0 B27R3.513944930 CCN(CC)Cc1cc(ccc1O)Nc2cccc3c2ccc(n3)C 27a_100016998494_100010173736 [0,0,0,0,0,0|3,0,0]=3 1 B27R3.513944930 CCN(CC)Cc1cc(ccc1O)Nc2cccc3c2cnc(n3)N 27a_100016998494_100010209551 [0,0,0,0,0,0|4,0,0]=4 2 B27R3.513944930 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2ccc(c3)F 27a_100016998494_100000755548 [0,0,0,0,0,0|0,1,0]=1 3 B27R3.513944930 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2ccc(c3)O 27a_100016998494_100000045489 [0,0,0,0,0,0|1,0,0]=1 4 B27R3.513944930 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2ncc(c3)F 27a_100016998494_100011072215 [0,0,0,0,0,0|1,1,0]=2 5 B27R3.513944930 CCN(CC)Cc1cc(ccc1O)Nc2nccc3c2ccc(c3)C 27a_100016998494_100000102439 [0,0,0,0,0,0|3,0,0]=3 6 B27R3.513944930 CCN(CC)Cc1cc(ccc1O)Nc2nccc3c2ccc(c3)F 27a_100016998494_100000097391 [0,0,0,0,0,0|2,1,0]=3 7 B27R3.513944930 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2ccc(c3)C 27a_100016998494_100000099684 [0,0,0,0,0,0|2,0,0]=2 8 B27R3.513944930 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2ccc(c3)F 27a_100016998494_100000230349 [0,0,0,0,0,0|1,1,0]=2 9 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2cccc3c2cccn3 27a_100016998494_100011290932 [1,0,0,0,0,0|2,0,0]=3 10 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2cccc3c2cncn3 27a_100016998494_100009814520 [1,0,0,0,0,0|3,0,0]=4 11 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2cccc3c2nccn3 27a_100016998494_100010003881 [1,0,0,0,0,0|3,0,0]=4 12 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2cccc3c2ncnc3 27a_100016998494_100010246313 [1,0,0,0,0,0|3,0,0]=4 13 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2cccc3 27a_100016998494_100011215880 [1,0,0,0,0,0|0,0,0]=1 14 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2cccn3 27a_100016998494_100000087570 [1,0,0,0,0,0|1,0,0]=2 15 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2cncc3 27a_100016998494_100000095135 [1,0,0,0,0,0|1,0,0]=2 16 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2nccn3 27a_100016998494_100010783457 [1,0,0,0,0,0|2,0,0]=3 17 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2cncc3c2cccn3 27a_100016998494_100010211308 [1,0,0,0,0,0|3,0,0]=4 18 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2cnnc3c2cccc3 27a_100016998494_100000063506 [1,0,0,0,0,0|1,0,0]=2 19 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2nccc3c2cccc3 27a_100016998494_100011934041 [1,0,0,0,0,0|2,0,0]=3 20 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2nccc3c2cccn3 27a_100016998494_100000077681 [1,0,0,0,0,0|3,0,0]=4 21 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2nccc3c2cncc3 27a_100016998494_100000116921 [1,0,0,0,0,0|3,0,0]=4 22 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2nccc3c2nccc3 27a_100016998494_100010063729 [1,0,0,0,0,0|3,0,0]=4 23 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2cccc3 27a_100016998494_100000217608 [1,0,0,0,0,0|1,0,0]=2 24 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2cccn3 27a_100016998494_100000026734 [1,0,0,0,0,0|2,0,0]=3 25 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2ccnc3 27a_100016998494_100000098430 [1,0,0,0,0,0|2,0,0]=3 26 B26R3.2777711 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2nccc3 27a_100016998494_100000063688 [1,0,0,0,0,0|2,0,0]=3 27 B26R3.150651620 CCN(CC)Cc1cccc(c1)Nc2ccnc3c2ccc(c3)F 27a_100000737640_100000755548 [1,0,0,0,0,0|0,1,0]=2 28 B26R3.150651620 CCN(CC)Cc1cccc(c1)Nc2ccnc3c2ccc(c3)O 27a_100000737640_100000045489 [1,0,0,0,0,0|1,0,0]=2 29 B26R3.150651620 CCN(CC)Cc1cccc(c1)Nc2ccnc3c2ncc(c3)F 27a_100000737640_100011072215 [1,0,0,0,0,0|1,1,0]=3 30 B26R3.150651620 CCN(CC)Cc1cccc(c1)Nc2nccc3c2ccc(c3)F 27a_100000737640_100000097391 [1,0,0,0,0,0|2,1,0]=4 31 B26R3.150651620 CCN(CC)Cc1cccc(c1)Nc2ncnc3c2ccc(c3)C 27a_100000737640_100000099684 [1,0,0,0,0,0|2,0,0]=3 32 B26R3.150651620 CCN(CC)Cc1cccc(c1)Nc2ncnc3c2ccc(c3)F 27a_100000737640_100000230349 [1,0,0,0,0,0|1,1,0]=3 33 B28R3.183214332 CCN(CC)Cc1cc(ccc1O)Nc2cccc3c2ccc(n3)C#N 27a_100016998494_100010235449 [0,1,0,0,0,0|3,0,0]=4 34 B28R3.183214332 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2ccc(c3)OC 27a_100016998494_100000045488 [0,1,0,0,0,0|1,0,0]=2 35 B28R3.183214332 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2ncc(c3)OC 27a_100016998494_100009875103 [0,1,0,0,0,0|2,0,0]=3 36 B28R3.183214332 CCN(CC)Cc1cc(ccc1O)Nc2nccc3c2ccc(c3)OC 27a_100016998494_100000084302 [0,1,0,0,0,0|3,0,0]=4 37 B28R3.183214332 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2ccc(c3)OC 27a_100016998494_100011248138 [0,1,0,0,0,0|2,0,0]=3 38 B28R3.243562339 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2cc(c(c3)F)F 27a_100016998494_100000757567 [0,1,0,0,0,0|1,1,0]=3 39 B28R3.1895402695 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2c(cc(c3)F)F 27a_100016998494_100011310466 [0,1,0,0,0,0|0,1,0]=2 40 B28R3.1895402695 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2c(cc(c3)F)F 27a_100016998494_200012349238 [0,1,0,0,0,0|1,1,0]=3 41 B28R3.1895402741 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2ccc(c3C)F 27a_100016998494_100011516163 [0,1,0,0,0,0|0,1,0]=2 42 B28R3.3449017501 CCN(CC)Cc1cc(ccc1O)Nc2cc(nc3c2ccc(c3)F)C 27a_100016998494_100011290880 [0,1,0,0,0,0|0,1,0]=2 43 B28R3.3449017501 CCN(CC)Cc1cc(ccc1O)Nc2nc(nc3c2ccc(c3)C)C 27a_100016998494_200010384746 [0,1,0,0,0,0|2,0,0]=3 44 B28R3.3449017501 CCN(CC)Cc1cc(ccc1O)Nc2nc(nc3c2ccc(c3)F)C 27a_100016998494_100012003523 [0,1,0,0,0,0|1,1,0]=3 45 B26R2.58392433 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2OC)Cl 1626a_100016998494_100000217211 [0,0,1,0,0,0|2,0,1]=4 46 B26R2.58392433 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2OC)Cl 22a_100016998494_100000217211 [0,0,1,0,0,0|2,0,1]=4 47 B26R2.58392433 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2OC)Cl 527a_100016998494_100000217211 [0,0,1,0,0,0|2,0,1]=4 48 B26R3.17197663 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2cc([nH]3)C 27a_100016998494_100009847220 [0,0,0,0,1,0|3,0,0]=4 49 B26R3.17197663 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2cc(s3)C 27a_100016998494_100000753035 [0,0,0,0,1,0|3,0,0]=4 50 B26R3.17197663 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2sc(c3)C 27a_100016998494_200009846640 [0,0,0,0,1,0|3,0,0]=4 51 B26R3.150537688 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2ccn3C 27a_100016998494_100010168893 [0,0,0,0,1,0|2,0,0]=3 52 B26R3.150537688 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2cnn3C 27a_100016998494_100013479686 [0,0,0,0,1,0|3,0,0]=4 53 B26R3.150537688 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2ccn3C 27a_100016998494_100000076352 [0,0,0,0,1,0|3,0,0]=4 54 B26R3.150537688 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2scc3C 27a_100016998494_100000041020 [0,0,0,0,1,0|3,0,0]=4 55 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2Br)Cl 1626a_100016998494_100000766353 [1,0,1,0,0,0|2,0,0]=4 56 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2Br)Cl 22a_100016998494_100000766353 [1,0,1,0,0,0|2,0,0]=4 57 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2Br)Cl 527a_100016998494_100000766353 [1,0,1,0,0,0|2,0,0]=4 58 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2C)Cl 1626a_100016998494_100000688705 [1,0,1,0,0,0|1,0,1]=4 59 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2C)Cl 22a_100016998494_100000688705 [1,0,1,0,0,0|1,0,1]=4 60 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2C)Cl 527a_100016998494_100000688705 [1,0,1,0,0,0|1,0,1]=4 61 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2Cl)Cl 1626a_100016998494_100000185840 [1,0,1,0,0,0|2,0,0]=4 62 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2Cl)Cl 22a_100016998494_100000185840 [1,0,1,0,0,0|2,0,0]=4 63 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2Cl)Cl 527a_100016998494_100000185840 [1,0,1,0,0,0|2,0,0]=4 64 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2F)Cl 1626a_100016998494_100000212326 [1,0,1,0,0,0|2,0,0]=4 65 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2F)Cl 22a_100016998494_100000212326 [1,0,1,0,0,0|2,0,0]=4 66 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2F)Cl 527a_100016998494_100000212326 [1,0,1,0,0,0|2,0,0]=4 67 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2I)Cl 1626a_100016998494_100000739380 [1,0,1,0,0,0|2,0,0]=4 68 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2I)Cl 22a_100016998494_100000739380 [1,0,1,0,0,0|2,0,0]=4 69 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2I)Cl 527a_100016998494_100000739380 [1,0,1,0,0,0|2,0,0]=4 70 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2O)Cl 22a_100016998494_100000188622 [1,0,1,0,0,0|2,0,0]=4 71 B25R2.8061128 CCN(CC)Cc1cc(ccc1O)NC(=O)c2ccc(cc2O)Cl 527a_100016998494_100000188622 [1,0,1,0,0,0|2,0,0]=4 72 B25R2.52598253 C=Cc1ccccc1C(=O)Nc2ccc(c(c2)CN(CC)CC)O 1626a_100016998494_100011830265 [1,0,1,0,0,0|2,0,0]=4 73 B25R2.52598253 C=Cc1ccccc1C(=O)Nc2ccc(c(c2)CN(CC)CC)O 22a_100016998494_100011830265 [1,0,1,0,0,0|2,0,0]=4 74 B25R2.103572819 C=CCc1ccccc1CNc2ccc(c(c2)CN(CC)CC)O 270302a_100016998494_100010619294 [1,0,1,0,0,0|1,0,1]=4 75 B25R3.24932 CCN(CC)Cc1cccc(c1)Nc2cccc3c2cccn3 27a_100000737640_100011290932 [2,0,0,0,0,0|2,0,0]=4 76 B25R3.24932 CCN(CC)Cc1cccc(c1)Nc2ccnc3c2cccc3 27a_100000737640_100011215880 [2,0,0,0,0,0|0,0,0]=2 77 B25R3.24932 CCN(CC)Cc1cccc(c1)Nc2ccnc3c2cccn3 27a_100000737640_100000087570 [2,0,0,0,0,0|1,0,0]=3 78 B25R3.24932 CCN(CC)Cc1cccc(c1)Nc2ccnc3c2cncc3 27a_100000737640_100000095135 [2,0,0,0,0,0|1,0,0]=3 79 B25R3.24932 CCN(CC)Cc1cccc(c1)Nc2ccnc3c2nccn3 27a_100000737640_100010783457 [2,0,0,0,0,0|2,0,0]=4 80 B25R3.24932 CCN(CC)Cc1cccc(c1)Nc2cnnc3c2cccc3 27a_100000737640_100000063506 [2,0,0,0,0,0|1,0,0]=3 81 B25R3.24932 CCN(CC)Cc1cccc(c1)Nc2nccc3c2cccc3 27a_100000737640_100011934041 [2,0,0,0,0,0|2,0,0]=4 82 B25R3.24932 CCN(CC)Cc1cccc(c1)Nc2ncnc3c2cccc3 27a_100000737640_100000217608 [2,0,0,0,0,0|1,0,0]=3 83 B25R3.24932 CCN(CC)Cc1cccc(c1)Nc2ncnc3c2cccn3 27a_100000737640_100000026734 [2,0,0,0,0,0|2,0,0]=4 84 B25R3.24932 CCN(CC)Cc1cccc(c1)Nc2ncnc3c2ccnc3 27a_100000737640_100000098430 [2,0,0,0,0,0|2,0,0]=4 85 B25R3.24932 CCN(CC)Cc1cccc(c1)Nc2ncnc3c2nccc3 27a_100000737640_100000063688 [2,0,0,0,0,0|2,0,0]=4 86 B25R3.311787790 CCNCc1cc(ccc1O)Sc2ccnc3c2ccc(c3)Cl 62a_100000765307_100012352046 [2,0,0,0,0,0|1,0,0]=3 87 B25R3.311787790 CCNCc1cc(ccc1O)Sc2ccnc3c2ccc(c3)Cl 62a_100012352046_100000765307 [2,0,0,0,0,0|1,0,0]=3 88 B25R3.311787790 CCNCc1cc(ccc1O)Sc2ccnc3c2ccc(c3)F 62a_100000755548_100000765307 [2,0,0,0,0,0|1,1,0]=4 89 B25R3.311787790 CCNCc1cc(ccc1O)Sc2ccnc3c2ccc(c3)F 62a_100000765307_100000755548 [2,0,0,0,0,0|1,1,0]=4 90 B25R3.311787790 CCNCc1cc(ccc1O)Sc2ccnc3c2ccc(c3)O 62a_100000765307_100000045489 [2,0,0,0,0,0|2,0,0]=4 91 B27R3.20055380 CCN(CC)Cc1cc(ccc1O)Nc2cccc3c2nccc3C 27a_100016998494_100010254272 [1,1,0,0,0,0|2,0,0]=4 92 B27R3.20055380 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2cccc3C 27a_100016998494_100000751276 [1,1,0,0,0,0|0,0,0]=2 93 B27R3.20055380 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2cccc3F 27a_100016998494_100000751275 [1,1,0,0,0,0|0,0,0]=2 94 B27R3.20055380 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2cccc3N 27a_100016998494_100009892510 [1,1,0,0,0,0|0,0,0]=2 95 B27R3.20055380 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2cccc3O 27a_100016998494_100000703299 [1,1,0,0,0,0|0,0,0]=2 96 B27R3.20055380 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2nccc3C 27a_100016998494_200013369187 [1,1,0,0,0,0|1,0,0]=3 97 B27R3.20055380 CCN(CC)Cc1cc(ccc1O)Nc2nccc3c2cccc3C 27a_100016998494_100012002547 [1,1,0,0,0,0|2,0,0]=4 98 B27R3.20055380 CCN(CC)Cc1cc(ccc1O)Nc2nccc3c2cccc3F 27a_100016998494_100012180906 [1,1,0,0,0,0|2,0,0]=4 99 B27R3.20055380 CCN(CC)Cc1cc(ccc1O)Nc2nccc3c2cccc3N 27a_100016998494_100000070072 [1,1,0,0,0,0|2,0,0]=4 100 B27R3.20055380 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2cccc3C 27a_100016998494_100000751292 [1,1,0,0,0,0|1,0,0]=3 101 B27R3.20055380 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2cccc3F 27a_100016998494_100000693626 [1,1,0,0,0,0|1,0,0]=3 102 B27R3.165057681 CCN(CC)Cc1cc(ccc1O)Nc2cc(=O)[nH]c3c2cccc3 27a_100016998494_100000075698 [1,1,0,0,0,0|0,0,1]=3 103 B27R3.165057681 CCN(CC)Cc1cc(ccc1O)Nc2cc(=O)[nH]c3c2cccn3 27a_100016998494_100010499609 [1,1,0,0,0,0|1,0,1]=4 104 B27R3.165057681 CCN(CC)Cc1cc(ccc1O)Nc2cc(cc3c2nccc3)F 27a_100016998494_100010214460 [1,1,0,0,0,0|2,0,0]=4 105 B27R3.165057681 CCN(CC)Cc1cc(ccc1O)Nc2cc(nc3c2cccc3)C 27a_100016998494_100000735862 [1,1,0,0,0,0|0,0,0]=2 106 B27R3.165057681 CCN(CC)Cc1cc(ccc1O)Nc2cc(nc3c2cccn3)C 27a_100016998494_100009885123 [1,1,0,0,0,0|1,0,0]=3 107 B27R3.165057681 CCN(CC)Cc1cc(ccc1O)Nc2nc(cc3c2cccc3)C 27a_100016998494_100000698243 [1,1,0,0,0,0|2,0,0]=4 108 B27R3.165057681 CCN(CC)Cc1cc(ccc1O)Nc2nc(nc3c2cccc3)C 27a_100016998494_100000230251 [1,1,0,0,0,0|1,0,0]=3 109 B27R3.165057930 CCN(CC)Cc1cc(ccc1O)Nc2c(cnc3c2cccc3)C 27a_100016998494_100000092342 [1,1,0,0,0,0|0,0,0]=2 110 B27R3.165058112 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2cc(cc3)C 27a_100016998494_100000751279 [1,1,0,0,0,0|0,0,0]=2 111 B27R3.165058112 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2cc(cc3)F 27a_100016998494_100011217270 [1,1,0,0,0,0|0,0,0]=2 112 B27R3.165058112 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2cc(cc3)N 27a_100016998494_100009879071 [1,1,0,0,0,0|0,0,0]=2 113 B27R3.165058112 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2nc(cc3)C 27a_100016998494_100009889967 [1,1,0,0,0,0|1,0,0]=3 114 B27R3.165058112 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2nc(cc3)F 27a_100016998494_100000719316 [1,1,0,0,0,0|1,0,0]=3 115 B27R3.165058112 CCN(CC)Cc1cc(ccc1O)Nc2nccc3c2cc(cc3)F 27a_100016998494_100010202866 [1,1,0,0,0,0|2,0,0]=4 116 B27R3.165058112 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2cc(cc3)C 27a_100016998494_100000743341 [1,1,0,0,0,0|1,0,0]=3 117 B27R3.165058112 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2cc(cc3)F 27a_100016998494_100000743340 [1,1,0,0,0,0|1,0,0]=3 118 B27R3.165058113 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2c(ccc3)N 27a_100016998494_100010263589 [1,1,0,0,0,0|0,0,0]=2 119 B27R3.165058113 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2c(ccc3)F 27a_100016998494_100000743342 [1,1,0,0,0,0|1,0,0]=3 120 B27R3.513945183 CCN(CC)Cc1cc(ccc1O)Nc2ccc(c3c2ccnc3)F 27a_100016998494_100000698020 [1,1,0,0,0,0|2,0,0]=4 121 B27R3.513945183 CCN(CC)Cc1cc(ccc1O)Nc2ccc(c3c2cncc3)F 27a_100016998494_100010244717 [1,1,0,0,0,0|2,0,0]=4 122 B27R3.513945183 CCN(CC)Cc1cc(ccc1O)Nc2ccc(c3c2nccc3)F 27a_100016998494_100010214461 [1,1,0,0,0,0|2,0,0]=4 123 B27R3.513945183 CCN(CC)Cc1cc(ccc1O)Nc2ncc(c3c2cccc3)C 27a_100016998494_100000112005 [1,1,0,0,0,0|2,0,0]=4 124 B27R3.13787310 CCN(CC)Cc1cccc(c1)Nc2ccnc3c2ccc(c3)OC 27a_100000737640_100000045488 [1,1,0,0,0,0|1,0,0]=3 125 B27R3.13787310 CCN(CC)Cc1cccc(c1)Nc2ccnc3c2ncc(c3)OC 27a_100000737640_100009875103 [1,1,0,0,0,0|2,0,0]=4 126 B27R3.13787310 CCN(CC)Cc1cccc(c1)Nc2ncnc3c2ccc(c3)OC 27a_100000737640_100011248138 [1,1,0,0,0,0|2,0,0]=4 127 B27R3.20077936 CCN(CC)Cc1cccc(c1)Nc2ncnc3c2cc(c(c3)F)F 27a_100000737640_100000757567 [1,1,0,0,0,0|1,1,0]=4 128 B27R3.121321976 CCN(CC)C(=O)c1cccc(c1)Nc2ccnc3c2ccc(c3)F 27a_100000184881_100000755548 [1,1,0,0,0,0|0,1,1]=4 129 B27R3.121321976 CCN(CC)C(=O)c1cccc(c1)Nc2ccnc3c2ccc(c3)O 27a_100000184881_100000045489 [1,1,0,0,0,0|1,0,1]=4 130 B27R3.165213933 CCN(CC)Cc1cccc(c1)Nc2ncnc3c2c(cc(c3)F)F 27a_100000737640_200012349238 [1,1,0,0,0,0|1,1,0]=4 131 B27R3.514362017 CCN(CC)Cc1cccc(c1)Nc2nc(nc3c2ccc(c3)C)C 27a_100000737640_200010384746 [1,1,0,0,0,0|2,0,0]=4 132 B27R3.514362017 CCN(CC)Cc1cccc(c1)Nc2nc(nc3c2ccc(c3)F)C 27a_100000737640_100012003523 [1,1,0,0,0,0|1,1,0]=4 133 B29R3.3123270070 CCN(CC)Cc1cc(ccc1O)NC(=O)c2cccc3c2ccc(c3)F 1626a_100016998494_200000098428 [0,1,0,0,0,1|1,1,0]=4 134 B29R3.3123270070 CCN(CC)Cc1cc(ccc1O)NC(=O)c2cccc3c2ccc(c3)F 22a_100016998494_200000098428 [0,1,0,0,0,1|1,1,0]=4 135 B29R3.3123270070 CCN(CC)Cc1cc(ccc1O)NC(=O)c2cccc3c2ccc(c3)F 527a_100016998494_200000098428 [0,1,0,0,0,1|1,1,0]=4 136 B29R3.3123270070 CCN(CC)Cc1cc(ccc1O)NC(=O)c2cccc3c2ccc(c3)O 22a_100016998494_100000042678 [0,1,0,0,0,1|2,0,0]=4 137 B29R3.3123270070 CCN(CC)Cc1cc(ccc1O)NC(=O)c2cccc3c2ccc(c3)O 527a_100016998494_100000042678 [0,1,0,0,0,1|2,0,0]=4 138 B29R3.3123270070 CCN(CC)Cc1cc(ccc1O)NC(=O)c2cccc3c2ccc(n3)Cl 1626a_100016998494_100010238459 [0,1,0,0,0,1|2,0,0]=4 139 B29R3.3123270070 CCN(CC)Cc1cc(ccc1O)NC(=O)c2cccc3c2ccc(n3)Cl 527a_100016998494_100010238459 [0,1,0,0,0,1|2,0,0]=4 140 B29R3.8204131946 CCN(CC)Cc1cc(ccc1O)NCc2cc(=O)oc3c2ccc(c3)O 7a_100016998494_100000010346 [0,1,0,0,0,1|2,0,0]=4 141 B29R3.1047405811 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2cc(c(c3)OC)O 27a_100016998494_100010141198 [0,2,0,0,0,0|2,0,0]=4 142 B29R3.1384738957 CCN(CC)Cc1cc(ccc1O)Nc2cc(nc3c2ccc(c3)OC)C 27a_100016998494_100000044451 [0,2,0,0,0,0|1,0,0]=3 143 B29R3.1540152025 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2cc(c(c3)F)OC 27a_100016998494_100000725136 [0,2,0,0,0,0|0,1,0]=3 144 B29R3.3123217506 CCN(CC)Cc1cc(ccc1O)Nc2nc(nc3c2cc(c(c3)F)F)C 27a_100016998494_100012351370 [0,2,0,0,0,0|1,1,0]=4 145 B29R3.2152495473 CCN(CC)S(=O)(=O)c1cc(ccc1C)Nc2ccnc3c2ccc(c3)Cl 27a_100000260845_100012352046 [0,2,0,0,0,0|2,0,0]=4 146 B29R3.1366423386 CCN(CC)Cc1cc(ccc1O)Nc2c(cnc3c2ccc(c3)F)C#N 27a_100016998494_200011934548 [0,2,0,0,0,0|0,1,0]=3 147 B27R3.513948563 CCN(CC)Cc1cc(ccc1O)NCc2cnc3n2ccc(c3)Cl 270302a_100016998494_100000097743 [0,0,1,1,0,0|1,0,1]=4 148 B27R3.165062225 CCN(CC)Cc1cc(ccc1O)Nc2ccc3c(=O)[nH]cnc3c2 27a_100016998494_100000230960 [0,0,1,1,0,0|2,0,0]=4 149 B27R3.165062225 CCN(CC)Cc1cc(ccc1O)Nc2ccc3c(ncnc3c2)N 27a_100016998494_100010199758 [0,0,1,1,0,0|2,0,0]=4 150 B27R4.2451897 Cc1ccc2c(ncnc2c1)Nc3cccc(c3)CN4CCCC4 27a_100000738244_100000099684 [1,0,0,1,0,0|2,0,0]=4 151 B27R4.2451897 Fc1ccc2c(ccnc2c1)Nc3cccc(c3)CN4CCCC4 27a_100000738244_100000755548 [1,0,0,1,0,0|0,1,0]=3 152 B27R4.2451897 Fc1ccc2c(ncnc2c1)Nc3cccc(c3)CN4CCCC4 27a_100000738244_100000230349 [1,0,0,1,0,0|1,1,0]=4 153 B27R4.2451897 Fc1cnc2c(ccnc2c1)Nc3cccc(c3)CN4CCCC4 27a_100000738244_100011072215 [1,0,0,1,0,0|1,1,0]=4 154 B27R4.2451897 Oc1ccc2c(ccnc2c1)Nc3cccc(c3)CN4CCCC4 27a_100000738244_100000045489 [1,0,0,1,0,0|1,0,0]=3 155 B27R4.2451897 Oc1ccc2c(ccnc2c1)Sc3cccc(c3)CN4CCCC4 62a_100015185575_100000045489 [1,0,0,1,0,0|2,0,0]=4 156 B27R4.9674757 CCN1CCc2c(cccc2Nc3ccnc4c3ccc(c4)F)C1 27a_100000690291_100000755548 [1,0,0,1,0,0|0,1,0]=3 157 B27R4.9674757 CCN1CCc2c(cccc2Nc3ccnc4c3ccc(c4)O)C1 27a_100000690291_100000045489 [1,0,0,1,0,0|1,0,0]=3 158 B27R4.9674757 CCN1CCc2c(cccc2Nc3ccnc4c3ncc(c4)F)C1 27a_100000690291_100011072215 [1,0,0,1,0,0|1,1,0]=4 159 B27R4.9674757 CCN1CCc2c(cccc2Nc3ncnc4c3ccc(c4)C)C1 27a_100000690291_100000099684 [1,0,0,1,0,0|2,0,0]=4 160 B27R4.9674757 CCN1CCc2c(cccc2Nc3ncnc4c3ccc(c4)F)C1 27a_100000690291_100000230349 [1,0,0,1,0,0|1,1,0]=4 161 B27R4.543172057 CCN1CCCc2c1cc(cc2)Nc3ccnc4c3ccc(c4)F 27a_100011636486_100000755548 [0,0,0,1,1,0|1,1,0]=4 162 B27R4.543172057 CCN1CCCc2c1cc(cc2)Nc3ccnc4c3ccc(c4)O 27a_100011636486_100000045489 [0,0,0,1,1,0|2,0,0]=4 163 B29R4.3239433 Fc1ccc2c(ccnc2c1)Nc3ccc(c(c3)CN4CCOCC4)Cl 27a_200000725583_100000755548 [0,1,0,1,0,0|1,1,0]=4 164 B29R4.3239433 Oc1ccc2c(ccnc2c1)Nc3ccc(c(c3)CN4CCOCC4)Cl 27a_200000725583_100000045489 [0,1,0,1,0,0|2,0,0]=4 165 B25R3.2571324 CCN(CC)Cc1cc(ccc1O)Nc2cnc3n2nccc3 27a_100016998494_100009819068 [1,0,0,0,1,0|2,0,0]=4 166 B25R3.2571324 CCN(CC)Cc1cc(ccc1O)Nc2cnn3c2cncc3 27a_100016998494_100010892148 [1,0,0,0,1,0|2,0,0]=4 167 B25R3.2571324 CCN(CC)Cc1cc(ccc1O)Nc2cnn3c2nccc3 27a_100016998494_100009819579 [1,0,0,0,1,0|2,0,0]=4 168 B25R3.13666143 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2[nH]nc3 27a_100016998494_100000112858 [1,0,0,0,1,0|2,0,0]=4 169 B25R3.13666143 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2ccs3 27a_100016998494_100009861243 [1,0,0,0,1,0|1,0,0]=3 170 B25R3.13666143 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2nc[nH]3 27a_100016998494_100009820729 [1,0,0,0,1,0|2,0,0]=4 171 B25R3.13666143 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2scc3 27a_100016998494_100000764135 [1,0,0,0,1,0|1,0,0]=3 172 B25R3.13666143 CCN(CC)Cc1cc(ccc1O)Nc2ccnc3n2ncc3 27a_100016998494_100000080991 [1,0,0,0,1,0|2,0,0]=4 173 B25R3.13666143 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2[nH]cc3 27a_100016998494_100000084117 [1,0,0,0,1,0|2,0,0]=4 174 B25R3.13666143 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2cco3 27a_100016998494_100000094286 [1,0,0,0,1,0|2,0,0]=4 175 B25R3.13666143 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2ccs3 27a_100016998494_100000183654 [1,0,0,0,1,0|2,0,0]=4 176 B25R3.13666143 CCN(CC)Cc1cc(ccc1O)Nc2ncnc3c2scc3 27a_100016998494_100000234879 [1,0,0,0,1,0|2,0,0]=4 177 B25R3.13666143 CCN(CC)Cc1cc(ccc1O)Nc2ncnn3c2ccc3 27a_100016998494_100000104113 [1,0,0,0,1,0|2,0,0]=4 178 B25R3.13675702 CCN(CC)Cc1cccc(c1)Nc2ccnc3c2ccn3C 27a_100000737640_100010168893 [1,0,0,0,1,0|2,0,0]=4 179 B25R3.123207009 CCN(CC)Cc1cccc(c1)c2ccnc3c2ccc(c3)F 271570a_200020621423_100000755548 [1,0,0,0,1,0|0,1,0]=3 180 B25R3.123207009 CCN(CC)Cc1cccc(c1)c2ccnc3c2ccc(c3)O 271570a_200020621423_100000045489 [1,0,0,0,1,0|1,0,0]=3 181 B25R3.123207009 CCN(CC)Cc1cccc(c1)c2ccnc3c2ncc(c3)F 271570a_200020621423_100011072215 [1,0,0,0,1,0|1,1,0]=4 182 B25R3.123207009 CCN(CC)Cc1cccc(c1)c2ncnc3c2ccc(c3)C 271570a_200020621423_100000099684 [1,0,0,0,1,0|2,0,0]=4 183 B25R3.123207009 CCN(CC)Cc1cccc(c1)c2ncnc3c2ccc(c3)F 271570a_200020621423_100000230349 [1,0,0,0,1,0|1,1,0]=4 184 B27R3.2948700 CCN(CC)Cc1cc(ccc1O)NCc2cccc3c2ccnc3 270302a_100016998494_100000750165 [1,0,0,0,0,1|2,0,0]=4 185 B27R3.2948700 CCN(CC)Cc1cc(ccc1O)NCc2cccc3c2ccnc3 7a_100016998494_100016989825 [1,0,0,0,0,1|2,0,0]=4 186 B27R3.2948700 CCN(CC)Cc1cc(ccc1O)NCc2cccc3c2cncc3 270302a_100016998494_100011934574 [1,0,0,0,0,1|2,0,0]=4 187 B27R3.2948700 CCN(CC)Cc1cc(ccc1O)NCc2cccc3c2nccc3 270302a_100016998494_100000239888 [1,0,0,0,0,1|2,0,0]=4 188 B27R3.2948700 CCN(CC)Cc1cc(ccc1O)NCc2cccc3c2nccc3 7a_100016998494_100000241032 [1,0,0,0,0,1|2,0,0]=4 189 B27R3.2948700 CCN(CC)Cc1cc(ccc1O)NCc2ccnc3c2cccc3 7a_100016998494_100015192512 [1,0,0,0,0,1|0,0,0]=2 190 B27R3.2948700 CCN(CC)Cc1cc(ccc1O)NCc2cncc3c2cccc3 270302a_100016998494_100000684730 [1,0,0,0,0,1|2,0,0]=4 191 B27R3.2948700 CCN(CC)Cc1cc(ccc1O)NCc2nccc3c2cccc3 7a_100016998494_100000033776 [1,0,0,0,0,1|2,0,0]=4 192 B27R3.165062215 CCN(CC)Cc1cc(ccc1O)Nc2ccc3cc(ccc3n2)C 27a_100016998494_100011865911 [0,0,0,0,1,1|1,0,0]=3 193 B27R3.165062215 CCN(CC)Cc1cc(ccc1O)Nc2ccc3cc(ccc3n2)F 27a_100016998494_100011998705 [0,0,0,0,1,1|0,1,0]=3 194 B27R3.165062215 CCN(CC)Cc1cc(ccc1O)Nc2ccc3nc(ccc3n2)C 27a_100016998494_200009884078 [0,0,0,0,1,1|2,0,0]=4 195 B27R3.165062215 CCN(CC)Cc1cc(ccc1O)Nc2cnc3cc(ccc3n2)F 27a_100016998494_100000098432 [0,0,0,0,1,1|0,1,0]=3 196 B27R3.165062215 CCN(CC)Cc1cc(ccc1O)Nc2cnc3cc(ccc3n2)N 27a_100016998494_100009885871 [0,0,0,0,1,1|1,0,0]=3 197 B27R3.165062215 CCN(CC)Cc1cc(ccc1O)Nc2cnc3cc(ccc3n2)O 27a_100016998494_200010664160 [0,0,0,0,1,1|1,0,0]=3