,0]=2 1779 B14R2.1078 COc1cccc2c1nccc2O 271570a_203496583355_100000709070 [0,2,0,0,0,0|0,0,0]=2 1780 B14R2.1078 COc1cccc2c1ncnc2O 271570a_203496583355_100012001261 [0,2,0,0,0,0|1,0,0]=3 1781 B14R2.1078 COc1ccnc2c1cccc2F 34a_100000709910_200000210301 [0,2,0,0,0,0|1,0,0]=3 1782 B14R2.1078 CSc1cccc2c1cccc2F 62a_100009817034_200000210301 [0,2,0,0,0,0|1,1,0]=4 1783 B14R2.1078 CSc1cccc2c1cccc2F 62a_200000210301_100009817034 [0,2,0,0,0,0|1,1,0]=4 1784 B14R2.1078 CSc1cccc2c1cccc2N 62a_100009816864_200000210301 [0,2,0,0,0,0|1,1,0]=4 1785 B14R2.1078 CSc1cccc2c1cccc2O 62a_200000210301_100010003857 [0,2,0,0,0,0|1,0,0]=3 1786 B14R2.1078 CSc1cccc2c1nccc2C 62a_200000210301_100010254272 [0,2,0,0,0,0|0,1,0]=3 1787 B14R2.1078 CSc1cccc2c1nccc2N 62a_100011620713_200000210301 [0,2,0,0,0,0|0,1,0]=3 1788 B14R2.1078 CSc1cccc2c1nccc2N 62a_200000210301_100011620713 [0,2,0,0,0,0|0,1,0]=3 1789 B14R2.1078 CSc1cccc2c1ncnc2Cl 62a_200000210301_100010219103 [0,2,0,0,0,0|1,1,0]=4 1790 B14R2.1078 CSc1cccc2c1ncnc2N 62a_100010199759_200000210301 [0,2,0,0,0,0|1,1,0]=4 1791 B14R2.1078 CSc1cccc2c1ncnc2N 62a_200000210301_100010199759 [0,2,0,0,0,0|1,1,0]=4 1792 B14R2.1078 CSc1cccc2c1ncnc2O 62a_200000210301_100010201916 [0,2,0,0,0,0|1,1,0]=4 1793 B14R2.1078 CSc1ccnc2c1cccc2C 62a_200000210301_100000751276 [0,2,0,0,0,0|1,0,0]=3 1794 B14R2.1078 CSc1ccnc2c1cccc2F 62a_100011934723_200000210301 [0,2,0,0,0,0|1,0,0]=3 1795 B14R2.1078 CSc1ccnc2c1cccc2F 62a_200000210301_100011934723 [0,2,0,0,0,0|1,0,0]=3 1796 B14R2.1078 CSc1ccnc2c1cccc2N 62a_200000210301_100009892510 [0,2,0,0,0,0|1,0,0]=3 1797 B14R2.1078 CSc1ccnc2c1cccc2O 62a_200000210301_100000703299 [0,2,0,0,0,0|0,0,0]=2 1798 B14R2.1078 CSc1ccnc2c1nccc2C 62a_200000210301_200013369187 [0,2,0,0,0,0|1,1,0]=4 1799 B14R2.1078 CSc1ncnc2c1cccc2C 62a_200000210301_100000751292 [0,2,0,0,0,0|2,0,0]=4 1800 B14R2.1078 CSc1ncnc2c1cccc2F 62a_200000210301_100000693626 [0,2,0,0,0,0|2,0,0]=4 1801 B14R2.1078 Cc1cccc2c1nccc2S[13CH3] 62a_200025704644_100000751276 [0,2,0,0,0,0|1,0,0]=3 1802 B14R2.1078 Cc1cccc2c1ncnc2S[13CH3] 62a_200025704644_100000751292 [0,2,0,0,0,0|2,0,0]=4 1803 B14R2.1078 Cc1ccnc2c1cccc2N[13CH3] 34a_100011934384_200025704644 [0,2,0,0,0,0|1,0,0]=3 1804 B14R2.1078 Cc1ccnc2c1cccc2O[13CH3] 7a_100000702989_200025704644 [0,2,0,0,0,0|0,0,0]=2 1805 B14R2.1078 Cc1ccnc2c1cccc2S[13CH3] 62a_200025704644_100010254272 [0,2,0,0,0,0|0,1,0]=3 1806 B14R2.1078 Cc1ccnc2c1nccc2S[13CH3] 62a_200025704644_200013369187 [0,2,0,0,0,0|1,1,0]=4 1807 B14R2.1078 N#Cc1cccc2c1ccnc2O 271570a_203496583355_100009853718 [0,2,0,0,0,0|2,0,0]=4 1808 B14R2.1078 N#Cc1nccc2c1cccc2O 271570a_203496583355_100010113791 [0,2,0,0,0,0|2,0,0]=4 1809 B14R2.1078 [13CH3]Nc1cccc2c1cccc2Br 34a_100009816864_200025704644 [0,2,0,0,0,0|2,0,0]=4 1810 B14R2.1078 [13CH3]Nc1cccc2c1cccc2Cl 34a_100000077128_200025704644 [0,2,0,0,0,0|2,0,0]=4 1811 B14R2.1078 [13CH3]Nc1cccc2c1cccc2O 34a_100000210686_200025704644 [0,2,0,0,0,0|1,0,0]=3 1812 B14R2.1078 [13CH3]Nc1cccc2c1nccc2Cl 34a_100009892510_200025704644 [0,2,0,0,0,0|1,0,0]=3 1813 B14R2.1078 [13CH3]Oc1cccc2c1cccc2Br 34a_100010003857_200025704644 [0,2,0,0,0,0|1,0,0]=3 1814 B14R2.1078 [13CH3]Oc1cccc2c1cccc2Br 7a_100010003857_200025704644 [0,2,0,0,0,0|1,0,0]=3 1815 B14R2.1078 [13CH3]Oc1cccc2c1cccc2N 34a_100000210686_200025704644 [0,2,0,0,0,0|1,0,0]=3 1816 B14R2.1078 [13CH3]Oc1cccc2c1nccc2Br 34a_100000703299_200025704644 [0,2,0,0,0,0|0,0,0]=2 1817 B14R2.1078 [13CH3]Oc1cccc2c1nccc2Br 7a_100000703299_200025704644 [0,2,0,0,0,0|0,0,0]=2 1818 B14R2.1078 [13CH3]Oc1ccnc2c1cccc2F 34a_100000709910_200025704644 [0,2,0,0,0,0|1,0,0]=3 1819 B14R2.1078 [13CH3]Sc1cccc2c1cccc2F 62a_100009817034_200025704644 [0,2,0,0,0,0|1,1,0]=4 1820 B14R2.1078 [13CH3]Sc1cccc2c1cccc2F 62a_200025704644_100009817034 [0,2,0,0,0,0|1,1,0]=4 1821 B14R2.1078 [13CH3]Sc1cccc2c1cccc2N 62a_100009816864_200025704644 [0,2,0,0,0,0|1,1,0]=4 1822 B14R2.1078 [13CH3]Sc1cccc2c1cccc2O 62a_200025704644_100010003857 [0,2,0,0,0,0|1,0,0]=3 1823 B14R2.1078 [13CH3]Sc1cccc2c1nccc2N 62a_100011620713_200025704644 [0,2,0,0,0,0|0,1,0]=3 1824 B14R2.1078 [13CH3]Sc1cccc2c1nccc2N 62a_200025704644_100011620713 [0,2,0,0,0,0|0,1,0]=3 1825 B14R2.1078 [13CH3]Sc1cccc2c1ncnc2Cl 62a_200025704644_100010219103 [0,2,0,0,0,0|1,1,0]=4 1826 B14R2.1078 [13CH3]Sc1cccc2c1ncnc2N 62a_100010199759_200025704644 [0,2,0,0,0,0|1,1,0]=4 1827 B14R2.1078 [13CH3]Sc1cccc2c1ncnc2N 62a_200025704644_100010199759 [0,2,0,0,0,0|1,1,0]=4 1828 B14R2.1078 [13CH3]Sc1cccc2c1ncnc2O 62a_200025704644_100010201916 [0,2,0,0,0,0|1,1,0]=4 1829 B14R2.1078 [13CH3]Sc1ccnc2c1cccc2F 62a_100011934723_200025704644 [0,2,0,0,0,0|1,0,0]=3 1830 B14R2.1078 [13CH3]Sc1ccnc2c1cccc2F 62a_200025704644_100011934723 [0,2,0,0,0,0|1,0,0]=3 1831 B14R2.1078 [13CH3]Sc1ccnc2c1cccc2N 62a_200025704644_100009892510 [0,2,0,0,0,0|1,0,0]=3 1832 B14R2.1078 [13CH3]Sc1ccnc2c1cccc2O 62a_200025704644_100000703299 [0,2,0,0,0,0|0,0,0]=2 1833 B14R2.1078 [13CH3]Sc1ncnc2c1cccc2F 62a_200025704644_100000693626 [0,2,0,0,0,0|2,0,0]=4 1834 B14R2.8051 Cc1ccnc2c1c(ccc2O)C 271570a_203496583355_200010761301 [0,2,0,0,0,0|0,0,0]=2 1835 B14R2.8051 O=c1cc[nH]c2c1c(ccc2O)F 271570a_203496583355_100012347610 [0,2,0,0,0,0|0,0,1]=3 1836 B14R2.8051 Oc1ccnc2c1c(ccc2F)F 271570a_203496583355_100000748727 [0,2,0,0,0,0|1,0,0]=3 1837 B14R2.1131 C=Cc1ccc(c2c1cccc2)Br 271570a_100011290941_100012339872 [0,2,0,0,0,0|2,0,0]=4 1838 B14R2.1131 C=Cc1ccc(c2c1cccc2)C 271570a_100011290941_100011215156 [0,2,0,0,0,0|2,0,0]=4 1839 B14R2.1131 C=Cc1ccc(c2c1cccc2)F 271570a_100011290941_100011218216 [0,2,0,0,0,0|2,0,0]=4 1840 B14R2.1131 C=Cc1ccc(c2c1cccc2)N 271570a_100011290941_100000766797 [0,2,0,0,0,0|2,0,0]=4 1841 B14R2.1131 C=Cc1ccc(c2c1cccc2)O 271570a_100011290941_100000186334 [0,2,0,0,0,0|1,0,0]=3 1842 B14R2.1131 C=Cc1ccc(c2c1cccn2)C 271570a_100011290941_100000694312 [0,2,0,0,0,0|1,0,0]=3 1843 B14R2.1131 C=Cc1ccc(c2c1cccn2)F 271570a_100011290941_100010245834 [0,2,0,0,0,0|1,0,0]=3 1844 B14R2.1131 C=Cc1ccc(c2c1cccn2)N 271570a_100011290941_100000726955 [0,2,0,0,0,0|1,0,0]=3 1845 B14R2.1131 C=Cc1ccc(c2c1cccn2)O 271570a_100011290941_100011934063 [0,2,0,0,0,0|0,0,0]=2 1846 B14R2.1131 C=Cc1ccc(c2c1nccc2)F 271570a_100011290941_100010214461 [0,2,0,0,0,0|1,0,0]=3 1847 B14R2.1131 C=Cc1ccc(c2c1nccc2)N 271570a_100011290941_100012360041 [0,2,0,0,0,0|1,0,0]=3 1848 B14R2.1131 C=Cc1cnc(c2c1cccc2)O 271570a_100011290941_100009816523 [0,2,0,0,0,0|2,0,0]=4 1849 B14R2.1131 C=Cc1cnc(c2c1nccc2)N 271570a_100011290941_100010383929 [0,2,0,0,0,0|2,0,0]=4 1850 B14R2.1131 C=Cc1ncc(c2c1cccc2)O 271570a_100011290941_100000067196 [0,2,0,0,0,0|2,0,0]=4 1851 B14R2.1131 CNc1ccc(c2c1cccc2)Br 34a_100000766797_200000210301 [0,2,0,0,0,0|2,0,0]=4 1852 B14R2.1131 CNc1ccc(c2c1cccc2)Cl 34a_100011216319_200000210301 [0,2,0,0,0,0|2,0,0]=4 1853 B14R2.1131 CNc1ccc(c2c1cccc2)F 34a_100011988692_200000210301 [0,2,0,0,0,0|2,0,0]=4 1854 B14R2.1131 CNc1ccc(c2c1cccc2)O 34a_100000705857_200000210301 [0,2,0,0,0,0|1,0,0]=3 1855 B14R2.1131 CNc1ccc(c2c1cccn2)Br 34a_100012360041_200000210301 [0,2,0,0,0,0|1,0,0]=3 1856 B14R2.1131 CNc1ccc(c2c1cccn2)C 34a_100000736242_200000210301 [0,2,0,0,0,0|1,0,0]=3 1857 B14R2.1131 CNc1ccc(c2c1cccn2)Cl 34a_100000746469_200000210301 [0,2,0,0,0,0|1,0,0]=3 1858 B14R2.1131 CNc1ccc(c2c1cccn2)F 34a_102125277280_200000210301 [0,2,0,0,0,0|1,0,0]=3 1859 B14R2.1131 CNc1ccc(c2c1cccn2)O 34a_100000188197_200000210301 [0,2,0,0,0,0|0,0,0]=2 1860 B14R2.1131 CNc1ccc(c2c1nccc2)Br 34a_100000726955_200000210301 [0,2,0,0,0,0|1,0,0]=3 1861 B14R2.1131 CNc1ccc(c2c1nccc2)Cl 34a_100000736140_200000210301 [0,2,0,0,0,0|1,0,0]=3 1862 B14R2.1131 CNc1ccc(c2c1nccc2)F 27a_100102657272_100010214461 [0,2,0,0,0,0|1,0,0]=3 1863 B14R2.1131 COc1ccc(c2c1cccc2)Br 34a_100000186334_200000210301 [0,2,0,0,0,0|1,0,0]=3 1864 B14R2.1131 COc1ccc(c2c1cccc2)Br 7a_100000186334_200000210301 [0,2,0,0,0,0|1,0,0]=3 1865 B14R2.1131 COc1ccc(c2c1cccc2)C 34a_100000074455_200000210301 [0,2,0,0,0,0|1,0,0]=3 1866 B14R2.1131 COc1ccc(c2c1cccc2)C 7a_100000074455_200000210301 [0,2,0,0,0,0|1,0,0]=3 1867 B14R2.1131 COc1ccc(c2c1cccc2)Cl 34a_100000211000_200000210301 [0,2,0,0,0,0|1,0,0]=3 1868 B14R2.1131 COc1ccc(c2c1cccc2)Cl 7a_100000211000_200000210301 [0,2,0,0,0,0|1,0,0]=3 1869 B14R2.1131 COc1ccc(c2c1cccc2)F 34a_100000100223_200000210301 [0,2,0,0,0,0|1,0,0]=3 1870 B14R2.1131 COc1ccc(c2c1cccc2)F 7a_100000100223_200000210301 [0,2,0,0,0,0|1,0,0]=3 1871 B14R2.1131 COc1ccc(c2c1cccc2)N 34a_100000705857_200000210301 [0,2,0,0,0,0|1,0,0]=3 1872 B14R2.1131 COc1ccc(c2c1cccc2)N 7a_100000705857_200000210301 [0,2,0,0,0,0|1,0,0]=3 1873 B14R2.1131 COc1ccc(c2c1cccc2)O 271570a_203496583355_100011256618 [0,2,0,0,0,0|1,0,0]=3 1874 B14R2.1131 COc1ccc(c2c1nccc2)Br 34a_100011934063_200000210301 [0,2,0,0,0,0|0,0,0]=2 1875 B14R2.1131 COc1ccc(c2c1nccc2)Br 7a_100011934063_200000210301 [0,2,0,0,0,0|0,0,0]=2 1876 B14R2.1131 COc1ccc(c2c1nccc2)C 34a_100000058672_200000210301 [0,2,0,0,0,0|0,0,0]=2 1877 B14R2.1131 COc1ccc(c2c1nccc2)C 7a_100000058672_200000210301 [0,2,0,0,0,0|0,0,0]=2 1878 B14R2.1131 COc1ccc(c2c1nccc2)Cl 34a_100000212186_200000210301 [0,2,0,0,0,0|0,0,0]=2 1879 B14R2.1131 COc1ccc(c2c1nccc2)Cl 7a_100000212186_200000210301 [0,2,0,0,0,0|0,0,0]=2 1880 B14R2.1131 COc1ccc(c2c1nccc2)F 34a_100000034212_200000210301 [0,2,0,0,0,0|0,0,0]=2 1881 B14R2.1131 COc1ccc(c2c1nccc2)F 7a_100000034212_200000210301 [0,2,0,0,0,0|0,0,0]=2 1882 B14R2.1131 COc1ccc(c2c1nccc2)N 34a_100000188197_200000210301 [0,2,0,0,0,0|0,0,0]=2 1883 B14R2.1131 COc1ccc(c2c1nccc2)O 271570a_203496583355_100009820878 [0,2,0,0,0,0|0,0,0]=2 1884 B14R2.1131 COc1cnc(c2c1cccc2)Cl 34a_100000067196_200000210301 [0,2,0,0,0,0|2,0,0]=4 1885 B14R2.1131 COc1cnc(c2c1cccc2)Cl 7a_100000067196_200000210301 [0,2,0,0,0,0|2,0,0]=4 1886 B14R2.1131 COc1cnc(c2c1cccc2)O 271570a_203496583355_100009847308 [0,2,0,0,0,0|2,0,0]=4 1887 B14R2.1131 COc1ncc(c2c1cccc2)O 271570a_203496583355_100010220697 [0,2,0,0,0,0|2,0,0]=4 1888 B14R2.1131 CSc1c[nH]c(=O)c2c1nccc2 62a_200000210301_100009998689 [0,2,0,0,0,0|1,1,0]=4 1889 B14R2.1131 CSc1ccc(c2c1cccc2)Br 62a_100012339872_200000210301 [0,2,0,0,0,0|1,1,0]=4 1890 B14R2.1131 CSc1ccc(c2c1cccc2)Br 62a_200000210301_100012339872 [0,2,0,0,0,0|1,1,0]=4 1891 B14R2.1131 CSc1ccc(c2c1cccc2)C 62a_100011215156_200000210301 [0,2,0,0,0,0|1,1,0]=4 1892 B14R2.1131 CSc1ccc(c2c1cccc2)C 62a_200000210301_100011215156 [0,2,0,0,0,0|1,1,0]=4 1893 B14R2.1131 CSc1ccc(c2c1cccc2)F 62a_100011218216_200000210301 [0,2,0,0,0,0|1,1,0]=4 1894 B14R2.1131 CSc1ccc(c2c1cccc2)F 62a_200000210301_100011218216 [0,2,0,0,0,0|1,1,0]=4 1895 B14R2.1131 CSc1ccc(c2c1cccc2)N 62a_100000766797_200000210301 [0,2,0,0,0,0|1,1,0]=4 1896 B14R2.1131 CSc1ccc(c2c1cccc2)O 62a_200000210301_100000186334 [0,2,0,0,0,0|1,0,0]=3 1897 B14R2.1131 CSc1ccc(c2c1cccn2)C 62a_200000210301_100000694312 [0,2,0,0,0,0|1,0,0]=3 1898 B14R2.1131 CSc1ccc(c2c1cccn2)F 62a_100010245834_200000210301 [0,2,0,0,0,0|1,0,0]=3 1899 B14R2.1131 CSc1ccc(c2c1cccn2)F 62a_200000210301_100010245834 [0,2,0,0,0,0|1,0,0]=3 1900 B14R2.1131 CSc1ccc(c2c1cccn2)N 62a_100000726955_200000210301 [0,2,0,0,0,0|1,0,0]=3 1901 B14R2.1131 CSc1ccc(c2c1cccn2)N 62a_200000210301_100000726955 [0,2,0,0,0,0|1,0,0]=3 1902 B14R2.1131 CSc1ccc(c2c1cccn2)O 62a_200000210301_100011934063 [0,2,0,0,0,0|0,0,0]=2 1903 B14R2.1131 CSc1ccc(c2c1nccc2)F 62a_100010214461_200000210301 [0,2,0,0,0,0|0,1,0]=3 1904 B14R2.1131 CSc1ccc(c2c1nccc2)F 62a_200000210301_100010214461 [0,2,0,0,0,0|0,1,0]=3 1905 B14R2.1131 CSc1ccc(c2c1nccc2)N 62a_100012360041_200000210301 [0,2,0,0,0,0|0,1,0]=3 1906 B14R2.1131 CSc1ccc(c2c1nccc2)N 62a_200000210301_100012360041 [0,2,0,0,0,0|0,1,0]=3 1907 B14R2.1131 CSc1cnc(c2c1cccc2)O 62a_200000210301_100009816523 [0,2,0,0,0,0|2,0,0]=4 1908 B14R2.1131 CSc1cnc(c2c1nccc2)Cl 62a_200000210301_200010218400 [0,2,0,0,0,0|1,1,0]=4 1909 B14R2.1131 CSc1cnc(c2c1nccc2)N 62a_100010383929_200000210301 [0,2,0,0,0,0|1,1,0]=4 1910 B14R2.1131 CSc1cnc(c2c1nccc2)N 62a_200000210301_100010383929 [0,2,0,0,0,0|1,1,0]=4 1911 B14R2.1131 CSc1ncc(c2c1cccc2)O 62a_200000210301_100000067196 [0,2,0,0,0,0|2,0,0]=4 1912 B14R2.1131 Cc1ccc(c2c1cccc2)O[13CH3] 34a_100000074455_200025704644 [0,2,0,0,0,0|1,0,0]=3 1913 B14R2.1131 Cc1ccc(c2c1cccc2)O[13CH3] 7a_100000074455_200025704644 [0,2,0,0,0,0|1,0,0]=3 1914 B14R2.1131 Cc1ccc(c2c1cccc2)S[13CH3] 62a_100011215156_200025704644 [0,2,0,0,0,0|1,1,0]=4 1915 B14R2.1131 Cc1ccc(c2c1cccc2)S[13CH3] 62a_200025704644_100011215156 [0,2,0,0,0,0|1,1,0]=4 1916 B14R2.1131 Cc1ccc(c2c1cccn2)O[13CH3] 34a_100000058672_200025704644 [0,2,0,0,0,0|0,0,0]=2 1917 B14R2.1131 Cc1ccc(c2c1cccn2)O[13CH3] 7a_100000058672_200025704644 [0,2,0,0,0,0|0,0,0]=2 1918 B14R2.1131 Cc1ccc(c2c1nccc2)N[13CH3] 34a_100000736242_200025704644 [0,2,0,0,0,0|1,0,0]=3 1919 B14R2.1131 Cc1ccc(c2c1nccc2)S[13CH3] 62a_200025704644_100000694312 [0,2,0,0,0,0|1,0,0]=3 1920 B14R2.1131 N#Cc1ccc(c2c1cccc2)O 271570a_203496583355_100012344970 [0,2,0,0,0,0|1,0,0]=3 1921 B14R2.1131 N#Cc1ccc(c2c1nccc2)O 271570a_203496583355_100012663090 [0,2,0,0,0,0|1,0,0]=3 1922 B14R2.1131 N#Cc1cnc(c2c1cccc2)O 271570a_203496583355_100009870299 [0,2,0,0,0,0|2,0,0]=4 1923 B14R2.1131 N#Cc1ncc(c2c1cccc2)O 271570a_203496583355_200010239770 [0,2,0,0,0,0|2,0,0]=4 1924 B14R2.1131 NCc1ccc(c2c1cccc2)O 271570a_203496583355_100016995114 [0,2,0,0,0,0|1,0,0]=3 1925 B14R2.1131 O=Cc1ccc(c2c1cccc2)O 271570a_203496583355_100012359940 [0,2,0,0,0,0|1,0,0]=3 1926 B14R2.1131 O=Cc1ccc(c2c1nccc2)O 271570a_203496583355_100000694311 [0,2,0,0,0,0|0,0,1]=3 1927 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)Br 34a_100000766797_200025704644 [0,2,0,0,0,0|2,0,0]=4 1928 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)Cl 34a_100011216319_200025704644 [0,2,0,0,0,0|2,0,0]=4 1929 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)F 34a_100011988692_200025704644 [0,2,0,0,0,0|2,0,0]=4 1930 B14R2.1131 [13CH3]Nc1ccc(c2c1cccc2)O 34a_100000705857_200025704644 [0,2,0,0,0,0|1,0,0]=3 1931 B14R2.1131 [13CH3]Nc1ccc(c2c1cccn2)Br 34a_100012360041_200025704644 [0,2,0,0,0,0|1,0,0]=3 1932 B14R2.1131 [13CH3]Nc1ccc(c2c1cccn2)Cl 34a_100000746469_200025704644 [0,2,0,0,0,0|1,0,0]=3 1933 B14R2.1131 [13CH3]Nc1ccc(c2c1cccn2)F 34a_102125277280_200025704644 [0,2,0,0,0,0|1,0,0]=3 1934 B14R2.1131 [13CH3]Nc1ccc(c2c1cccn2)O 34a_100000188197_200025704644 [0,2,0,0,0,0|0,0,0]=2 1935 B14R2.1131 [13CH3]Nc1ccc(c2c1nccc2)Br 34a_100000726955_200025704644 [0,2,0,0,0,0|1,0,0]=3 1936 B14R2.1131 [13CH3]Nc1ccc(c2c1nccc2)Cl 34a_100000736140_200025704644 [0,2,0,0,0,0|1,0,0]=3 1937 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Br 34a_100000186334_200025704644 [0,2,0,0,0,0|1,0,0]=3 1938 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Br 7a_100000186334_200025704644 [0,2,0,0,0,0|1,0,0]=3 1939 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Cl 34a_100000211000_200025704644 [0,2,0,0,0,0|1,0,0]=3 1940 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)Cl 7a_100000211000_200025704644 [0,2,0,0,0,0|1,0,0]=3 1941 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)F 34a_100000100223_200025704644 [0,2,0,0,0,0|1,0,0]=3 1942 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)F 7a_100000100223_200025704644 [0,2,0,0,0,0|1,0,0]=3 1943 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)N 34a_100000705857_200025704644 [0,2,0,0,0,0|1,0,0]=3 1944 B14R2.1131 [13CH3]Oc1ccc(c2c1cccc2)N 7a_100000705857_200025704644 [0,2,0,0,0,0|1,0,0]=3 1945 B14R2.1131 [13CH3]Oc1ccc(c2c1nccc2)Br 34a_100011934063_200025704644 [0,2,0,0,0,0|0,0,0]=2 1946 B14R2.1131 [13CH3]Oc1ccc(c2c1nccc2)Br 7a_100011934063_200025704644 [0,2,0,0,0,0|0,0,0]=2 1947 B14R2.1131 [13CH3]Oc1ccc(c2c1nccc2)Cl 34a_100000212186_200025704644 [0,2,0,0,0,0|0,0,0]=2 1948 B14R2.1131 [13CH3]Oc1ccc(c2c1nccc2)Cl 7a_100000212186_200025704644 [0,2,0,0,0,0|0,0,0]=2 1949 B14R2.1131 [13CH3]Oc1ccc(c2c1nccc2)F 34a_100000034212_200025704644 [0,2,0,0,0,0|0,0,0]=2 1950 B14R2.1131 [13CH3]Oc1ccc(c2c1nccc2)F 7a_100000034212_200025704644 [0,2,0,0,0,0|0,0,0]=2 1951 B14R2.1131 [13CH3]Oc1ccc(c2c1nccc2)N 34a_100000188197_200025704644 [0,2,0,0,0,0|0,0,0]=2 1952 B14R2.1131 [13CH3]Oc1cnc(c2c1cccc2)Cl 34a_100000067196_200025704644 [0,2,0,0,0,0|2,0,0]=4 1953 B14R2.1131 [13CH3]Oc1cnc(c2c1cccc2)Cl 7a_100000067196_200025704644 [0,2,0,0,0,0|2,0,0]=4 1954 B14R2.1131 [13CH3]Sc1c[nH]c(=O)c2c1nccc2 62a_200025704644_100009998689 [0,2,0,0,0,0|1,1,0]=4 1955 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)Br 62a_100012339872_200025704644 [0,2,0,0,0,0|1,1,0]=4 1956 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)Br 62a_200025704644_100012339872 [0,2,0,0,0,0|1,1,0]=4 1957 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)F 62a_100011218216_200025704644 [0,2,0,0,0,0|1,1,0]=4 1958 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)F 62a_200025704644_100011218216 [0,2,0,0,0,0|1,1,0]=4 1959 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)N 62a_100000766797_200025704644 [0,2,0,0,0,0|1,1,0]=4 1960 B14R2.1131 [13CH3]Sc1ccc(c2c1cccc2)O 62a_200025704644_100000186334 [0,2,0,0,0,0|1,0,0]=3 1961 B14R2.1131 [13CH3]Sc1ccc(c2c1cccn2)F 62a_100010245834_200025704644 [0,2,0,0,0,0|1,0,0]=3 1962 B14R2.1131 [13CH3]Sc1ccc(c2c1cccn2)F 62a_200025704644_100010245834 [0,2,0,0,0,0|1,0,0]=3 1963 B14R2.1131 [13CH3]Sc1ccc(c2c1cccn2)N 62a_100000726955_200025704644 [0,2,0,0,0,0|1,0,0]=3 1964 B14R2.1131 [13CH3]Sc1ccc(c2c1cccn2)N 62a_200025704644_100000726955 [0,2,0,0,0,0|1,0,0]=3 1965 B14R2.1131 [13CH3]Sc1ccc(c2c1cccn2)O 62a_200025704644_100011934063 [0,2,0,0,0,0|0,0,0]=2 1966 B14R2.1131 [13CH3]Sc1ccc(c2c1nccc2)F 62a_100010214461_200025704644 [0,2,0,0,0,0|0,1,0]=3 1967 B14R2.1131 [13CH3]Sc1ccc(c2c1nccc2)F 62a_200025704644_100010214461 [0,2,0,0,0,0|0,1,0]=3 1968 B14R2.1131 [13CH3]Sc1ccc(c2c1nccc2)N 62a_100012360041_200025704644 [0,2,0,0,0,0|0,1,0]=3 1969 B14R2.1131 [13CH3]Sc1ccc(c2c1nccc2)N 62a_200025704644_100012360041 [0,2,0,0,0,0|0,1,0]=3 1970 B14R2.1131 [13CH3]Sc1cnc(c2c1cccc2)O 62a_200025704644_100009816523 [0,2,0,0,0,0|2,0,0]=4 1971 B14R2.1131 [13CH3]Sc1cnc(c2c1nccc2)Cl 62a_200025704644_200010218400 [0,2,0,0,0,0|1,1,0]=4 1972 B14R2.1131 [13CH3]Sc1cnc(c2c1nccc2)N 62a_100010383929_200025704644 [0,2,0,0,0,0|1,1,0]=4 1973 B14R2.1131 [13CH3]Sc1cnc(c2c1nccc2)N 62a_200025704644_100010383929 [0,2,0,0,0,0|1,1,0]=4 1974 B14R2.1131 [13CH3]Sc1ncc(c2c1cccc2)O 62a_200025704644_100000067196 [0,2,0,0,0,0|2,0,0]=4 1975 B14R2.1073 C=Cc1ccnc2c1ncc(c2)F 271570a_100011290941_100011072215 [0,2,0,0,0,0|2,0,0]=4 1976 B14R2.1073 CNc1cccc2c1ccc(c2)Br 34a_100010090037_200000210301 [0,2,0,0,0,0|2,0,0]=4 1977 B14R2.1073 CNc1cccc2c1ccc(c2)O 34a_100000034668_200000210301 [0,2,0,0,0,0|2,0,0]=4 1978 B14R2.1073 CNc1cccc2c1ncc(c2)Br 34a_100000702407_200000210301 [0,2,0,0,0,0|1,0,0]=3 1979 B14R2.1073 CNc1ccnc2c1ncc(c2)F 27a_100102657272_100011072215 [0,2,0,0,0,0|2,0,0]=4 1980 B14R2.1073 COc1cccc2c1ccc(c2)Br 34a_100010202202_200000210301 [0,2,0,0,0,0|1,0,0]=3 1981 B14R2.1073 COc1cccc2c1ccc(c2)Br 7a_100010202202_200000210301 [0,2,0,0,0,0|1,0,0]=3 1982 B14R2.1073 COc1cccc2c1ccc(c2)F 34a_100009846233_200000210301 [0,2,0,0,0,0|1,0,0]=3 1983 B14R2.1073 COc1cccc2c1ccc(c2)F 7a_100009846233_200000210301 [0,2,0,0,0,0|1,0,0]=3 1984 B14R2.1073 COc1cccc2c1ccc(c2)N 34a_100000035793_200000210301 [0,2,0,0,0,0|1,0,0]=3 1985 B14R2.1073 COc1cccc2c1ccc(n2)O 271570a_203496583355_100010382897 [0,2,0,0,0,0|2,0,0]=4 1986 B14R2.1073 COc1cccc2c1ncc(c2)C 34a_100000144662_200000210301 [0,2,0,0,0,0|0,0,0]=2 1987 B14R2.1073 COc1cccc2c1ncc(c2)C 7a_100000144662_200000210301 [0,2,0,0,0,0|0,0,0]=2 1988 B14R2.1073 COc1cccc2c1ncc(c2)Cl 34a_100009858588_200000210301 [0,2,0,0,0,0|0,0,0]=2 1989 B14R2.1073 COc1cccc2c1ncc(c2)Cl 7a_100009858588_200000210301 [0,2,0,0,0,0|0,0,0]=2 1990 B14R2.1073 COc1cccc2c1ncc(n2)O 271570a_203496583355_100010890105 [0,2,0,0,0,0|1,0,0]=3 1991 B14R2.1073 COc1ccnc2c1ccc(c2)Cl 34a_100011215206_200000210301 [0,2,0,0,0,0|2,0,0]=4 1992 B14R2.1073 COc1ccnc2c1ccc(c2)F 34a_100000004115_200000210301 [0,2,0,0,0,0|2,0,0]=4 1993 B14R2.1073 COc1ccnc2c1ccc(c2)O 271570a_203496583355_100010204255 [0,2,0,0,0,0|2,0,0]=4 1994 B14R2.1073 COc1nccc2c1ccc(c2)Br 34a_100000760485_200000210301 [0,2,0,0,0,0|2,0,0]=4 1995 B14R2.1073 COc1nccc2c1ncc(c2)Br 34a_100010117065_200000210301 [0,2,0,0,0,0|1,0,0]=3 1996 B14R2.1073 CSc1ccnc2c1ncc(c2)F 62a_100011072215_200000210301 [0,2,0,0,0,0|1,1,0]=4 1997 B14R2.1073 CSc1ccnc2c1ncc(c2)F 62a_200000210301_100011072215 [0,2,0,0,0,0|1,1,0]=4 1998 B14R2.1073 Cc1cnc2c(cccc2c1)O[13CH3] 34a_100000144662_200025704644 [0,2,0,0,0,0|0,0,0]=2 1999 B14R2.1073 Cc1cnc2c(cccc2c1)O[13CH3] 7a_100000144662_200025704644 [0,2,0,0,0,0|0,0,0]=2 2000 B14R2.1073 [13CH3]Nc1cccc2c1ccc(c2)Br 34a_100010090037_200025704644 [0,2,0,0,0,0|2,0,0]=4 2001 B14R2.1073 [13CH3]Nc1cccc2c1ccc(c2)O 34a_100000034668_200025704644 [0,2,0,0,0,0|2,0,0]=4 2002 B14R2.1073 [13CH3]Nc1cccc2c1ncc(c2)Br 34a_100000702407_200025704644 [0,2,0,0,0,0|1,0,0]=3 2003 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)Br 34a_100010202202_200025704644 [0,2,0,0,0,0|1,0,0]=3 2004 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)Br 7a_100010202202_200025704644 [0,2,0,0,0,0|1,0,0]=3 2005 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)F 34a_100009846233_200025704644 [0,2,0,0,0,0|1,0,0]=3 2006 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)F 7a_100009846233_200025704644 [0,2,0,0,0,0|1,0,0]=3 2007 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)N 34a_100000035793_200025704644 [0,2,0,0,0,0|1,0,0]=3 2008 B14R2.1073 [13CH3]Oc1cccc2c1ncc(c2)Cl 34a_100009858588_200025704644 [0,2,0,0,0,0|0,0,0]=2 2009 B14R2.1073 [13CH3]Oc1cccc2c1ncc(c2)Cl 7a_100009858588_200025704644 [0,2,0,0,0,0|0,0,0]=2 2010 B14R2.1073 [13CH3]Oc1ccnc2c1ccc(c2)Cl 34a_100011215206_200025704644 [0,2,0,0,0,0|2,0,0]=4 2011 B14R2.1073 [13CH3]Oc1ccnc2c1ccc(c2)F 34a_100000004115_200025704644 [0,2,0,0,0,0|2,0,0]=4 2012 B14R2.1073 [13CH3]Oc1nccc2c1ccc(c2)Br 34a_100000760485_200025704644 [0,2,0,0,0,0|2,0,0]=4 2013 B14R2.1073 [13CH3]Oc1nccc2c1ncc(c2)Br 34a_100010117065_200025704644 [0,2,0,0,0,0|1,0,0]=3 2014 B14R2.1073 [13CH3]Sc1ccnc2c1ncc(c2)F 62a_100011072215_200025704644 [0,2,0,0,0,0|1,1,0]=4 2015 B14R2.1073 [13CH3]Sc1ccnc2c1ncc(c2)F 62a_200025704644_100011072215 [0,2,0,0,0,0|1,1,0]=4 2016 B14R2.7150 C=C=Cc1cccc2c1cccc2 271570a_100015277604_100000210605 [0,2,0,0,0,0|2,0,0]=4 2017 B14R2.7150 C=C=Cc1cccc2c1nccc2 271570a_100015277604_100011215545 [0,2,0,0,0,0|1,0,0]=3 2018 B14R2.7150 C=C=Cc1cccc2c1nccn2 271570a_100015277604_100010003881 [0,2,0,0,0,0|2,0,0]=4 2019 B14R2.7150 C=C=Cc1cccc2c1ncnc2 271570a_100015277604_100010246313 [0,2,0,0,0,0|2,0,0]=4 2020 B14R2.7150 C=C=Cc1nccc2c1nccc2 271570a_100015277604_100010063729 [0,2,0,0,0,0|2,0,0]=4 2021 B14R2.7150 CC=Cc1cccc2c1cccc2 271570a_100016259895_100000210605 [0,2,0,0,0,0|2,0,0]=4 2022 B14R2.7150 CC=Cc1cccc2c1nccc2 271570a_100016259895_100011215545 [0,2,0,0,0,0|1,0,0]=3 2023 B14R2.7150 CC=Cc1cccc2c1nccn2 271570a_100016259895_100010003881 [0,2,0,0,0,0|2,0,0]=4 2024 B14R2.7150 CC=Cc1cccc2c1ncnc2 271570a_100016259895_100010246313 [0,2,0,0,0,0|2,0,0]=4 2025 B14R2.7150 CC=Cc1nccc2c1nccc2 271570a_100016259895_100010063729 [0,2,0,0,0,0|2,0,0]=4 2026 B14R2.7150 CCNc1cccc2c1cccc2 34a_100000185869_100000210202 [0,2,0,0,0,0|2,0,0]=4 2027 B14R2.7150 CCNc1cccc2c1nccc2 34a_100000181377_100000210202 [0,2,0,0,0,0|1,0,0]=3 2028 B14R2.7150 CCNc1cccc2c1nccn2 27a_100015525214_100010003881 [0,2,0,0,0,0|2,0,0]=4 2029 B14R2.7150 CCNc1cccc2c1ncnc2 27a_100015525214_100010246313 [0,2,0,0,0,0|2,0,0]=4 2030 B14R2.7150 CCNc1nccc2c1nccc2 27a_100015525214_100010063729 [0,2,0,0,0,0|2,0,0]=4 2031 B14R2.7150 CCOc1cccc2c1CC=CC2 34a_100000074931_100000210202 [0,2,0,0,0,0|1,0,1]=4 2032 B14R2.7150 CCOc1cccc2c1CC=CC2 7a_100000074931_100000210202 [0,2,0,0,0,0|1,0,1]=4 2033 B14R2.7150 CCOc1cccc2c1cccc2 34a_100000210388_100000210202 [0,2,0,0,0,0|1,0,0]=3 2034 B14R2.7150 CCOc1cccc2c1cccc2 7a_100000210388_100000210202 [0,2,0,0,0,0|1,0,0]=3 2035 B14R2.7150 CCOc1cccc2c1cccn2 34a_100011197808_100000210202 [0,2,0,0,0,0|2,0,0]=4 2036 B14R2.7150 CCOc1cccc2c1ccnc2 34a_100011218533_100000210202 [0,2,0,0,0,0|2,0,0]=4 2037 B14R2.7150 CCOc1cccc2c1cncc2 34a_103624766955_100000210202 [0,2,0,0,0,0|2,0,0]=4 2038 B14R2.7150 CCOc1cccc2c1nccc2 34a_100000056035_100000210202 [0,2,0,0,0,0|0,0,0]=2 2039 B14R2.7150 CCOc1cccc2c1nccn2 34a_100000077048_100000210202 [0,2,0,0,0,0|1,0,0]=3 2040 B14R2.7150 CCOc1cccc2c1ncnc2 34a_200000077003_100000210202 [0,2,0,0,0,0|1,0,0]=3 2041 B14R2.7150 CCOc1cncc2c1cccc2 34a_100000066178_100000210202 [0,2,0,0,0,0|2,0,0]=4 2042 B14R2.7150 CCOc1cncc2c1cccc2 7a_100000066178_100000210202 [0,2,0,0,0,0|2,0,0]=4 2043 B14R2.7150 CCOc1nccc2c1cccc2 34a_102531767632_100000210202 [0,2,0,0,0,0|2,0,0]=4 2044 B14R2.7150 CCSc1cccc2c1cccc2 62a_100000210202_100000210605 [0,2,0,0,0,0|1,1,0]=4 2045 B14R2.7150 CCSc1cccc2c1nccc2 62a_100000210202_100011215545 [0,2,0,0,0,0|0,1,0]=3 2046 B14R2.7150 CCSc1cccc2c1nccn2 62a_100000210202_100010003881 [0,2,0,0,0,0|1,1,0]=4 2047 B14R2.7150 CCSc1cccc2c1nccn2 62a_100010003881_100000210202 [0,2,0,0,0,0|1,1,0]=4 2048 B14R2.7150 CCSc1cccc2c1ncnc2 62a_100000210202_100010246313 [0,2,0,0,0,0|1,1,0]=4 2049 B14R2.7150 CCSc1cccc2c1ncnc2 62a_100010246313_100000210202 [0,2,0,0,0,0|1,1,0]=4 2050 B14R2.7150 CCSc1nccc2c1nccc2 62a_100000210202_100010063729 [0,2,0,0,0,0|1,1,0]=4 2051 B14R2.7150 CNCc1cccc2c1cccc2 207a_100102657272_100000210074 [0,2,0,0,0,0|2,0,0]=4 2052 B14R2.7150 CNCc1cccc2c1cccc2 2230a_106832991635_100011261445 [0,2,0,0,0,0|2,0,0]=4 2053 B14R2.7150 CNCc1cccc2c1cccc2 270004a_106832991635_100000210074 [0,2,0,0,0,0|2,0,0]=4 2054 B14R2.7150 CNCc1cccc2c1cccc2 34a_100000753325_200000210301 [0,2,0,0,0,0|2,0,0]=4 2055 B14R2.7150 CNCc1cccc2c1cccc2 34a_100102657272_100011261445 [0,2,0,0,0,0|2,0,0]=4 2056 B14R2.7150 CNCc1cccc2c1cccc2 7a_106832991635_100011261445 [0,2,0,0,0,0|2,0,0]=4 2057 B14R2.7150 CNCc1cccc2c1nccc2 207a_100102657272_100000239888 [0,2,0,0,0,0|1,0,0]=3 2058 B14R2.7150 CNCc1cccc2c1nccc2 2230a_106832991635_100000241032 [0,2,0,0,0,0|1,0,0]=3 2059 B14R2.7150 CNCc1cccc2c1nccc2 270004a_106832991635_100000239888 [0,2,0,0,0,0|1,0,0]=3 2060 B14R2.7150 CNCc1cccc2c1nccc2 34a_100102657272_100000241032 [0,2,0,0,0,0|1,0,0]=3 2061 B14R2.7150 CNCc1cccc2c1nccc2 7a_106832991635_100000241032 [0,2,0,0,0,0|1,0,0]=3 2062 B14R2.7150 CNCc1cccc2c1nccn2 270004a_106832991635_100011996249 [0,2,0,0,0,0|2,0,0]=4 2063 B14R2.7150 COCc1cccc2c1cccc2 34a_100011216843_200000210301 [0,2,0,0,0,0|1,0,0]=3 2064 B14R2.7150 COCc1cccc2c1cccc2 34a_100138415774_100011261445 [0,2,0,0,0,0|1,0,0]=3 2065 B14R2.7150 COCc1cccc2c1cccc2 7a_100011216843_200000210301 [0,2,0,0,0,0|1,0,0]=3 2066 B14R2.7150 COCc1cccc2c1cccn2 34a_100000709871_200000210301 [0,2,0,0,0,0|2,0,0]=4 2067 B14R2.7150 COCc1cccc2c1ccnc2 34a_100138415774_100016989825 [0,2,0,0,0,0|2,0,0]=4 2068 B14R2.7150 COCc1cccc2c1nccc2 34a_100011303629_200000210301 [0,2,0,0,0,0|0,0,0]=2 2069 B14R2.7150 COCc1cccc2c1nccc2 34a_100138415774_100000241032 [0,2,0,0,0,0|0,0,0]=2 2070 B14R2.7150 COCc1ccnc2c1cccc2 34a_100138415774_100015192512 [0,2,0,0,0,0|2,0,0]=4 2071 B14R2.7150 COCc1nccc2c1cccc2 34a_100138415774_100000033776 [0,2,0,0,0,0|2,0,0]=4 2072 B14R2.7150 CSCc1cccc2c1cccc2 62a_100011261445_200000210301 [0,2,0,0,0,0|1,1,0]=4 2073 B14R2.7150 CSCc1cccc2c1cccc2 62a_200000210301_100000188474 [0,2,0,0,0,0|1,1,0]=4 2074 B14R2.7150 CSCc1cccc2c1nccc2 62a_200000210301_100000241032 [0,2,0,0,0,0|0,1,0]=3 2075 B14R2.7150 FCNc1cccc2c1cccc2 34a_100000185869_100015361967 [0,2,0,0,0,0|2,0,0]=4 2076 B14R2.7150 FCNc1cccc2c1nccc2 34a_100000181377_100015361967 [0,2,0,0,0,0|1,0,0]=3 2077 B14R2.7150 FCOc1cccc2c1CC=CC2 34a_100000074931_100015361967 [0,2,0,0,0,0|1,0,1]=4 2078 B14R2.7150 FCOc1cccc2c1CC=CC2 7a_100000074931_100015361967 [0,2,0,0,0,0|1,0,1]=4 2079 B14R2.7150 FCOc1cccc2c1cccc2 34a_100000210388_100015361967 [0,2,0,0,0,0|1,0,0]=3 2080 B14R2.7150 FCOc1cccc2c1cccc2 7a_100000210388_100015361967 [0,2,0,0,0,0|1,0,0]=3 2081 B14R2.7150 FCOc1cccc2c1cccn2 34a_100011197808_100015361967 [0,2,0,0,0,0|2,0,0]=4 2082 B14R2.7150 FCOc1cccc2c1ccnc2 34a_100011218533_100015361967 [0,2,0,0,0,0|2,0,0]=4 2083 B14R2.7150 FCOc1cccc2c1cncc2 34a_103624766955_100015361967 [0,2,0,0,0,0|2,0,0]=4 2084 B14R2.7150 FCOc1cccc2c1nccc2 34a_100000056035_100015361967 [0,2,0,0,0,0|0,0,0]=2 2085 B14R2.7150 FCOc1cccc2c1nccn2 34a_100000077048_100015361967 [0,2,0,0,0,0|1,0,0]=3 2086 B14R2.7150 FCOc1cccc2c1ncnc2 34a_200000077003_100015361967 [0,2,0,0,0,0|1,0,0]=3 2087 B14R2.7150 FCOc1cncc2c1cccc2 34a_100000066178_100015361967 [0,2,0,0,0,0|2,0,0]=4 2088 B14R2.7150 FCOc1cncc2c1cccc2 7a_100000066178_100015361967 [0,2,0,0,0,0|2,0,0]=4 2089 B14R2.7150 FCOc1nccc2c1cccc2 34a_102531767632_100015361967 [0,2,0,0,0,0|2,0,0]=4 2090 B14R2.7150 FCSc1cccc2c1cccc2 62a_100015361967_100000210605 [0,2,0,0,0,0|1,1,0]=4 2091 B14R2.7150 FCSc1cccc2c1nccc2 62a_100015361967_100011215545 [0,2,0,0,0,0|0,1,0]=3 2092 B14R2.7150 FCSc1cccc2c1nccn2 62a_100010003881_100015361967 [0,2,0,0,0,0|1,1,0]=4 2093 B14R2.7150 FCSc1cccc2c1nccn2 62a_100015361967_100010003881 [0,2,0,0,0,0|1,1,0]=4 2094 B14R2.7150 FCSc1cccc2c1ncnc2 62a_100010246313_100015361967 [0,2,0,0,0,0|1,1,0]=4 2095 B14R2.7150 FCSc1cccc2c1ncnc2 62a_100015361967_100010246313 [0,2,0,0,0,0|1,1,0]=4 2096 B14R2.7150 FCSc1nccc2c1nccc2 62a_100015361967_100010063729 [0,2,0,0,0,0|1,1,0]=4 2097 B14R2.7150 [13CH3]NCc1cccc2c1cccc2 34a_100000753325_200025704644 [0,2,0,0,0,0|2,0,0]=4 2098 B14R2.7150 [13CH3]OCc1cccc2c1cccc2 34a_100011216843_200025704644 [0,2,0,0,0,0|1,0,0]=3 2099 B14R2.7150 [13CH3]OCc1cccc2c1cccc2 7a_100011216843_200025704644 [0,2,0,0,0,0|1,0,0]=3 2100 B14R2.7150 [13CH3]OCc1cccc2c1cccn2 34a_100000709871_200025704644 [0,2,0,0,0,0|2,0,0]=4 2101 B14R2.7150 [13CH3]OCc1cccc2c1nccc2 34a_100011303629_200025704644 [0,2,0,0,0,0|0,0,0]=2 2102 B14R2.7150 [13CH3]SCc1cccc2c1cccc2 62a_100011261445_200025704644 [0,2,0,0,0,0|1,1,0]=4 2103 B14R2.7150 [13CH3]SCc1cccc2c1cccc2 62a_200025704644_100000188474 [0,2,0,0,0,0|1,1,0]=4 2104 B14R2.7150 [13CH3]SCc1cccc2c1nccc2 62a_200025704644_100000241032 [0,2,0,0,0,0|0,1,0]=3 2105 B14R2.11635 C=Cc1cccc2c1c(ccc2)Br 271570a_100011290941_100010243825 [0,2,0,0,0,0|2,0,0]=4 2106 B14R2.11635 C=Cc1cccc2c1c(ccc2)C 271570a_100011290941_100009995290 [0,2,0,0,0,0|2,0,0]=4 2107 B14R2.11635 C=Cc1cccc2c1c(ccc2)F 271570a_100011290941_100010177852 [0,2,0,0,0,0|2,0,0]=4 2108 B14R2.11635 C=Cc1cccc2c1c(ccc2)N 271570a_100011290941_100010002837 [0,2,0,0,0,0|2,0,0]=4 2109 B14R2.11635 C=Cc1cccc2c1c(ccc2)O 271570a_100011290941_100010089961 [0,2,0,0,0,0|1,0,0]=3 2110 B14R2.11635 C=Cc1cccc2c1c(ccn2)O 271570a_100011290941_100010187735 [0,2,0,0,0,0|2,0,0]=4 2111 B14R2.11635 C=Cc1cccc2c1c(ncc2)O 271570a_100011290941_100010162479 [0,2,0,0,0,0|2,0,0]=4 2112 B14R2.11635 CCc1cccc2c1c(ccc2)O 271570a_203496583355_202517441601 [0,2,0,0,0,0|1,0,0]=3 2113 B14R2.11635 CNc1cccc2c1[n+](ccc2)[O-] 34a_200000070183_200000210301 [0,2,0,0,0,0|1,0,1]=4 2114 B14R2.11635 CNc1cccc2c1c(ccc2)Br 34a_100010002837_200000210301 [0,2,0,0,0,0|2,0,0]=4 2115 B14R2.11635 CNc1cccc2c1c(ccc2)C 34a_100009841044_200000210301 [0,2,0,0,0,0|2,0,0]=4 2116 B14R2.11635 CNc1cccc2c1c(ccc2)C 7a_100009841044_200000210301 [0,2,0,0,0,0|2,0,0]=4 2117 B14R2.11635 CNc1cccc2c1c(ccc2)Cl 34a_100009857565_200000210301 [0,2,0,0,0,0|2,0,0]=4 2118 B14R2.11635 CNc1cccc2c1c(ccc2)F 34a_100009878580_200000210301 [0,2,0,0,0,0|2,0,0]=4 2119 B14R2.11635 CNc1cccc2c1c(ccc2)F 7a_100009878580_200000210301 [0,2,0,0,0,0|2,0,0]=4 2120 B14R2.11635 COc1cccc2c1[n+](ccc2)[O-] 34a_100000039631_200000210301 [0,2,0,0,0,0|0,0,1]=3 2121 B14R2.11635 COc1cccc2c1[n+](ccc2)[O-] 7a_100000039631_200000210301 [0,2,0,0,0,0|0,0,1]=3 2122 B14R2.11635 COc1cccc2c1c(=O)[nH]cc2 34a_200010358299_200000210301 [0,2,0,0,0,0|2,0,0]=4 2123 B14R2.11635 COc1cccc2c1c(=O)[nH]cc2 7a_200010358299_200000210301 [0,2,0,0,0,0|2,0,0]=4 2124 B14R2.11635 COc1cccc2c1c(=O)cco2 34a_100000040341_200000210301 [0,2,0,0,0,0|2,0,0]=4 2125 B14R2.11635 COc1cccc2c1c(=O)cco2 7a_100000040341_200000210301 [0,2,0,0,0,0|2,0,0]=4 2126 B14R2.11635 COc1cccc2c1c(ccc2)Br 34a_100010089961_200000210301 [0,2,0,0,0,0|1,0,0]=3 2127 B14R2.11635 COc1cccc2c1c(ccc2)Br 7a_100010089961_200000210301 [0,2,0,0,0,0|1,0,0]=3 2128 B14R2.11635 COc1cccc2c1c(ccc2)O 271570a_203496583355_100010152499 [0,2,0,0,0,0|1,0,0]=3 2129 B14R2.11635 COc1cccc2c1c(ccn2)O 271570a_203496583355_100010204250 [0,2,0,0,0,0|2,0,0]=4 2130 B14R2.11635 COc1ccnc2c1c(ccc2)Br 34a_100010187735_200000210301 [0,2,0,0,0,0|2,0,0]=4 2131 B14R2.11635 COc1ccnc2c1c(ccc2)C 34a_100000087318_200000210301 [0,2,0,0,0,0|2,0,0]=4 2132 B14R2.11635 COc1nccc2c1c(ccc2)Br 34a_100010162479_200000210301 [0,2,0,0,0,0|2,0,0]=4 2133 B14R2.11635 COc1nccc2c1c(ccc2)Cl 34a_200010297299_200000210301 [0,2,0,0,0,0|2,0,0]=4 2134 B14R2.11635 CSc1cccc2c1c(ccc2)Br 62a_100010243825_200000210301 [0,2,0,0,0,0|1,1,0]=4 2135 B14R2.11635 CSc1cccc2c1c(ccc2)Br 62a_200000210301_100010243825 [0,2,0,0,0,0|1,1,0]=4 2136 B14R2.11635 CSc1cccc2c1c(ccc2)C 62a_200000210301_100009995290 [0,2,0,0,0,0|1,1,0]=4 2137 B14R2.11635 CSc1cccc2c1c(ccc2)F 62a_100010177852_200000210301 [0,2,0,0,0,0|1,1,0]=4 2138 B14R2.11635 CSc1cccc2c1c(ccc2)F 62a_200000210301_100010177852 [0,2,0,0,0,0|1,1,0]=4 2139 B14R2.11635 CSc1cccc2c1c(ccc2)N 62a_100010002837_200000210301 [0,2,0,0,0,0|1,1,0]=4 2140 B14R2.11635 CSc1cccc2c1c(ccc2)O 62a_200000210301_100010089961 [0,2,0,0,0,0|1,0,0]=3 2141 B14R2.11635 CSc1cccc2c1c(ncc2)O 62a_200000210301_100010162479 [0,2,0,0,0,0|2,0,0]=4 2142 B14R2.11635 Cc1cccc2c1c(ccc2)N[13CH3] 34a_100009841044_200025704644 [0,2,0,0,0,0|2,0,0]=4 2143 B14R2.11635 Cc1cccc2c1c(ccc2)N[13CH3] 7a_100009841044_200025704644 [0,2,0,0,0,0|2,0,0]=4 2144 B14R2.11635 Cc1cccc2c1c(ccc2)S[13CH3] 62a_200025704644_100009995290 [0,2,0,0,0,0|1,1,0]=4 2145 B14R2.11635 Cc1cccc2c1c(ccn2)O[13CH3] 34a_100000087318_200025704644 [0,2,0,0,0,0|2,0,0]=4 2146 B14R2.11635 N#Cc1cccc2c1c(ccc2)O 271570a_203496583355_200010152326 [0,2,0,0,0,0|1,0,0]=3 2147 B14R2.11635 OCc1cccc2c1c(ccc2)O 271570a_203496583355_200009814114 [0,2,0,0,0,0|1,0,0]=3 2148 B14R2.11635 [13CH3]Nc1cccc2c1[n+](ccc2)[O-] 34a_200000070183_200025704644 [0,2,0,0,0,0|1,0,1]=4 2149 B14R2.11635 [13CH3]Nc1cccc2c1c(ccc2)Br 34a_100010002837_200025704644 [0,2,0,0,0,0|2,0,0]=4 2150 B14R2.11635 [13CH3]Nc1cccc2c1c(ccc2)Cl 34a_100009857565_200025704644 [0,2,0,0,0,0|2,0,0]=4 2151 B14R2.11635 [13CH3]Nc1cccc2c1c(ccc2)F 34a_100009878580_200025704644 [0,2,0,0,0,0|2,0,0]=4 2152 B14R2.11635 [13CH3]Nc1cccc2c1c(ccc2)F 7a_100009878580_200025704644 [0,2,0,0,0,0|2,0,0]=4 2153 B14R2.11635 [13CH3]Oc1cccc2c1[n+](ccc2)[O-] 34a_100000039631_200025704644 [0,2,0,0,0,0|0,0,1]=3 2154 B14R2.11635 [13CH3]Oc1cccc2c1[n+](ccc2)[O-] 7a_100000039631_200025704644 [0,2,0,0,0,0|0,0,1]=3 2155 B14R2.11635 [13CH3]Oc1cccc2c1c(=O)[nH]cc2 34a_200010358299_200025704644 [0,2,0,0,0,0|2,0,0]=4 2156 B14R2.11635 [13CH3]Oc1cccc2c1c(=O)[nH]cc2 7a_200010358299_200025704644 [0,2,0,0,0,0|2,0,0]=4 2157 B14R2.11635 [13CH3]Oc1cccc2c1c(=O)cco2 34a_100000040341_200025704644 [0,2,0,0,0,0|2,0,0]=4 2158 B14R2.11635 [13CH3]Oc1cccc2c1c(=O)cco2 7a_100000040341_200025704644 [0,2,0,0,0,0|2,0,0]=4 2159 B14R2.11635 [13CH3]Oc1cccc2c1c(ccc2)Br 34a_100010089961_200025704644 [0,2,0,0,0,0|1,0,0]=3 2160 B14R2.11635 [13CH3]Oc1cccc2c1c(ccc2)Br 7a_100010089961_200025704644 [0,2,0,0,0,0|1,0,0]=3 2161 B14R2.11635 [13CH3]Oc1ccnc2c1c(ccc2)Br 34a_100010187735_200025704644 [0,2,0,0,0,0|2,0,0]=4 2162 B14R2.11635 [13CH3]Oc1nccc2c1c(ccc2)Br 34a_100010162479_200025704644 [0,2,0,0,0,0|2,0,0]=4 2163 B14R2.11635 [13CH3]Oc1nccc2c1c(ccc2)Cl 34a_200010297299_200025704644 [0,2,0,0,0,0|2,0,0]=4 2164 B14R2.11635 [13CH3]Sc1cccc2c1c(ccc2)Br 62a_100010243825_200025704644 [0,2,0,0,0,0|1,1,0]=4 2165 B14R2.11635 [13CH3]Sc1cccc2c1c(ccc2)Br 62a_200025704644_100010243825 [0,2,0,0,0,0|1,1,0]=4 2166 B14R2.11635 [13CH3]Sc1cccc2c1c(ccc2)F 62a_100010177852_200025704644 [0,2,0,0,0,0|1,1,0]=4 2167 B14R2.11635 [13CH3]Sc1cccc2c1c(ccc2)F 62a_200025704644_100010177852 [0,2,0,0,0,0|1,1,0]=4 2168 B14R2.11635 [13CH3]Sc1cccc2c1c(ccc2)N 62a_100010002837_200025704644 [0,2,0,0,0,0|1,1,0]=4 2169 B14R2.11635 [13CH3]Sc1cccc2c1c(ccc2)O 62a_200025704644_100010089961 [0,2,0,0,0,0|1,0,0]=3 2170 B14R2.11635 [13CH3]Sc1cccc2c1c(ncc2)O 62a_200025704644_100010162479 [0,2,0,0,0,0|2,0,0]=4 2171 B14R2.31359 C=C(C)c1cccc2c1cccc2 271570a_100000694244_100000210605 [0,2,0,0,0,0|2,0,0]=4 2172 B14R2.31359 C=C(C)c1cccc2c1nccc2 271570a_100000694244_100011215545 [0,2,0,0,0,0|1,0,0]=3 2173 B14R2.31359 C=C(C)c1cccc2c1nccn2 271570a_100000694244_100010003881 [0,2,0,0,0,0|2,0,0]=4 2174 B14R2.31359 C=C(C)c1cccc2c1ncnc2 271570a_100000694244_100010246313 [0,2,0,0,0,0|2,0,0]=4 2175 B14R2.31359 C=C(C)c1nccc2c1nccc2 271570a_100000694244_100010063729 [0,2,0,0,0,0|2,0,0]=4 2176 B14R2.31359 CC(=O)c1cccc2c1cccc2 1458a_100000210949_200000210301 [0,2,0,0,0,0|1,0,1]=4 2177 B14R2.31359 CC(=O)c1cccc2c1nccc2 1458a_100000195423_200000210301 [0,2,0,0,0,0|0,0,1]=3 2178 B14R2.31359 CC(=O)c1cccc2c1nccn2 1458a_100000048969_200000210301 [0,2,0,0,0,0|1,0,1]=4 2179 B14R2.31359 CN(C)c1cccc2c1cccc2 2230a_100000220138_200000210301 [0,2,0,0,0,0|2,0,0]=4 2180 B14R2.31359 CN(C)c1cccc2c1cccc2 269982a_100000220138_200000210301 [0,2,0,0,0,0|2,0,0]=4 2181 B14R2.31359 CN(C)c1cccc2c1cccc2 34a_100000220138_200000210301 [0,2,0,0,0,0|2,0,0]=4 2182 B14R2.31359 CN(C)c1cccc2c1nccn2 27a_100102631434_100010003881 [0,2,0,0,0,0|2,0,0]=4 2183 B14R2.31359 CN(C)c1cccc2c1ncnc2 27a_100102631434_100010246313 [0,2,0,0,0,0|2,0,0]=4 2184 B14R2.31359 CN(C)c1nccc2c1nccc2 27a_100102631434_100010063729 [0,2,0,0,0,0|2,0,0]=4 2185 B14R2.31359 CN([13CH3])c1cccc2c1cccc2 2230a_100000220138_200025704644 [0,2,0,0,0,0|2,0,0]=4 2186 B14R2.31359 CN([13CH3])c1cccc2c1cccc2 269982a_100000220138_200025704644 [0,2,0,0,0,0|2,0,0]=4 2187 B14R2.31359 CN([13CH3])c1cccc2c1cccc2 34a_100000220138_200025704644 [0,2,0,0,0,0|2,0,0]=4 2188 B14R2.31359 [13CH3]C(=O)c1cccc2c1cccc2 1458a_100000210949_200025704644 [0,2,0,0,0,0|1,0,1]=4 2189 B14R2.31359 [13CH3]C(=O)c1cccc2c1nccc2 1458a_100000195423_200025704644 [0,2,0,0,0,0|0,0,1]=3 2190 B14R2.31359 [13CH3]C(=O)c1cccc2c1nccn2 1458a_100000048969_200025704644 [0,2,0,0,0,0|1,0,1]=4 2191 B14R2.1801 C=Cc1ccc2c(cccc2c1)N 271570a_100011290941_100010090037 [0,2,0,0,0,0|2,0,0]=4 2192 B14R2.1801 C=Cc1ccc2c(cccc2c1)O 271570a_100011290941_100010202202 [0,2,0,0,0,0|1,0,0]=3 2193 B14R2.1801 C=Cc1ccc2c(ccnc2c1)O 271570a_100011290941_100000756855 [0,2,0,0,0,0|2,0,0]=4 2194 B14R2.1801 C=Cc1ccc2c(nccc2c1)O 271570a_100011290941_100000760485 [0,2,0,0,0,0|2,0,0]=4 2195 B14R2.1801 C=Cc1cnc2c(cccc2c1)Br 271570a_100011290941_100010204298 [0,2,0,0,0,0|1,0,0]=3 2196 B14R2.1801 C=Cc1cnc2c(cccc2c1)C 271570a_100011290941_100009829671 [0,2,0,0,0,0|1,0,0]=3 2197 B14R2.1801 C=Cc1cnc2c(cccc2c1)Cl 271570a_100011290941_100000759377 [0,2,0,0,0,0|1,0,0]=3 2198 B14R2.1801 C=Cc1cnc2c(cccc2c1)F 271570a_100011290941_100000049890 [0,2,0,0,0,0|1,0,0]=3 2199 B14R2.1801 C=Cc1cnc2c(cccc2c1)N 271570a_100011290941_100000702407 [0,2,0,0,0,0|1,0,0]=3 2200 B14R2.1801 C=Cc1cnc2c(nccc2c1)O 271570a_100011290941_100010117065 [0,2,0,0,0,0|1,0,0]=3 2201 B14R2.1801 CNc1ccc2c(cccc2c1)O 34a_100000035793_200000210301 [0,2,0,0,0,0|1,0,0]=3 2202 B14R2.1801 CNc1ccc2c(cccc2c1)O 7a_100000035793_200000210301 [0,2,0,0,0,0|1,0,0]=3 2203 B14R2.1801 COc1ccc2c(cccc2c1)N 34a_100000034668_200000210301 [0,2,0,0,0,0|2,0,0]=4 2204 B14R2.1801 COc1ccc2c(cccc2c1)N 7a_100000034668_200000210301 [0,2,0,0,0,0|2,0,0]=4 2205 B14R2.1801 COc1ccc2c(cccc2c1)O 271570a_203496583355_100010151670 [0,2,0,0,0,0|1,0,0]=3 2206 B14R2.1801 COc1ccc2c(ccnc2c1)O 271570a_203496583355_100000045488 [0,2,0,0,0,0|2,0,0]=4 2207 B14R2.1801 COc1ccc2c(nccc2c1)O 271570a_203496583355_100000084302 [0,2,0,0,0,0|2,0,0]=4 2208 B14R2.1801 COc1cnc2c(cccc2c1)F 34a_100012184956_200000210301 [0,2,0,0,0,0|1,0,0]=3 2209 B14R2.1801 COc1cnc2c(cccc2c1)F 7a_100012184956_200000210301 [0,2,0,0,0,0|1,0,0]=3 2210 B14R2.1801 COc1cnc2c(ccnc2c1)O 271570a_203496583355_100009875103 [0,2,0,0,0,0|1,0,0]=3 2211 B14R2.1801 CSc1ccc2c(cccc2c1)N 62a_100010090037_200000210301 [0,2,0,0,0,0|2,0,0]=4 2212 B14R2.1801 CSc1ccc2c(cccc2c1)N 62a_200000210301_100010090037 [0,2,0,0,0,0|2,0,0]=4 2213 B14R2.1801 CSc1ccc2c(cccc2c1)O 62a_200000210301_100010202202 [0,2,0,0,0,0|1,0,0]=3 2214 B14R2.1801 CSc1ccc2c(ccnc2c1)O 62a_200000210301_100000756855 [0,2,0,0,0,0|2,0,0]=4 2215 B14R2.1801 CSc1ccc2c(nccc2c1)O 62a_200000210301_100000760485 [0,2,0,0,0,0|2,0,0]=4 2216 B14R2.1801 CSc1cnc2c(cccc2c1)Br 62a_100010204298_200000210301 [0,2,0,0,0,0|1,0,0]=3 2217 B14R2.1801 CSc1cnc2c(cccc2c1)Br 62a_200000210301_100010204298 [0,2,0,0,0,0|1,0,0]=3 2218 B14R2.1801 CSc1cnc2c(cccc2c1)C 62a_200000210301_100009829671 [0,2,0,0,0,0|1,0,0]=3 2219 B14R2.1801 CSc1cnc2c(cccc2c1)Cl 62a_200000210301_100000759377 [0,2,0,0,0,0|1,0,0]=3 2220 B14R2.1801 CSc1cnc2c(cccc2c1)F 62a_100000049890_200000210301 [0,2,0,0,0,0|1,0,0]=3 2221 B14R2.1801 CSc1cnc2c(cccc2c1)F 62a_200000210301_100000049890 [0,2,0,0,0,0|1,0,0]=3 2222 B14R2.1801 CSc1cnc2c(cccc2c1)N 62a_200000210301_100000702407 [0,2,0,0,0,0|1,0,0]=3 2223 B14R2.1801 CSc1cnc2c(nccc2c1)O 62a_200000210301_100010117065 [0,2,0,0,0,0|1,0,0]=3 2224 B14R2.1801 Cc1cccc2c1ncc(c2)S[13CH3] 62a_200025704644_100009829671 [0,2,0,0,0,0|1,0,0]=3 2225 B14R2.1801 N#Cc1ccc2c(cccc2c1)O 271570a_203496583355_100010090035 [0,2,0,0,0,0|1,0,0]=3 2226 B14R2.1801 N#Cc1ccc2c(cccc2n1)O 271570a_203496583355_100010235449 [0,2,0,0,0,0|2,0,0]=4 2227 B14R2.1801 [13CH3]Nc1ccc2c(cccc2c1)O 34a_100000035793_200025704644 [0,2,0,0,0,0|1,0,0]=3 2228 B14R2.1801 [13CH3]Nc1ccc2c(cccc2c1)O 7a_100000035793_200025704644 [0,2,0,0,0,0|1,0,0]=3 2229 B14R2.1801 [13CH3]Oc1ccc2c(cccc2c1)N 34a_100000034668_200025704644 [0,2,0,0,0,0|2,0,0]=4 2230 B14R2.1801 [13CH3]Oc1ccc2c(cccc2c1)N 7a_100000034668_200025704644 [0,2,0,0,0,0|2,0,0]=4 2231 B14R2.1801 [13CH3]Oc1cnc2c(cccc2c1)F 34a_100012184956_200025704644 [0,2,0,0,0,0|1,0,0]=3 2232 B14R2.1801 [13CH3]Oc1cnc2c(cccc2c1)F 7a_100012184956_200025704644 [0,2,0,0,0,0|1,0,0]=3 2233 B14R2.1801 [13CH3]Sc1ccc2c(cccc2c1)N 62a_100010090037_200025704644 [0,2,0,0,0,0|2,0,0]=4 2234 B14R2.1801 [13CH3]Sc1ccc2c(cccc2c1)N 62a_200025704644_100010090037 [0,2,0,0,0,0|2,0,0]=4 2235 B14R2.1801 [13CH3]Sc1ccc2c(cccc2c1)O 62a_200025704644_100010202202 [0,2,0,0,0,0|1,0,0]=3 2236 B14R2.1801 [13CH3]Sc1ccc2c(ccnc2c1)O 62a_200025704644_100000756855 [0,2,0,0,0,0|2,0,0]=4 2237 B14R2.1801 [13CH3]Sc1ccc2c(nccc2c1)O 62a_200025704644_100000760485 [0,2,0,0,0,0|2,0,0]=4 2238 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)Br 62a_100010204298_200025704644 [0,2,0,0,0,0|1,0,0]=3 2239 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)Br 62a_200025704644_100010204298 [0,2,0,0,0,0|1,0,0]=3 2240 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)Cl 62a_200025704644_100000759377 [0,2,0,0,0,0|1,0,0]=3 2241 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)F 62a_100000049890_200025704644 [0,2,0,0,0,0|1,0,0]=3 2242 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)F 62a_200025704644_100000049890 [0,2,0,0,0,0|1,0,0]=3 2243 B14R2.1801 [13CH3]Sc1cnc2c(cccc2c1)N 62a_200025704644_100000702407 [0,2,0,0,0,0|1,0,0]=3 2244 B14R2.1801 [13CH3]Sc1cnc2c(nccc2c1)O 62a_200025704644_100010117065 [0,2,0,0,0,0|1,0,0]=3 2245 B12R2.2 c1ccc(cc1)c2ccco2 271570a_100000750936_100000210277 [0,0,1,1,0,0|1,0,0]=3 2246 B12R2.2 c1ccc(cc1)c2ccco2 271570a_100011218836_100009814098 [0,0,1,1,0,0|1,0,0]=3 2247 B12R2.2 c1ccc(cc1)c2cccs2 271570a_100000742291_100000210277 [0,0,1,1,0,0|1,1,0]=4 2248 B12R2.2 c1ccc(cc1)c2cccs2 271570a_100011218836_100011215356 [0,0,1,1,0,0|1,1,0]=4 2249 B12R2.2 c1ccc(cc1)c2cnco2 271570a_100011218836_100020591547 [0,0,1,1,0,0|2,0,0]=4 2250 B12R2.2 c1ccc(cc1)c2ncco2 271570a_100011218836_100011787736 [0,0,1,1,0,0|2,0,0]=4 2251 B12R2.2 c1ccc(nc1)c2c[nH]cn2 271570a_100011264011_100000756875 [0,0,1,1,0,0|2,0,0]=4 2252 B12R2.2 c1ccc(nc1)c2cc[nH]c2 271570a_100000102155_100011216584 [0,0,1,1,0,0|2,0,0]=4 2253 B12R2.2 c1ccc(nc1)c2cc[nH]n2 271570a_100000062414_100011216584 [0,0,1,1,0,0|2,0,0]=4 2254 B12R2.2 c1ccc(nc1)c2cc[nH]n2 271570a_100011264011_100000062575 [0,0,1,1,0,0|2,0,0]=4 2255 B12R2.2 c1ccc(nc1)c2ccco2 271570a_100000750936_100011216584 [0,0,1,1,0,0|0,0,0]=2 2256 B12R2.2 c1ccc(nc1)c2ccco2 271570a_100011264011_100009814098 [0,0,1,1,0,0|0,0,0]=2 2257 B12R2.2 c1ccc(nc1)c2cccs2 271570a_100000742291_100011216584 [0,0,1,1,0,0|0,1,0]=3 2258 B12R2.2 c1ccc(nc1)c2cccs2 271570a_100011264011_100011215356 [0,0,1,1,0,0|0,1,0]=3 2259 B12R2.2 c1ccc(nc1)c2ccoc2 271570a_100011218838_100011216584 [0,0,1,1,0,0|2,0,0]=4 2260 B12R2.2 c1ccc(nc1)c2ccoc2 271570a_100011264011_100011215275 [0,0,1,1,0,0|2,0,0]=4 2261 B12R2.2 c1ccc(nc1)c2ccsc2 271570a_100011264011_100000738268 [0,0,1,1,0,0|2,0,0]=4 2262 B12R2.2 c1ccc(nc1)c2ccsc2 271570a_100011934443_100011216584 [0,0,1,1,0,0|2,0,0]=4 2263 B12R2.2 c1ccc(nc1)c2ccsn2 271570a_100011264011_100009818082 [0,0,1,1,0,0|2,0,0]=4 2264 B12R2.2 c1ccc(nc1)c2cnco2 271570a_100011264011_100020591547 [0,0,1,1,0,0|1,0,0]=3 2265 B12R2.2 c1ccc(nc1)c2cncs2 271570a_100010231675_100011216584 [0,0,1,1,0,0|1,1,0]=4 2266 B12R2.2 c1ccc(nc1)c2cncs2 271570a_100011264011_100011934649 [0,0,1,1,0,0|1,1,0]=4 2267 B12R2.2 c1ccc(nc1)c2cscn2 271570a_100011264011_100000751502 [0,0,1,1,0,0|2,0,0]=4 2268 B12R2.2 c1ccc(nc1)c2ncc[nH]2 271570a_100011264011_100025796157 [0,0,1,1,0,0|2,0,0]=4 2269 B12R2.2 c1ccc(nc1)c2ncc[nH]2 271570a_100016988920_100011216584 [0,0,1,1,0,0|2,0,0]=4 2270 B12R2.2 c1ccc(nc1)c2ncco2 271570a_100011264011_100011787736 [0,0,1,1,0,0|1,0,0]=3 2271 B12R2.2 c1ccc(nc1)c2nccs2 271570a_100011264011_100000211983 [0,0,1,1,0,0|1,1,0]=4 2272 B12R2.2 c1cnc(cn1)c2cnco2 271570a_100011962566_100020591547 [0,0,1,1,0,0|2,0,0]=4 2273 B12R2.2 c1cnc(cn1)c2ncco2 271570a_100011962566_100011787736 [0,0,1,1,0,0|2,0,0]=4 2274 B12R2.2 c1cnc(nc1)c2ccco2 271570a_100000750936_100000211032 [0,0,1,1,0,0|1,0,0]=3 2275 B12R2.2 c1cnc(nc1)c2cccs2 271570a_100000742291_100000211032 [0,0,1,1,0,0|1,1,0]=4 2276 B12R2.2 c1cncc(c1)c2ccco2 271570a_100000750936_100000752921 [0,0,1,1,0,0|2,0,0]=4 2277 B12R2.2 c1cncc(c1)c2ccco2 271570a_100000757648_100009814098 [0,0,1,1,0,0|2,0,0]=4 2278 B12R2.2 c1cnnc(c1)c2ccco2 271570a_100000750936_100016991348 [0,0,1,1,0,0|1,0,0]=3 2279 B12R2.2 c1cnnc(c1)c2cccs2 271570a_100000742291_100016991348 [0,0,1,1,0,0|1,1,0]=4 2280 B12R2.2 c1coc(c1)c2ccncc2 271570a_100000750936_100000035832 [0,0,1,1,0,0|2,0,0]=4 2281 B12R2.2 c1coc(c1)c2ccncc2 271570a_100000752145_100009814098 [0,0,1,1,0,0|2,0,0]=4 2282 B12R2.2 c1coc(c1)c2ccncn2 271570a_100000750936_100000703185 [0,0,1,1,0,0|1,0,0]=3 2283 B12R2.2 c1coc(c1)c2cnccn2 271570a_100000750936_100000758340 [0,0,1,1,0,0|1,0,0]=3 2284 B12R2.2 c1coc(c1)c2cnccn2 271570a_100011962566_100009814098 [0,0,1,1,0,0|1,0,0]=3 2285 B12R2.2 c1csc(c1)c2ccncn2 271570a_100000742291_100000703185 [0,0,1,1,0,0|1,1,0]=4 2286 B12R2.2 c1csc(c1)c2cnccn2 271570a_100000742291_100000758340 [0,0,1,1,0,0|1,1,0]=4 2287 B12R2.2 c1csc(c1)c2cnccn2 271570a_100011962566_100011215356 [0,0,1,1,0,0|1,1,0]=4 2288 B12R2.32 C=Cc1cc2ccccc2[nH]1 271570a_100011290941_100010232065 [0,0,1,1,0,0|1,0,1]=4 2289 B12R2.32 C=Cc1cc2ccccc2o1 271570a_100011290941_100010159458 [0,0,1,1,0,0|1,0,0]=3 2290 B12R2.32 C=Cc1cc2ccccc2s1 271570a_100011290941_100009816949 [0,0,1,1,0,0|1,1,0]=4 2291 B12R2.32 C=Cc1cn2ccccc2n1 271570a_100011290941_100009819586 [0,0,1,1,0,0|2,0,0]=4 2292 B12R2.32 C=Cc1nc2ccccc2[nH]1 271570a_100011290941_100009814255 [0,0,1,1,0,0|1,0,0]=3 2293 B12R2.32 C=Cc1nc2ccccc2s1 271570a_100011290941_100000751744 [0,0,1,1,0,0|0,1,0]=3 2294 B12R2.32 C=Cc1nc2cccnc2s1 271570a_100011290941_100010188088 [0,0,1,1,0,0|1,1,0]=4 2295 B10R2.32 Oc1csc2c1scc2 271570a_203496583355_100009817191 [0,0,0,0,2,0|2,0,0]=4