0 B17R3.54615 Oc1cc2ccccc2c3c1cccc3 271570a_203496583355_100009813645 [1,0,0,0,0,0|2,0,1]=4 1 B19R3.444415 O=C1C(=O)c2ccc(cc2-c3c1cccc3)O 271570a_203496583355_100015191286 [0,1,0,0,0,0|2,0,0]=3 2 B17R2.231 CCC(=O)c1ccccc1c2cccnc2 1458a_100011399806_100000210202 [0,0,1,0,0,0|2,0,1]=4 3 B17R2.231 CNC(=O)c1ccccc1c2cccnc2 1626a_100102657272_100011399806 [0,0,1,0,0,0|3,0,0]=4 4 B17R2.231 CNC(=O)c1ccccc1c2cccnc2 240690a_100102657272_100011399806 [0,0,1,0,0,0|3,0,0]=4 5 B17R2.231 CNC(=O)c1ccccc1c2cccnc2 271570a_100000757648_100000155073 [0,0,1,0,0,0|3,0,0]=4 6 B17R2.231 CNC(=O)c1ccccc1c2cccnc2 271570a_100010369252_100000752921 [0,0,1,0,0,0|3,0,0]=4 7 B17R2.231 CNC(=O)c1ccccc1c2cccnc2 527a_100102657272_100011399806 [0,0,1,0,0,0|3,0,0]=4 8 B17R2.231 COC(=O)c1ccccc1c2cccnc2 271570a_100000034818_100000752921 [0,0,1,0,0,0|3,0,0]=4 9 B17R2.231 COC(=O)c1ccccc1c2cccnc2 271570a_100000757648_100000148710 [0,0,1,0,0,0|3,0,0]=4 10 B17R2.231 COC(=O)c1ncccc1c2ccccc2 271570a_100011218836_100011935214 [0,0,1,0,0,0|3,0,0]=4 11 B17R2.231 COC(=O)c1ncccc1c2cccnc2 271570a_100000757648_100011935214 [0,0,1,0,0,0|2,0,0]=3 12 B17R2.231 COC(=O)c1ncccc1c2cnccn2 271570a_100011962566_100011935214 [0,0,1,0,0,0|3,0,0]=4 13 B17R2.231 COC(=O)c1ncccc1c2cncnc2 271570a_100000707473_100011935214 [0,0,1,0,0,0|3,0,0]=4 14 B17R2.231 COC(=O)c1nccnc1c2cccnc2 271570a_100000757648_100000688410 [0,0,1,0,0,0|3,0,0]=4 15 B17R2.231 COC(=O)c1ncncc1c2cccnc2 271570a_100000757648_100012360100 [0,0,1,0,0,0|3,0,0]=4 16 B17R2.231 NNC(=O)c1ccccc1c2cccnc2 271570a_100000757648_100000190081 [0,0,1,0,0,0|3,0,0]=4 17 B17R2.231 O=C(CF)c1ccccc1c2cccnc2 1458a_100011399806_100015361967 [0,0,1,0,0,0|2,0,1]=4 18 B17R2.2758 C#Cc1ccccc1c2cccnc2C=O 271570a_100000099761_100011934733 [0,0,1,0,0,0|2,0,1]=4 19 B17R2.2758 C=Cc1ccccc1c2ccccc2C=O 271570a_100000037480_100000211189 [0,0,1,0,0,0|3,0,0]=4 20 B17R2.2758 C=Cc1ccccc1c2cccnc2C=O 271570a_100000037480_100011934733 [0,0,1,0,0,0|2,0,0]=3 21 B17R2.2758 CCc1ccccc1c2cccnc2C=O 271570a_100011216252_100011934733 [0,0,1,0,0,0|2,0,1]=4 22 B17R2.2758 CCc1ncccc1c2ccccc2C=O 271570a_100000740022_100009877225 [0,0,1,0,0,0|2,0,1]=4 23 B17R2.2758 CNc1ncccc1c2ccccc2C=O 271570a_100000740022_100000700899 [0,0,1,0,0,0|3,0,0]=4 24 B17R2.2758 COc1ccccc1c2cccnc2C=O 271570a_100000756652_100011934733 [0,0,1,0,0,0|3,0,0]=4 25 B17R2.2758 COc1ncccc1c2ccccc2C=O 271570a_100000740022_100000047025 [0,0,1,0,0,0|3,0,0]=4 26 B17R2.2758 COc1ncccc1c2ccccc2C=O 271570a_100011290909_100000211189 [0,0,1,0,0,0|3,0,0]=4 27 B17R2.2758 COc1ncccc1c2cccnc2C=O 271570a_100011290909_100011934733 [0,0,1,0,0,0|2,0,0]=3 28 B17R2.2758 CSc1ccccc1c2cccnc2C=O 271570a_100011218165_100011934733 [0,0,1,0,0,0|3,0,0]=4 29 B17R2.2758 CSc1ncccc1c2ccccc2C=O 271570a_100000740022_100011465278 [0,0,1,0,0,0|3,0,0]=4 30 B17R2.2758 N#Cc1ccccc1c2cccnc2C=O 271570a_100000043008_100011934733 [0,0,1,0,0,0|2,0,1]=4 31 B17R2.2758 N#Cc1ncccc1c2ccccc2C=O 271570a_100000062270_100000211189 [0,0,1,0,0,0|2,0,1]=4 32 B17R2.2758 N#Cc1ncccc1c2ccccc2C=O 271570a_100000740022_100000685805 [0,0,1,0,0,0|2,0,1]=4 33 B17R2.2758 N#Cc1ncccc1c2cccnc2C=O 271570a_100000062270_100011934733 [0,0,1,0,0,0|1,0,1]=3 34 B17R2.2758 NCc1ccccc1c2cccnc2C=O 271570a_100020632975_100011934733 [0,0,1,0,0,0|2,0,1]=4 35 B17R2.2758 NCc1ncccc1c2ccccc2C=O 271570a_100000740022_100020591323 [0,0,1,0,0,0|2,0,1]=4 36 B17R2.2758 NNc1ncccc1c2ccccc2C=O 271570a_100000740022_100011464834 [0,0,1,0,0,0|3,0,0]=4 37 B17R2.2758 O=Cc1ccccc1c2ccccc2C=O 271570a_100000740022_100000211189 [0,0,1,0,0,0|2,0,0]=3 38 B17R2.2758 O=Cc1ccccc1c2cccnc2C=O 271570a_100000740022_100011934733 [0,0,1,0,0,0|1,0,0]=2 39 B17R2.2758 O=Cc1ccccc1c2cccnc2CO 271570a_100000740022_100011996772 [0,0,1,0,0,0|1,0,2]=4 40 B17R2.2758 O=Cc1ccccc1c2ccncc2C=O 271570a_100000740022_100000050567 [0,0,1,0,0,0|3,0,0]=4 41 B17R2.2758 O=Cc1ccccc1c2cnccc2C=O 271570a_100000740022_100011934409 [0,0,1,0,0,0|3,0,0]=4 42 B17R2.2758 O=Cc1ccccc1c2ncccc2C=O 271570a_100000740022_100009816751 [0,0,1,0,0,0|3,0,0]=4 43 B17R2.2758 O=Cc1ncccc1c2ccccc2CO 271570a_100000066922_100011934733 [0,0,1,0,0,0|1,0,2]=4 44 B16R2.87 CC(=O)c1ccccc1c2cccnc2 1458a_100011399806_200000210301 [1,0,1,0,0,0|1,0,1]=4 45 B16R2.87 CC(=O)c1ccccc1c2cccnc2 271570a_100000757648_100000751169 [1,0,1,0,0,0|1,0,1]=4 46 B16R2.87 CC(=O)c1ccccc1c2cccnc2 271570a_100010158976_100000752921 [1,0,1,0,0,0|1,0,1]=4 47 B16R2.87 CC(=O)c1ncccc1c2ccccc2 271570a_100011218836_100012348690 [1,0,1,0,0,0|1,0,1]=4 48 B16R2.87 CC(=O)c1ncccc1c2cccnc2 271570a_100000757648_100012348690 [1,0,1,0,0,0|0,0,1]=3 49 B16R2.87 CC(=O)c1ncccc1c2cnccn2 271570a_100011962566_100012348690 [1,0,1,0,0,0|1,0,1]=4 50 B16R2.87 CC(=O)c1ncccc1c2cncnc2 271570a_100000707473_100012348690 [1,0,1,0,0,0|1,0,1]=4 51 B16R2.87 CC(=O)c1nccnc1c2cccnc2 271570a_100000757648_100000099859 [1,0,1,0,0,0|1,0,1]=4 52 B16R2.87 NC(=O)c1ccccc1c2cccnc2 271570a_100000041535_100000752921 [1,0,1,0,0,0|2,0,0]=4 53 B16R2.87 NC(=O)c1ccccc1c2cccnc2 271570a_100000757648_100000162227 [1,0,1,0,0,0|2,0,0]=4 54 B16R2.87 NC(=O)c1ncccc1c2ccccc2 271570a_100011218836_200012359670 [1,0,1,0,0,0|2,0,0]=4 55 B16R2.87 NC(=O)c1ncccc1c2cccnc2 271570a_100000757648_200012359670 [1,0,1,0,0,0|1,0,0]=3 56 B16R2.87 NC(=O)c1ncccc1c2cnccn2 271570a_100011962566_200012359670 [1,0,1,0,0,0|2,0,0]=4 57 B16R2.87 NC(=O)c1ncccc1c2cncnc2 271570a_100000707473_200012359670 [1,0,1,0,0,0|2,0,0]=4 58 B16R2.87 NC(=O)c1nccnc1c2cccnc2 271570a_100000757648_100000094861 [1,0,1,0,0,0|2,0,0]=4 59 B16R2.87 [13CH3]C(=O)c1ccccc1c2cccnc2 1458a_100011399806_200025704644 [1,0,1,0,0,0|1,0,1]=4 60 B16R2.98 O=CNc1ccccc1c2cccnc2 271570a_200000040256_100000752921 [1,0,1,0,0,0|2,0,0]=4 61 B16R2.2474 Cc1ccccc1c2cccnc2C=O 271570a_100000747142_100011934733 [1,0,1,0,0,0|1,0,1]=4 62 B16R2.2474 Cc1ncccc1c2ccccc2C=O 271570a_100000740022_100000751574 [1,0,1,0,0,0|1,0,1]=4 63 B16R2.2474 Cc1ncccc1c2ccccc2C=O 271570a_100011934933_100000211189 [1,0,1,0,0,0|1,0,1]=4 64 B16R2.2474 Cc1ncccc1c2cccnc2C=O 271570a_100011934933_100011934733 [1,0,1,0,0,0|0,0,1]=3 65 B16R2.2474 Cc1ncncc1c2cccnc2C=O 271570a_200010046012_100011934733 [1,0,1,0,0,0|1,0,1]=4 66 B16R2.2474 Nc1ccccc1c2cccnc2C=O 271570a_100000034411_100011934733 [1,0,1,0,0,0|2,0,0]=4 67 B16R2.2474 Nc1ncccc1c2ccccc2C=O 271570a_100000071976_100000211189 [1,0,1,0,0,0|2,0,0]=4 68 B16R2.2474 Nc1ncccc1c2ccccc2C=O 271570a_100000740022_100000045569 [1,0,1,0,0,0|2,0,0]=4 69 B16R2.2474 Nc1ncccc1c2cccnc2C=O 271570a_100000071976_100011934733 [1,0,1,0,0,0|1,0,0]=3 70 B16R2.2474 O=Cc1ccccc1c2ccc[nH]c2=O 271570a_100000099769_100000211189 [1,0,1,0,0,0|1,0,1]=4 71 B16R2.2474 O=Cc1ccccc1c2ccc[nH]c2=O 271570a_100000740022_100000050042 [1,0,1,0,0,0|1,0,1]=4 72 B16R2.2474 O=Cc1ccccc1c2cccnc2Br 271570a_100000740022_100010202626 [1,0,1,0,0,0|2,0,0]=4 73 B16R2.2474 O=Cc1ccccc1c2cccnc2Cl 271570a_100000047009_100000211189 [1,0,1,0,0,0|2,0,0]=4 74 B16R2.2474 O=Cc1ccccc1c2cccnc2Cl 271570a_100000740022_100000036424 [1,0,1,0,0,0|2,0,0]=4 75 B16R2.2474 O=Cc1ccccc1c2cccnc2F 271570a_100000042387_100000211189 [1,0,1,0,0,0|2,0,0]=4 76 B16R2.2474 O=Cc1ccccc1c2cccnc2F 271570a_100000740022_100009816115 [1,0,1,0,0,0|2,0,0]=4 77 B16R2.2474 O=Cc1ncccc1c2ccc[nH]c2=O 271570a_100000099769_100011934733 [1,0,1,0,0,0|0,0,1]=3 78 B16R2.2474 O=Cc1ncccc1c2ccccc2Cl 271570a_100011934419_100011934733 [1,0,1,0,0,0|2,0,0]=4 79 B16R2.2474 O=Cc1ncccc1c2ccccc2F 271570a_100000761933_100011934733 [1,0,1,0,0,0|2,0,0]=4 80 B16R2.2474 O=Cc1ncccc1c2ccccc2I 271570a_100000069755_100011934733 [1,0,1,0,0,0|2,0,0]=4 81 B16R2.2474 O=Cc1ncccc1c2ccccc2O 271570a_100000035170_100011934733 [1,0,1,0,0,0|1,0,1]=4 82 B16R2.2474 O=Cc1ncccc1c2cccnc2Cl 271570a_100000047009_100011934733 [1,0,1,0,0,0|1,0,0]=3 83 B16R2.2474 O=Cc1ncccc1c2cccnc2F 271570a_100000042387_100011934733 [1,0,1,0,0,0|1,0,0]=3 84 B16R2.88 O=C(Cc1ccccn1)c2ccccc2 1458a_100000185807_100000721315 [1,0,1,0,0,0|1,0,1]=4 85 B18R2.235 C=CCC(=O)c1ccccc1c2cccnc2 1458a_100011399806_100000210623 [0,1,1,0,0,0|2,0,0]=4 86 B18R2.235 CCOC(=O)c1ncccc1c2cccnc2 271570a_100000757648_100012351660 [0,1,1,0,0,0|1,0,1]=4 87 B18R2.279 COC(=O)c1nc(ccc1c2cccnc2)N 271570a_100000757648_100009816986 [0,1,1,0,0,0|2,0,0]=4 88 B18R2.279 COC(=O)c1nc(ccc1c2cccnc2)O 271570a_100000757648_100010189638 [0,1,1,0,0,0|2,0,0]=4 89 B18R2.293 COC(=O)c1ncccc1c2ccc(nc2)C 271570a_100012354835_100011935214 [0,1,1,0,0,0|2,0,0]=4 90 B18R2.293 COC(=O)c1ncccc1c2ccc(nc2)Cl 271570a_100000037156_100011935214 [0,1,1,0,0,0|2,0,0]=4 91 B18R2.293 COC(=O)c1ncccc1c2ccc(nc2)F 271570a_100000041719_100011935214 [0,1,1,0,0,0|2,0,0]=4 92 B18R2.293 COC(=O)c1ncccc1c2ccc(nc2)N 271570a_100000062249_100011935214 [0,1,1,0,0,0|2,0,0]=4 93 B18R2.293 COC(=O)c1ncccc1c2ccc(nc2)O 271570a_100000062254_100011935214 [0,1,1,0,0,0|2,0,0]=4 94 B18R2.9308 COC(=O)c1ncccc1c2cncc(c2)Br 271570a_200009814628_100011935214 [0,1,1,0,0,0|2,0,0]=4 95 B18R2.9308 COC(=O)c1ncccc1c2cncc(c2)C 271570a_100012355712_100011935214 [0,1,1,0,0,0|2,0,0]=4 96 B18R2.9308 COC(=O)c1ncccc1c2cncc(c2)Cl 271570a_100000049213_100011935214 [0,1,1,0,0,0|2,0,0]=4 97 B18R2.9308 COC(=O)c1ncccc1c2cncc(c2)F 271570a_100000757375_100011935214 [0,1,1,0,0,0|2,0,0]=4 98 B18R2.9308 COC(=O)c1ncccc1c2cncc(c2)N 271570a_100000069896_100011935214 [0,1,1,0,0,0|2,0,0]=4 99 B18R2.9308 COC(=O)c1ncccc1c2cncc(c2)O 271570a_100010248756_100011935214 [0,1,1,0,0,0|2,0,0]=4 100 B18R2.9472 COC(=O)c1ncc(cc1c2cccnc2)C 271570a_100000757648_100010167497 [0,1,1,0,0,0|2,0,0]=4 101 B18R2.9472 COC(=O)c1ncc(cc1c2cccnc2)F 271570a_100000757648_100010189631 [0,1,1,0,0,0|2,0,0]=4 102 B18R2.9515 COC(=O)c1ncccc1c2cccnc2C 271570a_100011934933_100011935214 [0,1,1,0,0,0|2,0,0]=4 103 B18R2.9515 COC(=O)c1ncccc1c2cccnc2Cl 271570a_100000047009_100011935214 [0,1,1,0,0,0|2,0,0]=4 104 B18R2.9515 COC(=O)c1ncccc1c2cccnc2F 271570a_100000042387_100011935214 [0,1,1,0,0,0|2,0,0]=4 105 B18R2.9515 COC(=O)c1ncccc1c2cccnc2N 271570a_100000071976_100011935214 [0,1,1,0,0,0|2,0,0]=4 106 B18R2.9515 COC(=O)c1ncccc1c2cnccc2C 271570a_100011935247_100011935214 [0,1,1,0,0,0|2,0,0]=4 107 B18R2.9515 COC(=O)c1ncccc1c2cnccc2Cl 271570a_100000062317_100011935214 [0,1,1,0,0,0|2,0,0]=4 108 B18R2.9515 COC(=O)c1ncccc1c2cnccc2N 271570a_200010248739_100011935214 [0,1,1,0,0,0|2,0,0]=4 109 B18R2.3102 C=Cc1ccccc1c2cccnc2C(=O)C 271570a_100000037480_100012348690 [0,1,1,0,0,0|2,0,0]=4 110 B18R2.3102 C=Cc1ccccc1c2cccnc2C(=O)N 271570a_100000037480_200012359670 [0,1,1,0,0,0|2,0,0]=4 111 B18R2.3102 CC(=O)c1ccccc1c2ccccc2C=O 271570a_100000740022_100000751169 [0,1,1,0,0,0|2,0,0]=4 112 B18R2.3102 CC(=O)c1ccccc1c2ccccc2C=O 271570a_100010158976_100000211189 [0,1,1,0,0,0|2,0,0]=4 113 B18R2.3102 CC(=O)c1ccccc1c2cccnc2C=O 271570a_100010158976_100011934733 [0,1,1,0,0,0|1,0,0]=3 114 B18R2.3102 CC(=O)c1ncccc1c2ccccc2C=O 271570a_100000740022_100012348690 [0,1,1,0,0,0|1,0,0]=3 115 B18R2.3102 CC(=O)c1ncccc1c2cccnc2C#N 271570a_100000062270_100012348690 [0,1,1,0,0,0|1,0,1]=4 116 B18R2.3102 CC(=O)c1nccnc1c2ccccc2C=O 271570a_100000740022_100000099859 [0,1,1,0,0,0|2,0,0]=4 117 B18R2.3102 COc1ncccc1c2cccnc2C(=O)C 271570a_100011290909_100012348690 [0,1,1,0,0,0|2,0,0]=4 118 B18R2.3102 COc1ncccc1c2cccnc2C(=O)N 271570a_100011290909_200012359670 [0,1,1,0,0,0|2,0,0]=4 119 B18R2.3102 CS(=O)c1ccccc1c2cccnc2C=O 271570a_100000040274_100011934733 [0,1,1,0,0,0|2,0,0]=4 120 B18R2.3102 N#Cc1ncccc1c2cccnc2C(=O)N 271570a_100000062270_200012359670 [0,1,1,0,0,0|1,0,1]=4 121 B18R2.3102 NC(=O)c1ccccc1c2ccccc2C=O 271570a_100000041535_100000211189 [0,1,1,0,0,0|2,0,0]=4 122 B18R2.3102 NC(=O)c1ccccc1c2ccccc2C=O 271570a_100000740022_100000162227 [0,1,1,0,0,0|2,0,0]=4 123 B18R2.3102 NC(=O)c1ccccc1c2cccnc2C=O 271570a_100000041535_100011934733 [0,1,1,0,0,0|1,0,0]=3 124 B18R2.3102 NC(=O)c1ncccc1c2ccccc2C=O 271570a_100000740022_200012359670 [0,1,1,0,0,0|1,0,0]=3 125 B18R2.3102 NC(=O)c1nccnc1c2ccccc2C=O 271570a_100000740022_100000094861 [0,1,1,0,0,0|2,0,0]=4 126 B18R2.3102 O=Cc1ncccc1c2ccccc2[N+](=O)[O-] 271570a_100000043317_100011934733 [0,1,1,0,0,0|2,0,0]=4 127 B18R2.7574 C=CCc1ccccc1c2cccnc2C=O 271570a_200010742005_100011934733 [0,1,1,0,0,0|2,0,0]=4 128 B18R2.7574 CCOc1ncccc1c2cccnc2C=O 271570a_100000047259_100011934733 [0,1,1,0,0,0|1,0,1]=4 129 B18R2.7574 O=CNc1ccccc1c2ccccc2C=O 271570a_200000040256_100000211189 [0,1,1,0,0,0|2,0,0]=4 130 B18R2.7574 O=CNc1ccccc1c2cccnc2C=O 271570a_200000040256_100011934733 [0,1,1,0,0,0|1,0,0]=3 131 B18R2.12454 C=Cc1ccccc1c2ccc(nc2C=O)C 271570a_100000037480_100010173661 [0,1,1,0,0,0|2,0,0]=4 132 B18R2.12454 COc1nc(ccc1c2cccnc2C=O)Br 271570a_100010143858_100011934733 [0,1,1,0,0,0|2,0,0]=4 133 B18R2.12454 COc1nc(ccc1c2cccnc2C=O)C 271570a_100010129928_100011934733 [0,1,1,0,0,0|2,0,0]=4 134 B18R2.12454 COc1nc(ccc1c2cccnc2C=O)Cl 271570a_100000101703_100011934733 [0,1,1,0,0,0|2,0,0]=4 135 B18R2.12454 COc1ncccc1c2ccc(nc2C=O)C 271570a_100011290909_100010173661 [0,1,1,0,0,0|2,0,0]=4 136 B18R2.12454 Cc1ccc(c(c1)C=O)c2ccccc2C=O 271570a_100000740022_100011551863 [0,1,1,0,0,0|2,0,0]=4 137 B18R2.12454 Cc1ccc(c(c1)C=O)c2ccccc2C=O 271570a_100010043623_100000211189 [0,1,1,0,0,0|2,0,0]=4 138 B18R2.12454 Cc1ccc(c(c1)C=O)c2cccnc2C=O 271570a_100010043623_100011934733 [0,1,1,0,0,0|1,0,0]=3 139 B18R2.12454 Cc1ccc(c(n1)C=O)c2ccccc2C=O 271570a_100000740022_100010173661 [0,1,1,0,0,0|1,0,0]=3 140 B18R2.12454 Cc1ccc(c(n1)C=O)c2cccnc2C#N 271570a_100000062270_100010173661 [0,1,1,0,0,0|1,0,1]=4 141 B18R2.12454 O=Cc1cc(ccc1c2cccnc2C=O)Br 271570a_100021397726_100011934733 [0,1,1,0,0,0|1,0,0]=3 142 B18R2.12454 O=Cc1cc(ccc1c2cccnc2C=O)Cl 271570a_100000069396_100011934733 [0,1,1,0,0,0|1,0,0]=3 143 B18R2.12454 O=Cc1cc(ccc1c2cccnc2C=O)F 271570a_100010043619_100011934733 [0,1,1,0,0,0|1,0,0]=3 144 B18R2.12454 O=Cc1cc(ccc1c2cccnc2C=O)O 271570a_100010081631_100011934733 [0,1,1,0,0,0|1,0,0]=3 145 B18R2.12454 O=Cc1ccccc1c2ccc(cc2C=O)Br 271570a_100000740022_100010185651 [0,1,1,0,0,0|2,0,0]=4 146 B18R2.12454 O=Cc1ccccc1c2ccc(cc2C=O)Br 271570a_100021397726_100000211189 [0,1,1,0,0,0|2,0,0]=4 147 B18R2.12454 O=Cc1ccccc1c2ccc(cc2C=O)Cl 271570a_100000069396_100000211189 [0,1,1,0,0,0|2,0,0]=4 148 B18R2.12454 O=Cc1ccccc1c2ccc(cc2C=O)Cl 271570a_100000740022_100010254386 [0,1,1,0,0,0|2,0,0]=4 149 B18R2.12454 O=Cc1ccccc1c2ccc(cc2C=O)F 271570a_100000740022_100011218309 [0,1,1,0,0,0|2,0,0]=4 150 B18R2.12454 O=Cc1ccccc1c2ccc(cc2C=O)F 271570a_100010043619_100000211189 [0,1,1,0,0,0|2,0,0]=4 151 B18R2.12454 O=Cc1ccccc1c2ccc(cc2C=O)O 271570a_100000740022_100000690577 [0,1,1,0,0,0|2,0,0]=4 152 B18R2.12454 O=Cc1ccccc1c2ccc(cc2C=O)O 271570a_100010081631_100000211189 [0,1,1,0,0,0|2,0,0]=4 153 B18R2.12456 COc1ncc(cc1c2cccnc2C=O)Br 271570a_200009814610_100011934733 [0,1,1,0,0,0|2,0,0]=4 154 B18R2.12456 COc1ncc(cc1c2cccnc2C=O)C 271570a_100010168195_100011934733 [0,1,1,0,0,0|2,0,0]=4 155 B18R2.12456 COc1ncc(cc1c2cccnc2C=O)Cl 271570a_100000081274_100011934733 [0,1,1,0,0,0|2,0,0]=4 156 B18R2.12456 COc1ncc(cc1c2cccnc2C=O)F 271570a_100010187659_100011934733 [0,1,1,0,0,0|2,0,0]=4 157 B18R2.12456 CSc1ncc(cc1c2cccnc2C=O)Cl 271570a_200010732566_100011934733 [0,1,1,0,0,0|2,0,0]=4 158 B18R2.12456 Cc1ccc(c(c1)c2ccccc2C=O)C=O 271570a_100000117001_100000211189 [0,1,1,0,0,0|2,0,0]=4 159 B18R2.12456 Cc1ccc(c(c1)c2ccccc2C=O)C=O 271570a_100000740022_100000692596 [0,1,1,0,0,0|2,0,0]=4 160 B18R2.12456 Cc1ccc(c(c1)c2cccnc2C=O)C=O 271570a_100000117001_100011934733 [0,1,1,0,0,0|1,0,0]=3 161 B18R2.12456 Cc1cnc(c(c1)c2cccnc2C=O)C#N 271570a_100010029141_100011934733 [0,1,1,0,0,0|1,0,1]=4 162 B18R2.12456 O=Cc1ccc(cc1c2cccnc2C=O)Cl 271570a_100010223337_100011934733 [0,1,1,0,0,0|1,0,0]=3 163 B18R2.12456 O=Cc1ccc(cc1c2cccnc2C=O)F 271570a_100000097291_100011934733 [0,1,1,0,0,0|1,0,0]=3 164 B18R2.12456 O=Cc1ccc(cc1c2cccnc2C=O)O 271570a_100010081635_100011934733 [0,1,1,0,0,0|1,0,0]=3 165 B18R2.12456 O=Cc1ccccc1c2cc(ccc2C=O)Br 271570a_100000740022_100010146562 [0,1,1,0,0,0|2,0,0]=4 166 B18R2.12456 O=Cc1ccccc1c2cc(ccc2C=O)Cl 271570a_100010223337_100000211189 [0,1,1,0,0,0|2,0,0]=4 167 B18R2.12456 O=Cc1ccccc1c2cc(ccc2C=O)F 271570a_100000097291_100000211189 [0,1,1,0,0,0|2,0,0]=4 168 B18R2.12456 O=Cc1ccccc1c2cc(ccc2C=O)F 271570a_100000740022_100000752949 [0,1,1,0,0,0|2,0,0]=4 169 B18R2.12456 O=Cc1ccccc1c2cc(ccc2C=O)O 271570a_100000740022_100011236494 [0,1,1,0,0,0|2,0,0]=4 170 B18R2.12456 O=Cc1ccccc1c2cc(ccc2C=O)O 271570a_100010081635_100000211189 [0,1,1,0,0,0|2,0,0]=4 171 B18R2.12469 Cc1cccc(c1C=O)c2ccccc2C=O 271570a_100000740022_100000041122 [0,1,1,0,0,0|2,0,0]=4 172 B18R2.12469 Nc1cccc(c1C=O)c2ccccc2C=O 271570a_100000740022_100010232536 [0,1,1,0,0,0|2,0,0]=4 173 B18R2.12469 O=Cc1ccccc1c2cccc(c2C=O)Cl 271570a_100000740022_100010147682 [0,1,1,0,0,0|2,0,0]=4 174 B18R2.12469 O=Cc1ccccc1c2cccc(c2C=O)Cl 271570a_100009861587_100000211189 [0,1,1,0,0,0|2,0,0]=4 175 B18R2.12469 O=Cc1ccccc1c2cccc(c2C=O)F 271570a_100000740022_100000210083 [0,1,1,0,0,0|2,0,0]=4 176 B18R2.12469 O=Cc1ccccc1c2cccc(c2C=O)F 271570a_100010144235_100000211189 [0,1,1,0,0,0|2,0,0]=4 177 B18R2.12469 O=Cc1ccccc1c2cccc(c2C=O)O 271570a_100000740022_100009814793 [0,1,1,0,0,0|2,0,0]=4 178 B18R2.12469 O=Cc1ncccc1c2cccc(c2C=O)Cl 271570a_100009861587_100011934733 [0,1,1,0,0,0|1,0,0]=3 179 B18R2.12469 O=Cc1ncccc1c2cccc(c2C=O)F 271570a_100010144235_100011934733 [0,1,1,0,0,0|1,0,0]=3 180 B18R2.19418 COc1nccc(c1c2cccnc2C=O)C 271570a_100010082537_100011934733 [0,1,1,0,0,0|2,0,0]=4 181 B18R2.19418 O=Cc1ccccc1c2c(cccc2C=O)F 271570a_100000740022_100011998484 [0,1,1,0,0,0|2,0,0]=4 182 B18R2.19418 O=Cc1ccccc1c2c(cccc2C=O)O 271570a_100000740022_100009816417 [0,1,1,0,0,0|2,0,0]=4 183 B18R2.250 O=C(C(=O)c1ccc(cc1)O)c2ccccc2 271570a_203496583355_200103168698 [0,1,1,0,0,0|2,0,0]=4 184 B18R2.6461 O=C(C(=O)c1cccc(c1)O)c2ccccc2 271570a_203496583355_100160495691 [0,1,1,0,0,0|2,0,0]=4 185 B20R3.1289133 C=Cc1ccc2c(c1)-c3ccccc3C(=O)C2=O 271570a_100011290941_100015191286 [0,2,0,0,0,0|2,0,0]=4 186 B20R3.1289133 CSc1ccc2c(c1)-c3ccccc3C(=O)C2=O 62a_100015191286_200000210301 [0,2,0,0,0,0|2,0,0]=4 187 B20R3.1289133 [13CH3]Sc1ccc2c(c1)-c3ccccc3C(=O)C2=O 62a_100015191286_200025704644 [0,2,0,0,0,0|2,0,0]=4 188 B16R2.7884 O=Cc1ccccc1c2ccoc2C=O 271570a_100000740022_100000756499 [0,0,1,0,1,0|2,0,0]=4 189 B16R2.7884 O=Cc1ccccc1c2ccsc2C=O 271570a_100000740022_100000766043 [0,0,1,0,1,0|2,0,0]=4 190 B16R2.7884 O=Cc1ccccc1c2ccsc2C=O 271570a_100010083059_100000211189 [0,0,1,0,1,0|2,0,0]=4 191 B16R2.7884 O=Cc1ccccc1c2cscc2C=O 271570a_100000077414_100000211189 [0,0,1,0,1,0|2,0,0]=4 192 B16R2.7884 O=Cc1ccccc1c2cscc2C=O 271570a_100000740022_100000685484 [0,0,1,0,1,0|2,0,0]=4 193 B16R2.7884 O=Cc1ccccc1c2occc2C=O 271570a_200000039635_100000211189 [0,0,1,0,1,0|2,0,0]=4 194 B16R2.7884 O=Cc1ccccc1c2sccc2C=O 271570a_100000034323_100000211189 [0,0,1,0,1,0|2,0,0]=4 195 B16R2.7884 O=Cc1ccccc1c2sccc2C=O 271570a_100000740022_100009816921 [0,0,1,0,1,0|2,0,0]=4 196 B16R2.7884 O=Cc1ccoc1c2cccnc2C=O 271570a_200000039635_100011934733 [0,0,1,0,1,0|1,0,0]=3 197 B16R2.7884 O=Cc1ccsc1c2cccnc2C=O 271570a_100000034323_100011934733 [0,0,1,0,1,0|1,0,0]=3 198 B16R2.7884 O=Cc1cscc1c2cccnc2C=O 271570a_100000077414_100011934733 [0,0,1,0,1,0|1,0,0]=3 199 B16R2.7884 O=Cc1ncccc1c2ccsc2C=O 271570a_100010083059_100011934733 [0,0,1,0,1,0|1,0,0]=3 200 B18R2.2616 C=CC(=O)Nc1ccccc1c2cccnc2 1626a_100011399838_100000185746 [0,0,1,0,0,1|2,0,0]=4 201 B18R2.2616 C=CC(=O)Nc1ccccc1c2cccnc2 22a_100011399838_100000185746 [0,0,1,0,0,1|2,0,0]=4 202 B18R2.2616 C=CC(=O)Nc1ccccc1c2cccnc2 271570a_100010232135_100000752921 [0,0,1,0,0,1|2,0,0]=4 203 B18R2.2616 COC(=O)Cc1ncccc1c2cccnc2 271570a_100000757648_100012347948 [0,0,1,0,0,1|2,0,0]=4 204 B18R2.2616 COC(=O)Cc1ncccc1c2cccnc2 271570a_200010046451_100000752921 [0,0,1,0,0,1|2,0,0]=4 205 B18R2.9309 COC(=O)c1ncccc1Sc2cccnc2 62a_100000210063_100011935214 [0,0,1,0,0,1|2,0,0]=4 206 B18R2.9309 COC(=O)c1ncccc1Sc2cccnc2 62a_100011935214_100000210063 [0,0,1,0,0,1|2,0,0]=4 207 B18R2.1025 C=Cc1ccccc1Sc2cccnc2C=O 62a_100011218376_100011934733 [0,0,1,0,0,1|2,0,0]=4 208 B18R2.1025 C=Cc1ccccc1Sc2cccnc2C=O 62a_100011934733_100011218376 [0,0,1,0,0,1|2,0,0]=4 209 B18R2.1025 CCc1ncccc1Sc2cccnc2C=O 62a_100009877225_100011934733 [0,0,1,0,0,1|1,0,1]=4 210 B18R2.1025 CCc1ncccc1Sc2cccnc2C=O 62a_100011934733_100009877225 [0,0,1,0,0,1|1,0,1]=4 211 B18R2.1025 CNc1ncccc1Sc2cccnc2C=O 62a_100000700899_100011934733 [0,0,1,0,0,1|2,0,0]=4 212 B18R2.1025 CNc1ncccc1Sc2cccnc2C=O 62a_100011934733_100000700899 [0,0,1,0,0,1|2,0,0]=4 213 B18R2.1025 COc1ncccc1Sc2cccnc2C=O 62a_100000047025_100011934733 [0,0,1,0,0,1|2,0,0]=4 214 B18R2.1025 COc1ncccc1Sc2cccnc2C=O 62a_100011934733_100000047025 [0,0,1,0,0,1|2,0,0]=4 215 B18R2.1025 CSc1ncccc1Sc2cccnc2C=O 62a_100011465278_100011934733 [0,0,1,0,0,1|2,0,0]=4 216 B18R2.1025 CSc1ncccc1Sc2cccnc2C=O 62a_100011934733_100011465278 [0,0,1,0,0,1|2,0,0]=4 217 B18R2.1025 N#Cc1ncccc1Sc2cccnc2C=O 62a_100011934733_100000685805 [0,0,1,0,0,1|1,0,1]=4 218 B18R2.1025 NCc1ncccc1Sc2cccnc2C=O 62a_100011934733_100020591323 [0,0,1,0,0,1|1,0,1]=4 219 B18R2.1025 NCc1ncccc1Sc2cccnc2C=O 62a_100020591323_100011934733 [0,0,1,0,0,1|1,0,1]=4 220 B18R2.1025 NNc1ncccc1Sc2cccnc2C=O 62a_100011464834_100011934733 [0,0,1,0,0,1|2,0,0]=4 221 B18R2.1025 NNc1ncccc1Sc2cccnc2C=O 62a_100011934733_100011464834 [0,0,1,0,0,1|2,0,0]=4 222 B18R2.1025 O=Cc1ccccc1Sc2ccccc2C=O 62a_100000210073_100000210073 [0,0,1,0,0,1|2,0,0]=4 223 B18R2.1025 O=Cc1ccccc1Sc2cccnc2C=O 62a_100000210073_100011934733 [0,0,1,0,0,1|1,0,0]=3 224 B18R2.1025 O=Cc1ccccc1Sc2cccnc2C=O 62a_100011934733_100000210073 [0,0,1,0,0,1|1,0,0]=3 225 B18R2.1025 O=Cc1ccccc1Sc2nccnc2C=O 62a_100000051000_100000210073 [0,0,1,0,0,1|2,0,0]=4 226 B18R2.1025 O=Cc1ccccc1Sc2nccnc2C=O 62a_100000210073_100000051000 [0,0,1,0,0,1|2,0,0]=4 227 B18R2.1025 O=Cc1cccnc1Sc2cccnc2C=O 62a_100009816751_100011934733 [0,0,1,0,0,1|2,0,0]=4 228 B18R2.1025 O=Cc1cccnc1Sc2cccnc2C=O 62a_100011934733_100009816751 [0,0,1,0,0,1|2,0,0]=4 229 B18R2.1025 O=Cc1ccncc1Sc2cccnc2C=O 62a_100011934409_100011934733 [0,0,1,0,0,1|2,0,0]=4 230 B18R2.1025 O=Cc1ccncc1Sc2cccnc2C=O 62a_100011934733_100011934409 [0,0,1,0,0,1|2,0,0]=4 231 B18R2.1025 O=Cc1cnccc1Sc2cccnc2C=O 62a_100000050567_100011934733 [0,0,1,0,0,1|2,0,0]=4 232 B18R2.1025 O=Cc1cnccc1Sc2cccnc2C=O 62a_100011934733_100000050567 [0,0,1,0,0,1|2,0,0]=4 233 B18R2.1025 O=Cc1ncccc1Sc2cccnc2C=O 62a_100011934733_100011934733 [0,0,1,0,0,1|0,0,0]=2 234 B18R2.1025 O=Cc1ncccc1Sc2cccnc2CO 62a_100011934733_100011996772 [0,0,1,0,0,1|0,0,2]=4 235 B18R2.1025 O=Cc1ncccc1Sc2cccnc2CO 62a_100011996772_100011934733 [0,0,1,0,0,1|0,0,2]=4 236 B18R2.1025 O=Cc1ncccc1Sc2nccnc2C=O 62a_100000051000_100011934733 [0,0,1,0,0,1|1,0,0]=3 237 B18R2.1025 O=Cc1ncccc1Sc2nccnc2C=O 62a_100011934733_100000051000 [0,0,1,0,0,1|1,0,0]=3 238 B18R2.1025 O=Cc1nccnc1Sc2nccnc2C=O 62a_100000051000_100000051000 [0,0,1,0,0,1|2,0,0]=4 239 B18R2.3634 O=C(CC(=O)c1ccccc1)c2ccccc2 1458a_100000185807_100000211460 [0,0,1,0,0,1|2,0,0]=4 240 B18R2.3634 O=C(CC(=O)c1ccccn1)c2ccccc2 1458a_100000185807_100000027445 [0,0,1,0,0,1|1,0,0]=3 241 B18R2.3634 O=C(CC(=O)c1ncccn1)c2ccccc2 1458a_100000185807_100020636365 [0,0,1,0,0,1|2,0,0]=4 242 B18R2.7204 C=C(C(=O)Cc1ccccn1)c2ccccc2 1458a_100000065200_100000721315 [0,0,1,0,0,1|2,0,0]=4 243 B18R2.7204 CC(C(=O)Cc1ccccn1)c2ccccn2 1458a_100000722050_100000721315 [0,0,1,0,0,1|1,0,1]=4