0 B30R4.10970550 COc1cc(ccc1C#N)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100011999456_200016987766 [0,0,0,0,0,0|4,0,0]=4 1 B30R4.10970550 COc1cc(ccc1C#N)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011999456_100000261305 [0,0,0,0,0,0|3,0,0]=3 2 B30R4.10970550 COc1cc(ccc1C#N)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000694671 [0,0,0,0,0,0|4,0,0]=4 3 B30R4.10970550 COc1cc(ccc1C=O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100010290300 [0,0,0,0,0,0|4,0,0]=4 4 B30R4.10970550 COc1cc(ccc1C=O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000697075_100000261305 [0,0,0,0,0,0|4,0,0]=4 5 B30R4.10970550 COc1cc(ccc1CO)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100012183141_200016987766 [0,0,0,0,0,0|4,0,0]=4 6 B30R4.10970550 COc1cc(ccc1CO)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100012183141_100000261305 [0,0,0,0,0,0|3,0,0]=3 7 B30R4.10970550 COc1cc(ccc1CO)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100011277633 [0,0,0,0,0,0|4,0,0]=4 8 B30R4.10970550 COc1cc(ccc1CO)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100011277633_100000261305 [0,0,0,0,0,0|4,0,0]=4 9 B30R4.10970550 COc1cc(cnc1OC)Sc2cc(nc3c2cccc3)c4ccccc4 62a_200016987766_100010234541 [0,0,0,0,0,0|4,0,0]=4 10 B30R4.10970550 COc1cc(cnc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100010234541 [0,0,0,0,0,0|3,0,0]=3 11 B30R4.10970550 COc1cc(nnc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_200000095610 [0,0,0,0,0,0|4,0,0]=4 12 B30R4.10970550 COc1ccc(cc1C#N)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100011204338_200016987766 [0,0,0,0,0,0|4,0,0]=4 13 B30R4.10970550 COc1ccc(cc1C#N)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011204338_100000261305 [0,0,0,0,0,0|3,0,0]=3 14 B30R4.10970550 COc1ccc(cc1C#N)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000188252 [0,0,0,0,0,0|4,0,0]=4 15 B30R4.10970550 COc1ccc(cc1C=O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000170026_100000261305 [0,0,0,0,0,0|4,0,0]=4 16 B30R4.10970550 COc1ccc(cc1C=O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000170026 [0,0,0,0,0,0|4,0,0]=4 17 B30R4.10970550 COc1ccc(cc1CN)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000690498 [0,0,0,0,0,0|4,0,0]=4 18 B30R4.10970550 COc1ccc(cc1CN)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000690498_100000261305 [0,0,0,0,0,0|4,0,0]=4 19 B30R4.10970550 COc1ccc(cc1CO)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000204679_100000261305 [0,0,0,0,0,0|4,0,0]=4 20 B30R4.10970550 COc1ccc(cc1CO)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000204679 [0,0,0,0,0,0|4,0,0]=4 21 B30R4.10970550 COc1ccc(cc1OC)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100000187404_200016987766 [0,0,0,0,0,0|2,0,0]=2 22 B30R4.10970550 COc1ccc(cc1OC)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000187404_100000261305 [0,0,0,0,0,0|1,0,0]=1 23 B30R4.10970550 COc1ccc(cc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100011356967 [0,0,0,0,0,0|2,0,0]=2 24 B30R4.10970550 COc1ccc(nc1OC)Sc2cc(nc3c2cccc3)c4ccccc4 62a_200016987766_100010214848 [0,0,0,0,0,0|4,0,0]=4 25 B30R4.10970550 COc1ccc(nc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100010214848 [0,0,0,0,0,0|3,0,0]=3 26 B30R4.10970550 COc1cnc(nc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100010280452 [0,0,0,0,0,0|4,0,0]=4 27 B30R4.10970550 COc1ncc(nc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100010132954 [0,0,0,0,0,0|4,0,0]=4 28 B30R4.10970550 COc1ncc(nc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100010132954_100000261305 [0,0,0,0,0,0|4,0,0]=4 29 B29R4.12360243 CNc1ccc(cc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000221803_100000261305 [1,0,0,0,0,0|3,0,0]=4 30 B29R4.12360243 CNc1ccc(cc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000221803 [1,0,0,0,0,0|3,0,0]=4 31 B29R4.12360243 COc1ccc(cc1Br)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000187427_100000261305 [1,0,0,0,0,0|2,0,0]=3 32 B29R4.12360243 COc1ccc(cc1C)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100000743268_200016987766 [1,0,0,0,0,0|2,0,0]=3 33 B29R4.12360243 COc1ccc(cc1C)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000743268_100000261305 [1,0,0,0,0,0|1,0,0]=2 34 B29R4.12360243 COc1ccc(cc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100011219705 [1,0,0,0,0,0|2,0,0]=3 35 B29R4.12360243 COc1ccc(cc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100011219705_100000261305 [1,0,0,0,0,0|2,0,0]=3 36 B29R4.12360243 COc1ccc(cc1Cl)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000211044_100000261305 [1,0,0,0,0,0|2,0,0]=3 37 B29R4.12360243 COc1ccc(cc1F)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100000740183_200016987766 [1,0,0,0,0,0|3,0,0]=4 38 B29R4.12360243 COc1ccc(cc1F)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000740183_100000261305 [1,0,0,0,0,0|2,0,0]=3 39 B29R4.12360243 COc1ccc(cc1F)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000171752_100000261305 [1,0,0,0,0,0|3,0,0]=4 40 B29R4.12360243 COc1ccc(cc1F)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000171752 [1,0,0,0,0,0|3,0,0]=4 41 B29R4.12360243 COc1ccc(cc1I)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011356947_100000261305 [1,0,0,0,0,0|2,0,0]=3 42 B29R4.12360243 COc1ccc(cc1N)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100011249504 [1,0,0,0,0,0|3,0,0]=4 43 B29R4.12360243 COc1ccc(cc1N)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100011249504_100000261305 [1,0,0,0,0,0|3,0,0]=4 44 B29R4.12360243 COc1ccc(cc1O)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100000211920_200016987766 [1,0,0,0,0,0|2,0,0]=3 45 B29R4.12360243 COc1ccc(cc1O)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000211920_100000261305 [1,0,0,0,0,0|1,0,0]=2 46 B29R4.12360243 COc1ccc(cc1O)Sc2cc(nc3c2cccc3)c4ccccc4 62a_200016987766_100009816560 [1,0,0,0,0,0|3,0,0]=4 47 B29R4.12360243 COc1ccc(cc1O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100009816560 [1,0,0,0,0,0|2,0,0]=3 48 B29R4.12360243 COc1ccc(nc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100010244750 [1,0,0,0,0,0|3,0,0]=4 49 B29R4.12360243 COc1ccc(nc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100010244750_100000261305 [1,0,0,0,0,0|3,0,0]=4 50 B29R4.12360243 COc1cnc(cc1O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100010264082 [1,0,0,0,0,0|3,0,0]=4 51 B29R4.12360243 COc1ncc(cc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100011290809 [1,0,0,0,0,0|3,0,0]=4 52 B29R4.12360243 COc1ncc(cc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100011290809_100000261305 [1,0,0,0,0,0|3,0,0]=4 53 B29R4.12360243 COc1ncc(cc1O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100010135713 [1,0,0,0,0,0|3,0,0]=4 54 B29R4.12360243 CSc1ccc(cc1F)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000762756_100000261305 [1,0,0,0,0,0|2,1,0]=4 55 B29R4.12360243 Cc1cc(ccc1C#N)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011999795_100000261305 [1,0,0,0,0,0|3,0,0]=4 56 B29R4.12360243 Cc1cc(ccc1CO)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000102464_100000261305 [1,0,0,0,0,0|3,0,0]=4 57 B29R4.12360243 N#Cc1ccc(cc1O)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000094571_100000261305 [1,0,0,0,0,0|3,0,0]=4 58 B29R4.13828428 C#Cc1cc(ccc1C)Nc2nc(nc3c2cccc3)c4ccccc4 27a_200012017271_100000261305 [1,0,0,0,0,0|2,0,1]=4 59 B29R4.13828428 CCc1cc(ccc1O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100012338938 [1,0,0,0,0,0|3,0,0]=4 60 B29R4.13828428 CNc1cc(ccc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100020629602 [1,0,0,0,0,0|3,0,0]=4 61 B29R4.13828428 CNc1cc(ccc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100020629602_100000261305 [1,0,0,0,0,0|3,0,0]=4 62 B29R4.13828428 COc1cc(ccc1Br)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000765947_100000261305 [1,0,0,0,0,0|2,0,0]=3 63 B29R4.13828428 COc1cc(ccc1C)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100011279678_200016987766 [1,0,0,0,0,0|2,0,0]=3 64 B29R4.13828428 COc1cc(ccc1C)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011279678_100000261305 [1,0,0,0,0,0|1,0,0]=2 65 B29R4.13828428 COc1cc(ccc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100011830276 [1,0,0,0,0,0|2,0,0]=3 66 B29R4.13828428 COc1cc(ccc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100011830276_100000261305 [1,0,0,0,0,0|2,0,0]=3 67 B29R4.13828428 COc1cc(ccc1Cl)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000742311_100000261305 [1,0,0,0,0,0|2,0,0]=3 68 B29R4.13828428 COc1cc(ccc1F)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100000701188_200016987766 [1,0,0,0,0,0|3,0,0]=4 69 B29R4.13828428 COc1cc(ccc1F)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000701188_100000261305 [1,0,0,0,0,0|2,0,0]=3 70 B29R4.13828428 COc1cc(ccc1F)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100011934186 [1,0,0,0,0,0|3,0,0]=4 71 B29R4.13828428 COc1cc(ccc1F)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100011934186_100000261305 [1,0,0,0,0,0|3,0,0]=4 72 B29R4.13828428 COc1cc(ccc1I)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000746945_100000261305 [1,0,0,0,0,0|2,0,0]=3 73 B29R4.13828428 COc1cc(ccc1N)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100015196925 [1,0,0,0,0,0|3,0,0]=4 74 B29R4.13828428 COc1cc(ccc1N)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100011279103_100000261305 [1,0,0,0,0,0|3,0,0]=4 75 B29R4.13828428 COc1cc(ccc1O)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100000726020_200016987766 [1,0,0,0,0,0|2,0,0]=3 76 B29R4.13828428 COc1cc(ccc1O)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000726020_100000261305 [1,0,0,0,0,0|1,0,0]=2 77 B29R4.13828428 COc1cc(ccc1O)Sc2cc(nc3c2cccc3)c4ccccc4 62a_200016987766_100000694246 [1,0,0,0,0,0|3,0,0]=4 78 B29R4.13828428 COc1cc(ccc1O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000694246 [1,0,0,0,0,0|2,0,0]=3 79 B29R4.13828428 COc1cc(cnc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100010254219 [1,0,0,0,0,0|3,0,0]=4 80 B29R4.13828428 COc1cc(cnc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100010254219_100000261305 [1,0,0,0,0,0|3,0,0]=4 81 B29R4.13828428 COc1cc(ncc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100010067687 [1,0,0,0,0,0|3,0,0]=4 82 B29R4.13828428 COc1cc(ncc1C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100010067687_100000261305 [1,0,0,0,0,0|3,0,0]=4 83 B29R4.13828428 COc1nc(ccc1O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100010893133 [1,0,0,0,0,0|3,0,0]=4 84 B29R4.13828428 Cc1ccc(cc1C#N)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011216687_100000261305 [1,0,0,0,0,0|3,0,0]=4 85 B29R4.13828428 N#Cc1cc(ccc1O)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011249283_100000261305 [1,0,0,0,0,0|3,0,0]=4 86 B31R4.16524960 COc1ccc(cc1C(=O)C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000173343_100000261305 [0,1,0,0,0,0|3,0,0]=4 87 B31R4.16524960 COc1ccc(cc1C(=O)N)Nc2nc(nc3c2cccc3)c4ccccc4 27a_200011413973_100000261305 [0,1,0,0,0,0|3,0,0]=4 88 B31R4.16524960 COc1ccc(cc1[N+](=O)[O-])Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000042093_100000261305 [0,1,0,0,0,0|3,0,0]=4 89 B31R4.18641305 COc1cc(ccc1C(=O)C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000709911_100000261305 [0,1,0,0,0,0|3,0,0]=4 90 B31R4.18641305 COc1cc(ccc1[N+](=O)[O-])Nc2nc(nc3c2cccc3)c4ccccc4 27a_102125277084_100000261305 [0,1,0,0,0,0|3,0,0]=4 91 B31R4.35009252 CCOc1ccc(cc1OC)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000184985_100000261305 [0,1,0,0,0,0|1,0,0]=2 92 B31R4.35009252 CCOc1ncc(cc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_200010116856 [0,1,0,0,0,0|3,0,0]=4 93 B31R4.74673858 CNCc1cc(ccc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000690607 [0,1,0,0,0,0|3,0,0]=4 94 B31R4.74673858 CNCc1cc(ccc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000690607_100000261305 [0,1,0,0,0,0|3,0,0]=4 95 B31R4.74673858 COCc1cc(ccc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_200011493686 [0,1,0,0,0,0|2,0,0]=3 96 B31R4.74673858 COCc1cc(ccc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_200011493686_100000261305 [0,1,0,0,0,0|2,0,0]=3 97 B31R4.74673858 COc1ccc(cc1CCN)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000763266 [0,1,0,0,0,0|3,0,0]=4 98 B31R4.74673858 COc1ccc(cc1CCN)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000763266_100000261305 [0,1,0,0,0,0|3,0,0]=4 99 B31R4.114956184 COc1cc(c(cc1C#N)Nc2nc(nc3c2cccc3)c4ccccc4)C 27a_100021893188_100000261305 [0,1,0,0,0,0|3,0,0]=4 100 B31R4.114956184 COc1cc(c(cc1OC)Nc2cc(nc3c2cccc3)c4ccccc4)C 27a_100000183460_200016987766 [0,1,0,0,0,0|2,0,0]=3 101 B31R4.114956184 COc1cc(c(cc1OC)Nc2cc(nc3c2cccc3)c4ccccc4)F 27a_100000753170_200016987766 [0,1,0,0,0,0|2,0,0]=3 102 B31R4.114956184 COc1cc(c(cc1OC)Nc2nc(nc3c2cccc3)c4ccccc4)C 27a_100000183460_100000261305 [0,1,0,0,0,0|1,0,0]=2 103 B31R4.114956184 COc1cc(c(cc1OC)Nc2nc(nc3c2cccc3)c4ccccc4)F 27a_100000753170_100000261305 [0,1,0,0,0,0|1,0,0]=2 104 B31R4.114956184 COc1cc(c(cc1OC)Sc2nc(nc3c2cccc3)c4ccccc4)F 62a_200011765842_100000261305 [0,1,0,0,0,0|2,0,0]=3 105 B31R4.114956184 COc1cc(c(nc1OC)Sc2nc(nc3c2cccc3)c4ccccc4)C 62a_100000261305_200011016175 [0,1,0,0,0,0|3,0,0]=4 106 B31R4.175262307 COc1ccc(c(c1OC)C)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100010000156 [0,1,0,0,0,0|2,0,0]=3 107 B31R5.5792766 CN1CCc2c1ccc(c2)Nc3nc(nc4c3cccc4)c5ccccc5 27a_100000749598_100000261305 [0,0,0,1,0,0|3,0,0]=4 108 B31R5.14439017 c1ccc(cc1)c2cc(c3ccccc3n2)Nc4ccc5c(c4)CCCO5 27a_100138412508_200016987766 [0,0,0,1,0,0|3,0,0]=4 109 B31R5.14439017 c1ccc(cc1)c2cc(c3ccccc3n2)Nc4ccc5c(c4)OCCO5 27a_100020630400_200016987766 [0,0,0,1,0,0|2,0,0]=3 110 B31R5.14439017 c1ccc(cc1)c2cc(c3ccccc3n2)Sc4ccc5c(c4)OCCO5 62a_200016987766_100011216881 [0,0,0,1,0,0|3,0,0]=4 111 B31R5.14439017 c1ccc(cc1)c2nc(c3ccccc3n2)Nc4ccc5c(c4)CCCC5 27a_100011205400_100000261305 [0,0,0,1,0,0|3,0,0]=4 112 B31R5.14439017 c1ccc(cc1)c2nc(c3ccccc3n2)Nc4ccc5c(c4)CCCO5 27a_100138412508_100000261305 [0,0,0,1,0,0|2,0,0]=3 113 B31R5.14439017 c1ccc(cc1)c2nc(c3ccccc3n2)Nc4ccc5c(c4)OCCO5 27a_100020630400_100000261305 [0,0,0,1,0,0|1,0,0]=2 114 B31R5.14439017 c1ccc(cc1)c2nc(c3ccccc3n2)Sc4ccc5c(c4)CCCO5 62a_100000261305_100011393166 [0,0,0,1,0,0|3,0,0]=4 115 B31R5.14439017 c1ccc(cc1)c2nc(c3ccccc3n2)Sc4ccc5c(c4)CCCO5 62a_100011393166_100000261305 [0,0,0,1,0,0|3,0,0]=4 116 B31R5.14439017 c1ccc(cc1)c2nc(c3ccccc3n2)Sc4ccc5c(c4)NCCO5 62a_100000261305_100000708519 [0,0,0,1,0,0|3,0,0]=4 117 B31R5.14439017 c1ccc(cc1)c2nc(c3ccccc3n2)Sc4ccc5c(c4)OCCC5 62a_100000261305_100010700467 [0,0,0,1,0,0|3,0,0]=4 118 B31R5.14439017 c1ccc(cc1)c2nc(c3ccccc3n2)Sc4ccc5c(c4)OCCC5 62a_100010700467_100000261305 [0,0,0,1,0,0|3,0,0]=4 119 B31R5.14439017 c1ccc(cc1)c2nc(c3ccccc3n2)Sc4ccc5c(c4)OCCN5 62a_100000261305_100012355470 [0,0,0,1,0,0|3,0,0]=4 120 B31R5.14439017 c1ccc(cc1)c2nc(c3ccccc3n2)Sc4ccc5c(c4)OCCO5 62a_100000261305_100011216881 [0,0,0,1,0,0|2,0,0]=3 121 B31R5.14439017 c1ccc(cc1)c2nc(c3ccccc3n2)Sc4ccc5c(c4)OCCO5 62a_100011216881_100000261305 [0,0,0,1,0,0|2,0,0]=3 122 B29R4.1935269 COc1ccc(cc1OC)Nc2c(nc3n2cccn3)c4ccccc4 27a_100000187404_100010171953 [0,0,0,0,1,0|3,0,0]=4 123 B29R4.12328212 COc1cc(ccc1C#N)Nc2nc(nc3c2cccc3)c4cccs4 27a_100011999456_100000184998 [0,0,0,0,1,0|3,0,0]=4 124 B29R4.12328212 COc1cc(ccc1CO)Nc2nc(nc3c2cccc3)c4cccs4 27a_100012183141_100000184998 [0,0,0,0,1,0|3,0,0]=4 125 B29R4.12328212 COc1cc(cnc1OC)Sc2nc(nc3c2cccc3)c4cccs4 62a_100000184998_100010234541 [0,0,0,0,1,0|3,0,0]=4 126 B29R4.12328212 COc1ccc(cc1C#N)Nc2nc(nc3c2cccc3)c4cccs4 27a_100011204338_100000184998 [0,0,0,0,1,0|3,0,0]=4 127 B29R4.12328212 COc1ccc(cc1OC)Nc2nc(nc3c2cccc3)c4cccs4 27a_100000187404_100000184998 [0,0,0,0,1,0|1,0,0]=2 128 B29R4.12328212 COc1ccc(cc1OC)Sc2nc(nc3c2cccc3)c4cccs4 62a_100000184998_100011356967 [0,0,0,0,1,0|2,0,0]=3 129 B29R4.12328212 COc1ccc(nc1OC)Sc2nc(nc3c2cccc3)c4cccs4 62a_100000184998_100010214848 [0,0,0,0,1,0|3,0,0]=4 130 B29R4.123372236 COc1cc(cnc1OC)c2cc(nc3c2cccc3)c4ccccc4 271570a_100010246160_200016987766 [0,0,0,0,1,0|3,0,0]=4 131 B29R4.123372236 COc1ccc(cc1OC)c2cc(nc3c2cccc3)c4ccccc4 271570a_100000743868_200016987766 [0,0,0,0,1,0|2,0,0]=3 132 B31R4.138932746 COc1ccc(cc1OC)CNc2cc(nc3c2cccc3)c4ccccc4 27a_100000185555_200016987766 [0,0,0,0,0,1|2,0,0]=3 133 B31R4.138932746 COc1ccc(cc1OC)CNc2nc(nc3c2cccc3)c4ccccc4 27a_100000185555_100000261305 [0,0,0,0,0,1|1,0,0]=2 134 B31R4.138932746 COc1ccc(cc1OC)CSc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100011233839 [0,0,0,0,0,1|2,0,0]=3 135 B28R4.85823 CCc1ccc(cc1)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000211069_100000261305 [2,0,0,0,0,0|2,0,0]=4 136 B28R4.85823 COc1ccc(cc1)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100000184247_200016987766 [2,0,0,0,0,0|2,0,0]=4 137 B28R4.85823 COc1ccc(cc1)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000184247_100000261305 [2,0,0,0,0,0|1,0,0]=3 138 B28R4.85823 COc1ccc(cc1)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000171711 [2,0,0,0,0,0|2,0,0]=4 139 B28R4.85823 CSc1ccc(cc1)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000212337_100000261305 [2,0,0,0,0,0|1,1,0]=4 140 B28R4.6465498 Cc1cc(ccc1F)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000750164_100000261305 [2,0,0,0,0,0|2,0,0]=4 141 B28R4.6465498 Cc1cc(ccc1I)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000198070_100000261305 [2,0,0,0,0,0|2,0,0]=4 142 B28R4.6465498 Cc1cc(ccc1O)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100011218179_200016987766 [2,0,0,0,0,0|2,0,0]=4 143 B28R4.6465498 Cc1cc(ccc1O)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011218179_100000261305 [2,0,0,0,0,0|1,0,0]=3 144 B28R4.6465498 Cc1cc(ccc1O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000186361 [2,0,0,0,0,0|2,0,0]=4 145 B28R4.6465498 Cc1ccc(cc1C)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000724040_100000261305 [2,0,0,0,0,0|1,0,0]=3 146 B28R4.6465498 Cc1ccc(cc1F)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000210958_100000261305 [2,0,0,0,0,0|2,0,0]=4 147 B28R4.6465498 Cc1ccc(cc1I)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000184131_100000261305 [2,0,0,0,0,0|2,0,0]=4 148 B28R4.6465498 Cc1ccc(cc1O)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100000759471_200016987766 [2,0,0,0,0,0|2,0,0]=4 149 B28R4.6465498 Cc1ccc(cc1O)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000759471_100000261305 [2,0,0,0,0,0|1,0,0]=3 150 B28R4.6465498 Cc1ccc(cc1O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000685420 [2,0,0,0,0,0|2,0,0]=4 151 B28R4.6465498 Cc1ccc(cc1O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000685420_100000261305 [2,0,0,0,0,0|2,0,0]=4 152 B28R4.6465498 Oc1cc(ccc1Cl)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011934209_100000261305 [2,0,0,0,0,0|2,0,0]=4 153 B28R4.6465498 Oc1cc(ccc1F)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100012017398_100000261305 [2,0,0,0,0,0|2,0,0]=4 154 B28R4.6465498 Oc1ccc(cc1Br)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011534360_100000261305 [2,0,0,0,0,0|2,0,0]=4 155 B28R4.6465498 Oc1ccc(cc1Cl)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000744943_100000261305 [2,0,0,0,0,0|2,0,0]=4 156 B28R4.6465498 Oc1ccc(cc1F)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011220035_100000261305 [2,0,0,0,0,0|2,0,0]=4 157 B28R4.6465498 Oc1ccc(cc1O)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100102946323_200016987766 [2,0,0,0,0,0|2,0,0]=4 158 B28R4.6465498 Oc1ccc(cc1O)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100102946323_100000261305 [2,0,0,0,0,0|1,0,0]=3 159 B28R4.6465498 Oc1ccc(cc1O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100009813601 [2,0,0,0,0,0|2,0,0]=4 160 B28R4.2065554 CCc1cccc(c1)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000211250_100000261305 [2,0,0,0,0,0|2,0,0]=4 161 B28R4.2065554 COc1cccc(c1)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100000210024_200016987766 [2,0,0,0,0,0|2,0,0]=4 162 B28R4.2065554 COc1cccc(c1)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000210024_100000261305 [2,0,0,0,0,0|1,0,0]=3 163 B28R4.2065554 COc1cccc(c1)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000170001 [2,0,0,0,0,0|2,0,0]=4 164 B28R4.2065554 CSc1cccc(c1)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000210049_100000261305 [2,0,0,0,0,0|1,1,0]=4 165 B30R4.20177345 Cc1cc(ccc1N(C)C)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000738307_100000261305 [1,1,0,0,0,0|2,0,0]=4 166 B30R4.22011505 COCc1ccc(cc1F)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100012145864_100000261305 [1,1,0,0,0,0|2,0,0]=4 167 B30R4.74510321 COc1cc(c(cc1C)Sc2nc(nc3c2cccc3)c4ccccc4)N 62a_100000261305_100010244135 [1,1,0,0,0,0|2,0,0]=4 168 B30R4.74510321 COc1cc(c(cc1C)Sc2nc(nc3c2cccc3)c4ccccc4)N 62a_100010244135_100000261305 [1,1,0,0,0,0|2,0,0]=4 169 B30R4.75315386 COc1ccc(c(c1C)C)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100025755787_100000261305 [1,1,0,0,0,0|1,0,0]=3 170 B30R4.90233749 COc1ccc(cc1I)N(C)c2nc(nc3c2cccc3)c4ccccc4 27a_114948341033_100000261305 [1,1,0,0,0,0|2,0,0]=4 171 B30R4.129609297 COc1c(cc(cc1Br)Nc2nc(nc3c2cccc3)c4ccccc4)F 27a_200009816006_100000261305 [1,1,0,0,0,0|2,0,0]=4 172 B30R4.129609297 COc1c(cc(cc1C)Nc2nc(nc3c2cccc3)c4ccccc4)C 27a_100000187574_100000261305 [1,1,0,0,0,0|1,0,0]=3 173 B30R4.129609297 COc1c(cc(cc1Cl)Nc2nc(nc3c2cccc3)c4ccccc4)F 27a_200000094053_100000261305 [1,1,0,0,0,0|2,0,0]=4 174 B30R4.5605101 COc1cc(cc(c1O)O)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_200159242197 [1,1,0,0,0,0|2,0,0]=4 175 B30R4.7558157 Cc1ccc(cc1N(C)C)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011708272_100000261305 [1,1,0,0,0,0|2,0,0]=4 176 B30R4.74484696 COc1cc(c(cc1C)N)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_200010584344 [1,1,0,0,0,0|2,0,0]=4 177 B30R4.74484696 COc1cc(c(cc1C)N)Sc2nc(nc3c2cccc3)c4ccccc4 62a_200010584344_100000261305 [1,1,0,0,0,0|2,0,0]=4 178 B30R4.74484696 COc1cc(c(cc1O)F)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100010189133 [1,1,0,0,0,0|2,0,0]=4 179 B30R4.96858949 COc1cc(ccc1F)N(C)c2nc(nc3c2cccc3)c4ccccc4 27a_200012002703_100000261305 [1,1,0,0,0,0|2,0,0]=4 180 B30R4.21985214 CCOc1ccc(cc1OC)Nc2nc(nc3c2cccc3)c4cccs4 27a_100000184985_100000184998 [0,1,0,0,1,0|1,0,0]=3 181 B30R4.48381211 COCc1cc(ccc1OC)Sc2nc(nc3c2cccc3)c4cccs4 62a_100000184998_200011493686 [0,1,0,0,1,0|2,0,0]=4 182 B30R4.48381211 COCc1cc(ccc1OC)Sc2nc(nc3c2cccc3)c4cccs4 62a_200011493686_100000184998 [0,1,0,0,1,0|2,0,0]=4 183 B30R4.111263071 COc1ccc(c(c1OC)C)Sc2nc(nc3c2cccc3)c4cccs4 62a_100000184998_100010000156 [0,1,0,0,1,0|2,0,0]=4 184 B30R4.365323713 COc1cc(c(cc1OC)Nc2nc(nc3c2cccc3)c4cccs4)C 27a_100000183460_100000184998 [0,1,0,0,1,0|1,0,0]=3 185 B30R4.365323713 COc1cc(c(cc1OC)Nc2nc(nc3c2cccc3)c4cccs4)F 27a_100000753170_100000184998 [0,1,0,0,1,0|1,0,0]=3 186 B30R4.365323713 COc1cc(c(cc1OC)Sc2nc(nc3c2cccc3)c4cccs4)F 62a_200011765842_100000184998 [0,1,0,0,1,0|2,0,0]=4 187 B30R4.255385098 CCOc1cc(ccc1OC)c2cc(nc3c2cccc3)c4ccccc4 271570a_200000097474_200016987766 [0,1,0,0,1,0|2,0,0]=4 188 B32R4.60078497 COc1cc(cc(c1OC)Br)CNc2nc(nc3c2cccc3)c4ccccc4 27a_100000748475_100000261305 [0,1,0,0,0,1|1,0,0]=3 189 B32R4.66206959 CCOc1cc(ccc1OC)CNc2cc(nc3c2cccc3)c4ccccc4 27a_100000755831_200016987766 [0,1,0,0,0,1|2,0,0]=4 190 B32R4.66206959 CCOc1cc(ccc1OC)CNc2nc(nc3c2cccc3)c4ccccc4 27a_100000755831_100000261305 [0,1,0,0,0,1|1,0,0]=3 191 B32R4.100055703 COc1cc(c(cc1OC)CNc2cc(nc3c2cccc3)c4ccccc4)F 27a_100132302102_200016987766 [0,1,0,0,0,1|2,0,0]=4 192 B32R4.100055703 COc1cc(c(cc1OC)CNc2nc(nc3c2cccc3)c4ccccc4)F 27a_100132302102_100000261305 [0,1,0,0,0,1|1,0,0]=3 193 B32R4.150619094 COc1ccc(cc1OC)[C@@H](C)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100025717294_100000261305 [0,1,0,0,0,1|1,0,0]=3 194 B32R4.192384221 CCOc1ccc(cc1OC)CNc2cc(nc3c2cccc3)c4ccccc4 27a_200000739100_200016987766 [0,1,0,0,0,1|2,0,0]=4 195 B32R4.192384221 CCOc1ccc(cc1OC)CNc2nc(nc3c2cccc3)c4ccccc4 27a_200000739100_100000261305 [0,1,0,0,0,1|1,0,0]=3 196 B32R4.419033557 COc1ccc(c(c1OC)Cl)CNc2nc(nc3c2cccc3)c4ccccc4 27a_102515433231_100000261305 [0,1,0,0,0,1|1,0,0]=3 197 B32R4.1105058527 COc1ccc(cc1OC)CN(C)c2cc(nc3c2cccc3)c4ccccc4 27a_100000180827_200016987766 [0,1,0,0,0,1|2,0,0]=4 198 B32R4.1105058527 COc1ccc(cc1OC)CN(C)c2nc(nc3c2cccc3)c4ccccc4 27a_100000180827_100000261305 [0,1,0,0,0,1|1,0,0]=3 199 B32R4.413271647 COC(=O)c1cc(ccc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100012047238 [0,2,0,0,0,0|2,0,0]=4 200 B32R4.413271647 COC(=O)c1cc(ccc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100012047238_100000261305 [0,2,0,0,0,0|2,0,0]=4 201 B32R4.400503290 CNC(=O)c1ccc(cc1OC)Nc2nc(nc3c2cccc3)c4ccccc4 27a_200011977860_100000261305 [0,2,0,0,0,0|2,0,0]=4 202 B32R4.400503290 COC(=O)c1ccc(cc1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000708095_100000261305 [0,2,0,0,0,0|2,0,0]=4 203 B32R4.17724525 COc1cc(ccc1NC(=O)C)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100015186897_100000261305 [0,2,0,0,0,0|2,0,0]=4 204 B32R4.17724525 COc1cc(ccc1OC(F)F)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011279676_100000261305 [0,2,0,0,0,0|1,0,0]=3 205 B32R4.20569217 CCCOc1ccc(cc1OC)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011611390_100000261305 [0,2,0,0,0,0|1,0,0]=3 206 B32R4.20569217 COc1cc(ccc1OCCO)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100012347953 [0,2,0,0,0,0|2,0,0]=4 207 B32R4.20569217 COc1cc(ccc1OCCO)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100012347953_100000261305 [0,2,0,0,0,0|2,0,0]=4 208 B32R4.323499686 CCOc1ccc(cc1OCC)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000682499_100000261305 [0,2,0,0,0,0|1,0,0]=3 209 B32R4.60090741 COc1cc(cc(c1OC)C#N)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_200010153271 [0,2,0,0,0,0|2,0,0]=4 210 B32R4.60090741 COc1cc(cc(c1OC)OC)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100000209829_200016987766 [0,2,0,0,0,0|2,0,0]=4 211 B32R4.60090741 COc1cc(cc(c1OC)OC)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000209829_100000261305 [0,2,0,0,0,0|1,0,0]=3 212 B32R4.88191249 COc1ccc(cc1OCC#N)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_200010203062 [0,2,0,0,0,0|2,0,0]=4 213 B32R4.88191249 COc1ccc(cc1OCC#N)Sc2nc(nc3c2cccc3)c4ccccc4 62a_200010203062_100000261305 [0,2,0,0,0,0|2,0,0]=4 214 B32R4.150501416 COc1ccc(cc1NC(=O)C)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000736378_100000261305 [0,2,0,0,0,0|2,0,0]=4 215 B32R4.150501416 COc1ccc(cc1OC(F)F)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000735751_100000261305 [0,2,0,0,0,0|1,0,0]=3 216 B32R4.428340006 COc1cc(c(cc1OC)Nc2cc(nc3c2cccc3)c4ccccc4)C#N 27a_100011218292_200016987766 [0,2,0,0,0,0|2,0,0]=4 217 B32R4.428340006 COc1cc(c(cc1OC)Nc2nc(nc3c2cccc3)c4ccccc4)C#N 27a_100011218292_100000261305 [0,2,0,0,0,0|1,0,0]=3 218 B32R4.428340006 COc1cc(c(cc1OC)Sc2nc(nc3c2cccc3)c4ccccc4)C#N 62a_100000261305_100000188247 [0,2,0,0,0,0|2,0,0]=4 219 B32R4.428340006 COc1cc(c(cc1OC)Sc2nc(nc3c2cccc3)c4ccccc4)C=O 62a_100000170863_100000261305 [0,2,0,0,0,0|2,0,0]=4 220 B32R4.428340006 COc1cc(c(cc1OC)Sc2nc(nc3c2cccc3)c4ccccc4)CO 62a_200000246283_100000261305 [0,2,0,0,0,0|2,0,0]=4 221 B32R4.419042526 COc1ccc(c(c1OC)OC)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100000751027_200016987766 [0,2,0,0,0,0|2,0,0]=4 222 B32R4.419042526 COc1ccc(c(c1OC)OC)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000751027_100000261305 [0,2,0,0,0,0|1,0,0]=3 223 B32R4.23573785 COc1ccc2c(cc(nc2c1)c3ccccc3)Nc4ccc(c(c4)OC)OC 27a_100000187404_100016987491 [0,2,0,0,0,0|2,0,0]=4 224 B32R4.1040608681 CCN(c1ccc(c(c1)OC)OC)c2nc(nc3c2cccc3)c4ccccc4 27a_100000221037_100000261305 [0,2,0,0,0,0|1,0,0]=3 225 B30R5.21960021 c1ccc(cc1)c2cc(c3ccccc3n2)Nc4ccc5c(c4)CCO5 27a_100000736984_200016987766 [1,0,0,1,0,0|2,0,0]=4 226 B30R5.21960021 c1ccc(cc1)c2cc(c3ccccc3n2)Nc4ccc5c(c4)OCO5 27a_100000209953_200016987766 [1,0,0,1,0,0|2,0,0]=4 227 B30R5.21960021 c1ccc(cc1)c2nc(c3ccccc3n2)Nc4ccc5c(c4)CCC5 27a_100000211504_100000261305 [1,0,0,1,0,0|2,0,0]=4 228 B30R5.21960021 c1ccc(cc1)c2nc(c3ccccc3n2)Nc4ccc5c(c4)CCO5 27a_100000736984_100000261305 [1,0,0,1,0,0|1,0,0]=3 229 B30R5.21960021 c1ccc(cc1)c2nc(c3ccccc3n2)Nc4ccc5c(c4)OCO5 27a_100000209953_100000261305 [1,0,0,1,0,0|1,0,0]=3 230 B30R5.21960021 c1ccc(cc1)c2nc(c3ccccc3n2)Sc4ccc5c(c4)CCO5 62a_100000261305_100000729065 [1,0,0,1,0,0|2,0,0]=4 231 B30R5.21960021 c1ccc(cc1)c2nc(c3ccccc3n2)Sc4ccc5c(c4)CCO5 62a_100000729065_100000261305 [1,0,0,1,0,0|2,0,0]=4 232 B30R5.21650727 c1csc(c1)c2nc(c3ccccc3n2)Nc4ccc5c(c4)CCCO5 27a_100138412508_100000184998 [0,0,0,1,1,0|2,0,0]=4 233 B30R5.21650727 c1csc(c1)c2nc(c3ccccc3n2)Nc4ccc5c(c4)OCCO5 27a_100020630400_100000184998 [0,0,0,1,1,0|1,0,0]=3 234 B30R5.21650727 c1csc(c1)c2nc(c3ccccc3n2)Sc4ccc5c(c4)OCCO5 62a_100000184998_100011216881 [0,0,0,1,1,0|2,0,0]=4 235 B30R5.21650727 c1csc(c1)c2nc(c3ccccc3n2)Sc4ccc5c(c4)OCCO5 62a_100011216881_100000184998 [0,0,0,1,1,0|2,0,0]=4 236 B30R5.21960013 c1ccc(cc1)c2cc(c3ccccc3n2)c4ccc5c(c4)OCCO5 271570a_100012350598_200016987766 [0,0,0,1,1,0|2,0,0]=4 237 B32R5.58662821 c1ccc(cc1)c2cc(c3ccccc3n2)NCc4ccc5c(c4)OCCO5 27a_100000684186_200016987766 [0,0,0,1,0,1|2,0,0]=4 238 B32R5.58662821 c1ccc(cc1)c2nc(c3ccccc3n2)NCc4ccc5c(c4)OCCO5 27a_100000684186_100000261305 [0,0,0,1,0,1|1,0,0]=3 239 B32R5.33921102 CN1CCOc2c1cc(cc2)Nc3nc(nc4c3cccc4)c5ccccc5 27a_100000105042_100000261305 [0,1,0,1,0,0|2,0,0]=4 240 B32R5.13019139 c1ccc(cc1)c2cc(c3ccccc3n2)Nc4ccc5c(c4)OCCCO5 27a_100000181267_200016987766 [0,1,0,1,0,0|2,0,0]=4 241 B32R5.13019139 c1ccc(cc1)c2nc(c3ccccc3n2)Nc4ccc5c(c4)OCCCO5 27a_100000181267_100000261305 [0,1,0,1,0,0|1,0,0]=3 242 B32R5.13019139 c1ccc(cc1)c2nc(c3ccccc3n2)Sc4ccc5c(c4)OCCCO5 62a_100000261305_100000739260 [0,1,0,1,0,0|2,0,0]=4 243 B32R5.13019139 c1ccc(cc1)c2nc(c3ccccc3n2)Sc4ccc5c(c4)OCCCO5 62a_100000739260_100000261305 [0,1,0,1,0,0|2,0,0]=4 244 B32R5.575688 Clc1cc2c(cc1Nc3nc(nc4c3cccc4)c5ccccc5)OCCO2 27a_100000739234_100000261305 [0,1,0,1,0,0|1,0,0]=3 245 B32R5.23284240 Cc1c(ccc2c1OCCO2)Sc3nc(nc4c3cccc4)c5ccccc5 62a_100000261305_100010072848 [0,1,0,1,0,0|2,0,0]=4 246 B32R5.23284240 Cc1c(ccc2c1OCCO2)Sc3nc(nc4c3cccc4)c5ccccc5 62a_100010072848_100000261305 [0,1,0,1,0,0|2,0,0]=4 247 B28R3.2258698 COc1ccc(cc1OC)NN=C(Cc2ccccc2)c3ccccc3 4a_100000071703_100000183078 [0,0,1,0,1,0|2,0,0]=4 248 B28R4.9328533 COc1ccc(cc1Br)Nc2nc(nc3c2cccc3)c4cccs4 27a_100000187427_100000184998 [1,0,0,0,1,0|2,0,0]=4 249 B28R4.9328533 COc1ccc(cc1C)Nc2nc(nc3c2cccc3)c4cccs4 27a_100000743268_100000184998 [1,0,0,0,1,0|1,0,0]=3 250 B28R4.9328533 COc1ccc(cc1C)Sc2nc(nc3c2cccc3)c4cccs4 62a_100000184998_100011219705 [1,0,0,0,1,0|2,0,0]=4 251 B28R4.9328533 COc1ccc(cc1C)Sc2nc(nc3c2cccc3)c4cccs4 62a_100011219705_100000184998 [1,0,0,0,1,0|2,0,0]=4 252 B28R4.9328533 COc1ccc(cc1Cl)Nc2nc(nc3c2cccc3)c4cccs4 27a_100000211044_100000184998 [1,0,0,0,1,0|2,0,0]=4 253 B28R4.9328533 COc1ccc(cc1F)Nc2nc(nc3c2cccc3)c4cccs4 27a_100000740183_100000184998 [1,0,0,0,1,0|2,0,0]=4 254 B28R4.9328533 COc1ccc(cc1I)Nc2nc(nc3c2cccc3)c4cccs4 27a_100011356947_100000184998 [1,0,0,0,1,0|2,0,0]=4 255 B28R4.9328533 COc1ccc(cc1O)Nc2nc(nc3c2cccc3)c4cccs4 27a_100000211920_100000184998 [1,0,0,0,1,0|1,0,0]=3 256 B28R4.9328533 COc1ccc(cc1O)Sc2nc(nc3c2cccc3)c4cccs4 62a_100000184998_100009816560 [1,0,0,0,1,0|2,0,0]=4 257 B28R4.75461408 COc1ccc(cc1C)c2cc(nc3c2cccc3)c4ccccc4 271570a_100011217508_200016987766 [1,0,0,0,1,0|2,0,0]=4 258 B28R4.75461408 COc1ccc(cc1O)c2cc(nc3c2cccc3)c4ccccc4 271570a_100010199686_200016987766 [1,0,0,0,1,0|2,0,0]=4 259 B28R4.10220940 COc1cc(ccc1C)c2cc(nc3c2cccc3)c4ccccc4 271570a_100010045235_200016987766 [1,0,0,0,1,0|2,0,0]=4 260 B28R4.10220940 COc1cc(ccc1O)c2cc(nc3c2cccc3)c4ccccc4 271570a_100000040328_200016987766 [1,0,0,0,1,0|2,0,0]=4 261 B28R4.10278147 COc1cc(ccc1Br)Nc2nc(nc3c2cccc3)c4cccs4 27a_100000765947_100000184998 [1,0,0,0,1,0|2,0,0]=4 262 B28R4.10278147 COc1cc(ccc1C)Nc2nc(nc3c2cccc3)c4cccs4 27a_100011279678_100000184998 [1,0,0,0,1,0|1,0,0]=3 263 B28R4.10278147 COc1cc(ccc1C)Sc2nc(nc3c2cccc3)c4cccs4 62a_100000184998_100011830276 [1,0,0,0,1,0|2,0,0]=4 264 B28R4.10278147 COc1cc(ccc1C)Sc2nc(nc3c2cccc3)c4cccs4 62a_100011830276_100000184998 [1,0,0,0,1,0|2,0,0]=4 265 B28R4.10278147 COc1cc(ccc1Cl)Nc2nc(nc3c2cccc3)c4cccs4 27a_100000742311_100000184998 [1,0,0,0,1,0|2,0,0]=4 266 B28R4.10278147 COc1cc(ccc1F)Nc2nc(nc3c2cccc3)c4cccs4 27a_100000701188_100000184998 [1,0,0,0,1,0|2,0,0]=4 267 B28R4.10278147 COc1cc(ccc1I)Nc2nc(nc3c2cccc3)c4cccs4 27a_100000746945_100000184998 [1,0,0,0,1,0|2,0,0]=4 268 B28R4.10278147 COc1cc(ccc1O)Nc2nc(nc3c2cccc3)c4cccs4 27a_100000726020_100000184998 [1,0,0,0,1,0|1,0,0]=3 269 B28R4.10278147 COc1cc(ccc1O)Sc2nc(nc3c2cccc3)c4cccs4 62a_100000184998_100000694246 [1,0,0,0,1,0|2,0,0]=4 270 B30R4.10983824 COc1ccc(cc1Br)CNc2nc(nc3c2cccc3)c4ccccc4 27a_100159240714_100000261305 [1,0,0,0,0,1|2,0,0]=4 271 B30R4.10983824 COc1ccc(cc1C)CNc2cc(nc3c2cccc3)c4ccccc4 27a_100102679029_200016987766 [1,0,0,0,0,1|2,0,0]=4 272 B30R4.10983824 COc1ccc(cc1C)CNc2nc(nc3c2cccc3)c4ccccc4 27a_100102679029_100000261305 [1,0,0,0,0,1|1,0,0]=3 273 B30R4.10983824 COc1ccc(cc1C)CSc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_200011290836 [1,0,0,0,0,1|2,0,0]=4 274 B30R4.10983824 COc1ccc(cc1C)CSc2nc(nc3c2cccc3)c4ccccc4 62a_200011290836_100000261305 [1,0,0,0,0,1|2,0,0]=4 275 B30R4.10983824 COc1ccc(cc1Cl)CNc2nc(nc3c2cccc3)c4ccccc4 27a_100000008799_100000261305 [1,0,0,0,0,1|2,0,0]=4 276 B30R4.10983824 COc1ccc(cc1F)CNc2nc(nc3c2cccc3)c4ccccc4 27a_100000737316_100000261305 [1,0,0,0,0,1|2,0,0]=4 277 B30R4.10983824 COc1ccc(cc1O)CNc2cc(nc3c2cccc3)c4ccccc4 27a_100000740000_200016987766 [1,0,0,0,0,1|2,0,0]=4 278 B30R4.10983824 COc1ccc(cc1O)CNc2nc(nc3c2cccc3)c4ccccc4 27a_100000740000_100000261305 [1,0,0,0,0,1|1,0,0]=3 279 B30R4.1941545 COc1ccc(cc1OC)Nc2nc3ccccc3cc2c4ccccc4 27a_100000187404_100015267906 [0,0,0,0,1,1|2,0,0]=4 280 B30R4.1941545 COc1ccc(cc1OC)Nc2nc3ccccc3nc2c4ccccc4 27a_100000187404_100016999723 [0,0,0,0,1,1|1,0,0]=3 281 B30R4.89549794 COc1ccc(cc1OC)Nc2nnc(c3c2cccc3)c4ccccc4 27a_100000187404_100000260814 [0,0,0,0,1,1|1,0,0]=3 282 B30R4.110963599 COc1ccc(cc1OC)NCc2nc(n3c2cccc3)c4ccccc4 207a_100000187404_200020602505 [0,0,0,0,1,1|2,0,0]=4 283 B30R4.110963599 COc1ccc(cc1OC)NCc2nc(n3c2cccc3)c4ccccc4 270302a_100000187404_200020602505 [0,0,0,0,1,1|2,0,0]=4 284 B30R4.89481990 COc1ccc(cc1OC)CNc2nc(nc3c2cccc3)c4cccs4 27a_100000185555_100000184998 [0,0,0,0,1,1|1,0,0]=3 285 B30R4.89481990 COc1ccc(cc1OC)CSc2nc(nc3c2cccc3)c4cccs4 62a_100000184998_100011233839 [0,0,0,0,1,1|2,0,0]=4 286 B30R4.12527532 COc1cc(cc(c1)OC)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100000210928_200016987766 [0,0,0,0,1,1|2,0,0]=4 287 B30R4.12527532 COc1cc(cc(c1)OC)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000210928_100000261305 [0,0,0,0,1,1|1,0,0]=3 288 B30R4.12527532 COc1cc(cc(c1)Sc2nc(nc3c2cccc3)c4ccccc4)OC 62a_100000261305_100000685218 [0,0,0,0,1,1|2,0,0]=4 289 B30R4.73873384 COc1cccc(c1OC)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100011217386_200016987766 [0,0,0,0,1,1|2,0,0]=4 290 B30R4.73873384 COc1cccc(c1OC)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100011217386_100000261305 [0,0,0,0,1,1|1,0,0]=3 291 B30R4.73873384 COc1cccc(c1OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100010163134 [0,0,0,0,1,1|2,0,0]=4 292 B30R4.75403066 COc1cc(ccc1Nc2nc(nc3c2cccc3)c4ccccc4)SC 27a_100000766855_100000261305 [0,0,0,0,1,1|1,1,0]=4 293 B30R4.75403066 COc1ccc(c(c1)OC)Nc2cc(nc3c2cccc3)c4ccccc4 27a_100000211191_200016987766 [0,0,0,0,1,1|2,0,0]=4 294 B30R4.75403066 COc1ccc(c(c1)OC)Nc2nc(nc3c2cccc3)c4ccccc4 27a_100000211191_100000261305 [0,0,0,0,1,1|1,0,0]=3 295 B30R4.75403066 COc1ccc(c(c1)OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100000750026 [0,0,0,0,1,1|2,0,0]=4 296 B30R4.75403066 COc1ccc(c(c1)OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000750026_100000261305 [0,0,0,0,1,1|2,0,0]=4 297 B30R4.75403066 COc1ccc(c(n1)OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100009816055 [0,0,0,0,1,1|2,0,0]=4 298 B30R4.75403066 COc1ccc(c(n1)OC)Sc2nc(nc3c2cccc3)c4ccccc4 62a_100009816055_100000261305 [0,0,0,0,1,1|2,0,0]=4 299 B32R4.120047700 COc1ccc(cc1OC)CCNc2cc(nc3c2cccc3)c4ccccc4 27a_100000210947_200016987766 [0,0,0,0,0,2|2,0,0]=4 300 B32R4.120047700 COc1ccc(cc1OC)CCNc2nc(nc3c2cccc3)c4ccccc4 27a_100000210947_100000261305 [0,0,0,0,0,2|1,0,0]=3 301 B32R4.120047700 COc1ccc(cc1OC)CCSc2nc(nc3c2cccc3)c4ccccc4 62a_100000261305_100011740610 [0,0,0,0,0,2|2,0,0]=4