0 B13R1.133 C/C(=C\c1ccc(cc1)F)/C(=O)[13CH3] 1458a_100053117043_200025704644 [0,0,0,0,0,0|3,0,1]=4 1 B13R1.133 C=C(Br)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100009813364 [0,0,0,0,0,0|4,0,0]=4 2 B13R1.133 C=C(Br)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100009813364 [0,0,0,0,0,0|4,0,0]=4 3 B13R1.133 C=C(Br)C(=O)Nc1ccc(cc1)C 11a_100000124888_100009813364 [0,0,0,0,0,0|4,0,0]=4 4 B13R1.133 C=C(Br)C(=O)Nc1ccc(cc1)C 1626a_100000124888_100009813364 [0,0,0,0,0,0|4,0,0]=4 5 B13R1.133 C=C(Br)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100009813364 [0,0,0,0,0,0|4,0,0]=4 6 B13R1.133 C=C(Br)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100009813364 [0,0,0,0,0,0|4,0,0]=4 7 B13R1.133 C=C(Br)C(=O)Nc1ccc(cc1)F 11a_100000185862_100009813364 [0,0,0,0,0,0|4,0,0]=4 8 B13R1.133 C=C(Br)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100009813364 [0,0,0,0,0,0|4,0,0]=4 9 B13R1.133 C=C(Br)C(=O)Nc1ccc(cc1)I 11a_100000185761_100009813364 [0,0,0,0,0,0|4,0,0]=4 10 B13R1.133 C=C(Br)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100009813364 [0,0,0,0,0,0|4,0,0]=4 11 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)Br 1458a_100000185857_100000189115 [0,0,0,0,0,0|3,0,0]=3 12 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)C 1458a_100000185857_100000210814 [0,0,0,0,0,0|3,0,0]=3 13 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000185857_100000694040 [0,0,0,0,0,0|3,0,0]=3 14 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)F 1458a_100000185857_100000198546 [0,0,0,0,0,0|3,0,0]=3 15 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)I 1458a_100000185857_100000189116 [0,0,0,0,0,0|3,0,0]=3 16 B13R1.133 C=C(C)C(=O)Cc1ccc(cn1)Br 1458a_100000185857_100000702658 [0,0,0,0,0,0|4,0,0]=4 17 B13R1.133 C=C(C)C(=O)Cc1ccc(cn1)C 1458a_100000185857_100000691093 [0,0,0,0,0,0|4,0,0]=4 18 B13R1.133 C=C(C)C(=O)Cc1ccc(cn1)Cl 1458a_100000185857_100012066911 [0,0,0,0,0,0|4,0,0]=4 19 B13R1.133 C=C(C)C(=O)Cc1ccc(cn1)F 1458a_100000185857_100000703193 [0,0,0,0,0,0|4,0,0]=4 20 B13R1.133 C=C(C)C(=O)Cc1ccc(nc1)Br 1458a_100000185857_100009831999 [0,0,0,0,0,0|4,0,0]=4 21 B13R1.133 C=C(C)C(=O)Cc1ccc(nc1)C 1458a_100000185857_100016987292 [0,0,0,0,0,0|4,0,0]=4 22 B13R1.133 C=C(C)C(=O)Cc1ccc(nc1)Cl 1458a_100000185857_100000735431 [0,0,0,0,0,0|4,0,0]=4 23 B13R1.133 C=C(C)C(=O)Cc1ccc(nc1)F 1458a_100000185857_100009820150 [0,0,0,0,0,0|4,0,0]=4 24 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100000185857 [0,0,0,0,0,0|4,0,0]=4 25 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000185857 [0,0,0,0,0,0|4,0,0]=4 26 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000185857 [0,0,0,0,0,0|4,0,0]=4 27 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 11a_100000124888_100000185857 [0,0,0,0,0,0|4,0,0]=4 28 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 1626a_100000124888_100000185857 [0,0,0,0,0,0|4,0,0]=4 29 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 22a_100000124888_100000185857 [0,0,0,0,0,0|4,0,0]=4 30 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000185857 [0,0,0,0,0,0|4,0,0]=4 31 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000185857 [0,0,0,0,0,0|4,0,0]=4 32 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000185857 [0,0,0,0,0,0|4,0,0]=4 33 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 11a_100000185862_100000185857 [0,0,0,0,0,0|4,0,0]=4 34 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100000185857 [0,0,0,0,0,0|4,0,0]=4 35 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000185857 [0,0,0,0,0,0|4,0,0]=4 36 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 11a_100000185761_100000185857 [0,0,0,0,0,0|4,0,0]=4 37 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100000185857 [0,0,0,0,0,0|4,0,0]=4 38 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000185857 [0,0,0,0,0,0|4,0,0]=4 39 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000185857 [0,0,0,0,0,0|3,0,0]=3 40 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100000039160 [0,0,0,0,0,0|4,0,0]=4 41 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000039160 [0,0,0,0,0,0|4,0,0]=4 42 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000039160 [0,0,0,0,0,0|4,0,0]=4 43 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)C 11a_100000124888_100000039160 [0,0,0,0,0,0|4,0,0]=4 44 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)C 1626a_100000124888_100000039160 [0,0,0,0,0,0|4,0,0]=4 45 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)C 22a_100000124888_100000039160 [0,0,0,0,0,0|4,0,0]=4 46 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000039160 [0,0,0,0,0,0|4,0,0]=4 47 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000039160 [0,0,0,0,0,0|4,0,0]=4 48 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000039160 [0,0,0,0,0,0|4,0,0]=4 49 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)F 11a_100000185862_100000039160 [0,0,0,0,0,0|4,0,0]=4 50 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100000039160 [0,0,0,0,0,0|4,0,0]=4 51 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000039160 [0,0,0,0,0,0|4,0,0]=4 52 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)I 11a_100000185761_100000039160 [0,0,0,0,0,0|4,0,0]=4 53 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100000039160 [0,0,0,0,0,0|4,0,0]=4 54 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000039160 [0,0,0,0,0,0|4,0,0]=4 55 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000039160 [0,0,0,0,0,0|3,0,0]=3 56 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100000036797 [0,0,0,0,0,0|4,0,0]=4 57 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000036797 [0,0,0,0,0,0|4,0,0]=4 58 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000036797 [0,0,0,0,0,0|4,0,0]=4 59 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)C 11a_100000124888_100000036797 [0,0,0,0,0,0|4,0,0]=4 60 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)C 1626a_100000124888_100000036797 [0,0,0,0,0,0|4,0,0]=4 61 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)C 22a_100000124888_100000036797 [0,0,0,0,0,0|4,0,0]=4 62 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000036797 [0,0,0,0,0,0|4,0,0]=4 63 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000036797 [0,0,0,0,0,0|4,0,0]=4 64 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000036797 [0,0,0,0,0,0|4,0,0]=4 65 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)F 11a_100000185862_100000036797 [0,0,0,0,0,0|4,0,0]=4 66 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100000036797 [0,0,0,0,0,0|4,0,0]=4 67 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000036797 [0,0,0,0,0,0|4,0,0]=4 68 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)I 11a_100000185761_100000036797 [0,0,0,0,0,0|4,0,0]=4 69 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100000036797 [0,0,0,0,0,0|4,0,0]=4 70 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000036797 [0,0,0,0,0,0|4,0,0]=4 71 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000036797 [0,0,0,0,0,0|3,0,0]=3 72 B13R1.133 CC(=O)/C(=C/c1ccc(cc1)F)/C 1458a_100053117043_200000210301 [0,0,0,0,0,0|3,0,1]=4 73 B13R1.133 CC(=O)C(=O)Nc1ccc(cc1)C 1458a_100000189662_200000210301 [0,0,0,0,0,0|3,0,0]=3 74 B13R1.133 CC(=O)C(=O)Nc1ccc(cn1)Cl 1458a_100011297360_200000210301 [0,0,0,0,0,0|4,0,0]=4 75 B13R1.133 CC(=O)C(C)Cc1ccc(cc1)Br 1458a_100000695199_200000210301 [0,0,0,0,0,0|3,0,1]=4 76 B13R1.133 CC(=O)C(C)Cc1ccc(cc1)F 1458a_100000746122_200000210301 [0,0,0,0,0,0|3,0,1]=4 77 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)O 62a_100009814033_100000185759 [0,0,0,0,0,0|3,0,1]=4 78 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)Cl 1458a_100012362158_200000210301 [0,0,0,0,0,0|2,0,2]=4 79 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)F 1458a_100012179405_200000210301 [0,0,0,0,0,0|2,0,2]=4 80 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200000210301 [0,0,0,0,0,0|1,0,2]=3 81 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Br 11a_100000180866_100015343762 [0,0,0,0,0,0|4,0,0]=4 82 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Br 1626a_100000180866_100015343762 [0,0,0,0,0,0|4,0,0]=4 83 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Br 240690a_100000180866_100015343762 [0,0,0,0,0,0|4,0,0]=4 84 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Br 527a_100000180866_100103153847 [0,0,0,0,0,0|4,0,0]=4 85 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)C 11a_100000744650_100015343762 [0,0,0,0,0,0|4,0,0]=4 86 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)C 1626a_100000744650_100015343762 [0,0,0,0,0,0|4,0,0]=4 87 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)C 240690a_100000744650_100015343762 [0,0,0,0,0,0|4,0,0]=4 88 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)C 527a_100000744650_100103153847 [0,0,0,0,0,0|4,0,0]=4 89 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Cl 11a_100000184517_100015343762 [0,0,0,0,0,0|4,0,0]=4 90 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Cl 1626a_100000184517_100015343762 [0,0,0,0,0,0|4,0,0]=4 91 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Cl 240690a_100000184517_100015343762 [0,0,0,0,0,0|4,0,0]=4 92 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Cl 527a_100000184517_100103153847 [0,0,0,0,0,0|4,0,0]=4 93 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)F 11a_100000184576_100015343762 [0,0,0,0,0,0|4,0,0]=4 94 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)F 1626a_100000184576_100015343762 [0,0,0,0,0,0|4,0,0]=4 95 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)F 240690a_100000184576_100015343762 [0,0,0,0,0,0|4,0,0]=4 96 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)F 527a_100000184576_100103153847 [0,0,0,0,0,0|4,0,0]=4 97 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)O 240690a_100000207500_100015343762 [0,0,0,0,0,0|3,0,0]=3 98 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)O 527a_100000207500_100103153847 [0,0,0,0,0,0|3,0,0]=3 99 B13R1.133 CC(=O)[C@@H](C)Oc1ccc(cc1)O 1458a_100000005562_200000210301 [0,0,0,0,0,0|3,0,1]=4 100 B13R1.133 CC(=O)[C@@H](O)Cc1ccc(cc1)Br 1458a_200015644258_200000210301 [0,0,0,0,0,0|2,0,2]=4 101 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210206 [0,0,0,0,0,0|3,0,1]=4 102 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)Br 1458a_100000210198_100000189115 [0,0,0,0,0,0|3,0,1]=4 103 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000210198_100000694040 [0,0,0,0,0,0|3,0,1]=4 104 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210206 [0,0,0,0,0,0|3,0,1]=4 105 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)F 1458a_100000210198_100000198546 [0,0,0,0,0,0|3,0,1]=4 106 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210206 [0,0,0,0,0,0|3,0,1]=4 107 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)I 1458a_100000210198_100000189116 [0,0,0,0,0,0|3,0,1]=4 108 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210206 [0,0,0,0,0,0|3,0,1]=4 109 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210206 [0,0,0,0,0,0|2,0,1]=3 110 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000210198 [0,0,0,0,0,0|3,0,1]=4 111 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)O 271570a_203496583355_200000153573 [0,0,0,0,0,0|3,0,1]=4 112 B13R1.133 CC(Cc1ccc(cc1)Br)C(=O)[13CH3] 1458a_100000695199_200025704644 [0,0,0,0,0,0|3,0,1]=4 113 B13R1.133 CC(Cc1ccc(cc1)F)C(=O)[13CH3] 1458a_100000746122_200025704644 [0,0,0,0,0,0|3,0,1]=4 114 B13R1.133 CC(F)C(=O)Cc1ccc(cc1)Br 1458a_100000062450_100000189115 [0,0,0,0,0,0|3,0,1]=4 115 B13R1.133 CC(F)C(=O)Cc1ccc(cc1)Cl 1458a_100000062450_100000694040 [0,0,0,0,0,0|3,0,1]=4 116 B13R1.133 CC(F)C(=O)Cc1ccc(cc1)F 1458a_100000062450_100000198546 [0,0,0,0,0,0|3,0,1]=4 117 B13R1.133 CC(F)C(=O)Cc1ccc(cc1)I 1458a_100000062450_100000189116 [0,0,0,0,0,0|3,0,1]=4 118 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000062450 [0,0,0,0,0,0|3,0,1]=4 119 B13R1.133 CC(Nc1ccc(cc1)O)C(=O)N 34a_100000185829_100000702099 [0,0,0,0,0,0|3,0,1]=4 120 B13R1.133 CC(Oc1ccc(cc1)O)C(=O)N 271570a_203496583355_100000150412 [0,0,0,0,0,0|3,0,1]=4 121 B13R1.133 CC(Sc1ccc(cc1)O)C(=O)N 62a_100000702099_100000185759 [0,0,0,0,0,0|3,0,1]=4 122 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Br 11a_100102631434_100000198978 [0,0,0,0,0,0|4,0,0]=4 123 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Br 240690a_100102631434_100000198978 [0,0,0,0,0,0|4,0,0]=4 124 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Br 527a_100102631434_100000198978 [0,0,0,0,0,0|4,0,0]=4 125 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Cl 11a_100102631434_100000211027 [0,0,0,0,0,0|4,0,0]=4 126 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Cl 240690a_100102631434_100000211027 [0,0,0,0,0,0|4,0,0]=4 127 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Cl 527a_100102631434_100000211027 [0,0,0,0,0,0|4,0,0]=4 128 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)F 11a_100102631434_100000210951 [0,0,0,0,0,0|4,0,0]=4 129 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)F 1626a_100102631434_100000210951 [0,0,0,0,0,0|4,0,0]=4 130 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)F 240690a_100102631434_100000210951 [0,0,0,0,0,0|4,0,0]=4 131 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)F 527a_100102631434_100000210951 [0,0,0,0,0,0|4,0,0]=4 132 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)I 11a_100102631434_100000688869 [0,0,0,0,0,0|4,0,0]=4 133 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)I 1626a_100102631434_100000688869 [0,0,0,0,0,0|4,0,0]=4 134 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)I 240690a_100102631434_100000688869 [0,0,0,0,0,0|4,0,0]=4 135 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)I 527a_100102631434_100000688869 [0,0,0,0,0,0|4,0,0]=4 136 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)O 1626a_100102631434_100000198540 [0,0,0,0,0,0|3,0,0]=3 137 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)O 240690a_100102631434_100000198540 [0,0,0,0,0,0|3,0,0]=3 138 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)O 271570a_203496583355_100000159674 [0,0,0,0,0,0|3,0,0]=3 139 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)O 527a_100102631434_100000198540 [0,0,0,0,0,0|3,0,0]=3 140 B13R1.133 CN(C)C(=O)Nc1ccc(cc1)O 2430a_100000185829_100102631434 [0,0,0,0,0,0|4,0,0]=4 141 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cc1)Br 1458a_100000717761_100000189115 [0,0,0,0,0,0|2,0,1]=3 142 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cc1)Cl 1458a_100000717761_100000694040 [0,0,0,0,0,0|2,0,1]=3 143 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cc1)F 1458a_100000717761_100000198546 [0,0,0,0,0,0|2,0,1]=3 144 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cc1)I 1458a_100000717761_100000189116 [0,0,0,0,0,0|2,0,1]=3 145 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cn1)Br 1458a_100000717761_100000702658 [0,0,0,0,0,0|3,0,1]=4 146 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cn1)Cl 1458a_100000717761_100012066911 [0,0,0,0,0,0|3,0,1]=4 147 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cn1)F 1458a_100000717761_100000703193 [0,0,0,0,0,0|3,0,1]=4 148 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(nc1)Br 1458a_100000717761_100009831999 [0,0,0,0,0,0|3,0,1]=4 149 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(nc1)Cl 1458a_100000717761_100000735431 [0,0,0,0,0,0|3,0,1]=4 150 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(nc1)F 1458a_100000717761_100009820150 [0,0,0,0,0,0|3,0,1]=4 151 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000717761 [0,0,0,0,0,0|3,0,1]=4 152 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000717761 [0,0,0,0,0,0|3,0,1]=4 153 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000717761 [0,0,0,0,0,0|3,0,1]=4 154 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000717761 [0,0,0,0,0,0|3,0,1]=4 155 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000717761 [0,0,0,0,0,0|2,0,1]=3 156 B13R1.133 C[C@@H](Oc1ccc(cc1)O)C(=O)[13CH3] 1458a_100000005562_200025704644 [0,0,0,0,0,0|3,0,1]=4 157 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cc1)Br 1458a_217856618621_100000189115 [0,0,0,0,0,0|2,0,1]=3 158 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cc1)Cl 1458a_217856618621_100000694040 [0,0,0,0,0,0|2,0,1]=3 159 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cc1)F 1458a_217856618621_100000198546 [0,0,0,0,0,0|2,0,1]=3 160 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cc1)I 1458a_217856618621_100000189116 [0,0,0,0,0,0|2,0,1]=3 161 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cn1)Br 1458a_217856618621_100000702658 [0,0,0,0,0,0|3,0,1]=4 162 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cn1)Cl 1458a_217856618621_100012066911 [0,0,0,0,0,0|3,0,1]=4 163 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cn1)F 1458a_217856618621_100000703193 [0,0,0,0,0,0|3,0,1]=4 164 B13R1.133 C[C@H](O)C(=O)Cc1ccc(nc1)Br 1458a_217856618621_100009831999 [0,0,0,0,0,0|3,0,1]=4 165 B13R1.133 C[C@H](O)C(=O)Cc1ccc(nc1)Cl 1458a_217856618621_100000735431 [0,0,0,0,0,0|3,0,1]=4 166 B13R1.133 C[C@H](O)C(=O)Cc1ccc(nc1)F 1458a_217856618621_100009820150 [0,0,0,0,0,0|3,0,1]=4 167 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_217856618621 [0,0,0,0,0,0|3,0,1]=4 168 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)Br 22a_100000210018_217856618621 [0,0,0,0,0,0|3,0,1]=4 169 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_217856618621 [0,0,0,0,0,0|3,0,1]=4 170 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_217856618621 [0,0,0,0,0,0|3,0,1]=4 171 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)F 1626a_100000185862_217856618621 [0,0,0,0,0,0|3,0,1]=4 172 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)F 22a_100000185862_217856618621 [0,0,0,0,0,0|3,0,1]=4 173 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)I 1626a_100000185761_217856618621 [0,0,0,0,0,0|3,0,1]=4 174 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)I 22a_100000185761_217856618621 [0,0,0,0,0,0|3,0,1]=4 175 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)O 22a_100000185829_217856618621 [0,0,0,0,0,0|2,0,1]=3 176 B13R1.133 Cc1ccc(cc1)CC(=O)C(C)C 1458a_100000210198_100000210814 [0,0,0,0,0,0|3,0,1]=4 177 B13R1.133 Cc1ccc(cc1)CC(=O)C(C)C 1458a_100000212244_100000210206 [0,0,0,0,0,0|3,0,1]=4 178 B13R1.133 Cc1ccc(cc1)CC(=O)C(C)F 1458a_100000062450_100000210814 [0,0,0,0,0,0|3,0,1]=4 179 B13R1.133 Cc1ccc(cc1)CC(=O)C(O)O 1458a_100000233687_100000210814 [0,0,0,0,0,0|1,0,2]=3 180 B13R1.133 Cc1ccc(cc1)CC(=O)N(C)C 11a_100102631434_100000212244 [0,0,0,0,0,0|4,0,0]=4 181 B13R1.133 Cc1ccc(cc1)CC(=O)N(C)C 240690a_100102631434_100000212244 [0,0,0,0,0,0|4,0,0]=4 182 B13R1.133 Cc1ccc(cc1)CC(=O)N(C)C 527a_100102631434_100000212244 [0,0,0,0,0,0|4,0,0]=4 183 B13R1.133 Cc1ccc(cc1)CC(=O)[C@@H](C)O 1458a_100000717761_100000210814 [0,0,0,0,0,0|2,0,1]=3 184 B13R1.133 Cc1ccc(cc1)CC(=O)[C@H](C)O 1458a_217856618621_100000210814 [0,0,0,0,0,0|2,0,1]=3 185 B13R1.133 Cc1ccc(cc1)NC(=O)C(=O)N 22a_100000124888_100011215815 [0,0,0,0,0,0|3,0,0]=3 186 B13R1.133 Cc1ccc(cc1)NC(=O)C(=O)[13CH3] 1458a_100000189662_200025704644 [0,0,0,0,0,0|3,0,0]=3 187 B13R1.133 Cc1ccc(cc1)NC(=O)C(O)O 22a_100000124888_100000233687 [0,0,0,0,0,0|2,0,2]=4 188 B13R1.133 Cc1ccc(cc1)NC(=O)[C@@H](C)O 22a_100000124888_100000717761 [0,0,0,0,0,0|3,0,1]=4 189 B13R1.133 Cc1ccc(cc1)NC(=O)[C@H](C)O 1626a_100000124888_217856618621 [0,0,0,0,0,0|3,0,1]=4 190 B13R1.133 Cc1ccc(cc1)NC(=O)[C@H](C)O 22a_100000124888_217856618621 [0,0,0,0,0,0|3,0,1]=4 191 B13R1.133 Cc1ccc(cn1)CC(=O)C(O)O 1458a_100000233687_100016987292 [0,0,0,0,0,0|2,0,2]=4 192 B13R1.133 Cc1ccc(cn1)CC(=O)[C@@H](C)O 1458a_100000717761_100016987292 [0,0,0,0,0,0|3,0,1]=4 193 B13R1.133 Cc1ccc(cn1)CC(=O)[C@H](C)O 1458a_217856618621_100016987292 [0,0,0,0,0,0|3,0,1]=4 194 B13R1.133 Cc1ccc(nc1)CC(=O)C(O)O 1458a_100000233687_100000691093 [0,0,0,0,0,0|2,0,2]=4 195 B13R1.133 Cc1ccc(nc1)CC(=O)[C@@H](C)O 1458a_100000717761_100000691093 [0,0,0,0,0,0|3,0,1]=4 196 B13R1.133 Cc1ccc(nc1)CC(=O)[C@H](C)O 1458a_217856618621_100000691093 [0,0,0,0,0,0|3,0,1]=4 197 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100011215815 [0,0,0,0,0,0|3,0,0]=3 198 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100011215815 [0,0,0,0,0,0|3,0,0]=3 199 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)F 22a_100000185862_100011215815 [0,0,0,0,0,0|3,0,0]=3 200 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)I 22a_100000185761_100011215815 [0,0,0,0,0,0|3,0,0]=3 201 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)O 22a_100000185829_100011215815 [0,0,0,0,0,0|2,0,0]=2 202 B13R1.133 NC(=O)C(F)Nc1ccc(cc1)O 34a_100000185829_100009813875 [0,0,0,0,0,0|3,0,1]=4 203 B13R1.133 NC(=O)C(F)Sc1ccc(cc1)O 62a_100009813875_100000185759 [0,0,0,0,0,0|3,0,1]=4 204 B13R1.133 O=C(Cc1ccc(cc1)Br)C(O)O 1458a_100000233687_100000189115 [0,0,0,0,0,0|1,0,2]=3 205 B13R1.133 O=C(Cc1ccc(cc1)Cl)C(O)O 1458a_100000233687_100000694040 [0,0,0,0,0,0|1,0,2]=3 206 B13R1.133 O=C(Cc1ccc(cc1)F)C(O)O 1458a_100000233687_100000198546 [0,0,0,0,0,0|1,0,2]=3 207 B13R1.133 O=C(Cc1ccc(cc1)I)C(O)O 1458a_100000233687_100000189116 [0,0,0,0,0,0|1,0,2]=3 208 B13R1.133 O=C(Cc1ccc(cn1)Br)C(O)O 1458a_100000233687_100000702658 [0,0,0,0,0,0|2,0,2]=4 209 B13R1.133 O=C(Cc1ccc(cn1)Cl)C(O)O 1458a_100000233687_100012066911 [0,0,0,0,0,0|2,0,2]=4 210 B13R1.133 O=C(Cc1ccc(cn1)F)C(O)O 1458a_100000233687_100000703193 [0,0,0,0,0,0|2,0,2]=4 211 B13R1.133 O=C(Cc1ccc(nc1)Br)C(O)O 1458a_100000233687_100009831999 [0,0,0,0,0,0|2,0,2]=4 212 B13R1.133 O=C(Cc1ccc(nc1)Cl)C(O)O 1458a_100000233687_100000735431 [0,0,0,0,0,0|2,0,2]=4 213 B13R1.133 O=C(Cc1ccc(nc1)F)C(O)O 1458a_100000233687_100009820150 [0,0,0,0,0,0|2,0,2]=4 214 B13R1.133 O=C(Nc1ccc(cc1)Br)C(O)O 22a_100000210018_100000233687 [0,0,0,0,0,0|2,0,2]=4 215 B13R1.133 O=C(Nc1ccc(cc1)Cl)C(O)O 22a_100000210052_100000233687 [0,0,0,0,0,0|2,0,2]=4 216 B13R1.133 O=C(Nc1ccc(cc1)F)C(O)O 22a_100000185862_100000233687 [0,0,0,0,0,0|2,0,2]=4 217 B13R1.133 O=C(Nc1ccc(cc1)I)C(O)O 22a_100000185761_100000233687 [0,0,0,0,0,0|2,0,2]=4 218 B13R1.133 O=C(Nc1ccc(cc1)O)C(F)F 22a_100000185829_100000210393 [0,0,0,0,0,0|3,0,1]=4 219 B13R1.133 O=C(Nc1ccc(cc1)O)C(O)O 22a_100000185829_100000233687 [0,0,0,0,0,0|1,0,2]=3 220 B13R1.133 O=C([O-])C(F)Nc1ccc(cc1)O 34a_100000185829_100020610796 [0,0,0,0,0,0|2,0,2]=4 221 B13R1.133 O=C([O-])C(F)Sc1ccc(cc1)O 62a_100020610796_100000185759 [0,0,0,0,0,0|2,0,2]=4 222 B13R1.133 Oc1ccc(cc1)OC(=C(F)F)F 271570a_203496583355_100009828397 [0,0,0,0,0,0|4,0,0]=4 223 B13R1.133 [13CH3]C(=O)C(=O)Nc1ccc(cn1)Cl 1458a_100011297360_200025704644 [0,0,0,0,0,0|4,0,0]=4 224 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)Cl 1458a_100012362158_200025704644 [0,0,0,0,0,0|2,0,2]=4 225 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)F 1458a_100012179405_200025704644 [0,0,0,0,0,0|2,0,2]=4 226 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200025704644 [0,0,0,0,0,0|1,0,2]=3 227 B13R1.133 [13CH3]C(=O)[C@@H](O)Cc1ccc(cc1)Br 1458a_200015644258_200025704644 [0,0,0,0,0,0|2,0,2]=4 228 B12R1.21 CC(=O)/C=C/c1ccc(cc1)O 271570a_203496583355_200016259395 [1,0,0,0,0,0|1,0,1]=3 229 B12R1.21 CC(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_200000210301 [1,0,0,0,0,0|2,0,1]=4 230 B12R1.21 CC(=O)C=Cc1ccc(cc1)C 1458a_100000716854_200000210301 [1,0,0,0,0,0|2,0,1]=4 231 B12R1.21 CC(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_200000210301 [1,0,0,0,0,0|2,0,1]=4 232 B12R1.21 CC(=O)C=Cc1ccc(cc1)F 1458a_100000182136_200000210301 [1,0,0,0,0,0|2,0,1]=4 233 B12R1.21 CC(=O)C=Cc1ccc(cc1)I 1458a_100102526154_200000210301 [1,0,0,0,0,0|2,0,1]=4 234 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000070787_100011740612 [1,0,0,0,0,0|2,0,1]=4 235 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000217147_200000210301 [1,0,0,0,0,0|2,0,1]=4 236 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000070787_100011713686 [1,0,0,0,0,0|2,0,1]=4 237 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000234883_200000210301 [1,0,0,0,0,0|2,0,1]=4 238 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000070787_100011713675 [1,0,0,0,0,0|2,0,1]=4 239 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200000210301 [1,0,0,0,0,0|2,0,1]=4 240 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000070787_100011217392 [1,0,0,0,0,0|2,0,1]=4 241 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000198493_200000210301 [1,0,0,0,0,0|2,0,1]=4 242 B12R1.21 CC(=O)CCc1ccc(cc1)I 1458a_100011217499_200000210301 [1,0,0,0,0,0|2,0,1]=4 243 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000070787_100009816426 [1,0,0,0,0,0|1,0,1]=3 244 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000742835_200000210301 [1,0,0,0,0,0|1,0,1]=3 245 B12R1.21 CC(=O)CCc1ccc(cc1)O 271570a_203496583355_100000723691 [1,0,0,0,0,0|1,0,1]=3 246 B12R1.21 CC(=O)COc1ccc(cc1)O 1458a_100000031633_200000210301 [1,0,0,0,0,0|2,0,1]=4 247 B12R1.21 CC(=O)NCc1ccc(cc1)Br 11a_100000174875_100015343762 [1,0,0,0,0,0|3,0,0]=4 248 B12R1.21 CC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100015343762 [1,0,0,0,0,0|3,0,0]=4 249 B12R1.21 CC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100015343762 [1,0,0,0,0,0|3,0,0]=4 250 B12R1.21 CC(=O)NCc1ccc(cc1)Br 527a_100000174875_100103153847 [1,0,0,0,0,0|3,0,0]=4 251 B12R1.21 CC(=O)NCc1ccc(cc1)C 11a_100000174908_100015343762 [1,0,0,0,0,0|3,0,0]=4 252 B12R1.21 CC(=O)NCc1ccc(cc1)C 1626a_100000174908_100015343762 [1,0,0,0,0,0|3,0,0]=4 253 B12R1.21 CC(=O)NCc1ccc(cc1)C 240690a_100000174908_100015343762 [1,0,0,0,0,0|3,0,0]=4 254 B12R1.21 CC(=O)NCc1ccc(cc1)C 527a_100000174908_100103153847 [1,0,0,0,0,0|3,0,0]=4 255 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100015343762 [1,0,0,0,0,0|3,0,0]=4 256 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100015343762 [1,0,0,0,0,0|3,0,0]=4 257 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100015343762 [1,0,0,0,0,0|3,0,0]=4 258 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100103153847 [1,0,0,0,0,0|3,0,0]=4 259 B12R1.21 CC(=O)NCc1ccc(cc1)F 11a_100000174882_100015343762 [1,0,0,0,0,0|3,0,0]=4 260 B12R1.21 CC(=O)NCc1ccc(cc1)F 1626a_100000174882_100015343762 [1,0,0,0,0,0|3,0,0]=4 261 B12R1.21 CC(=O)NCc1ccc(cc1)F 240690a_100000174882_100015343762 [1,0,0,0,0,0|3,0,0]=4 262 B12R1.21 CC(=O)NCc1ccc(cc1)F 527a_100000174882_100103153847 [1,0,0,0,0,0|3,0,0]=4 263 B12R1.21 CC(=O)NCc1ccc(cc1)I 11a_100016989417_100015343762 [1,0,0,0,0,0|3,0,0]=4 264 B12R1.21 CC(=O)NCc1ccc(cc1)I 1626a_100016989417_100015343762 [1,0,0,0,0,0|3,0,0]=4 265 B12R1.21 CC(=O)NCc1ccc(cc1)I 240690a_100016989417_100015343762 [1,0,0,0,0,0|3,0,0]=4 266 B12R1.21 CC(=O)NCc1ccc(cc1)I 527a_100016989417_100103153847 [1,0,0,0,0,0|3,0,0]=4 267 B12R1.21 CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100015343762 [1,0,0,0,0,0|2,0,0]=3 268 B12R1.21 CC(=O)NCc1ccc(cc1)O 271570a_203496583355_200000685173 [1,0,0,0,0,0|2,0,0]=3 269 B12R1.21 CC(=O)NCc1ccc(cc1)O 527a_100000185549_100103153847 [1,0,0,0,0,0|2,0,0]=3 270 B12R1.21 CC(=O)NCc1ccc(cn1)O 240690a_100020605196_100015343762 [1,0,0,0,0,0|3,0,0]=4 271 B12R1.21 CC(=O)NCc1ccc(nc1)O 11a_100000757128_100015343762 [1,0,0,0,0,0|3,0,0]=4 272 B12R1.21 CC(=O)NCc1ccc(nc1)O 240690a_100000757128_100015343762 [1,0,0,0,0,0|3,0,0]=4 273 B12R1.21 CC(=O)NNc1ccc(cc1)O 271570a_203496583355_200009815283 [1,0,0,0,0,0|3,0,0]=4 274 B12R1.21 CC(O)C=Cc1ccc(cc1)O 271570a_200011019289_100000185759 [1,0,0,0,0,0|1,0,2]=4 275 B12R1.21 Cc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000716854_200025704644 [1,0,0,0,0,0|2,0,1]=4 276 B12R1.21 Cc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000234883_200025704644 [1,0,0,0,0,0|2,0,1]=4 277 B12R1.21 NC(=O)CCc1ccc(cc1)O 271570a_203496583355_200010110666 [1,0,0,0,0,0|1,0,1]=3 278 B12R1.21 NC(=O)CNc1ccc(cc1)O 34a_100000185829_100000187820 [1,0,0,0,0,0|2,0,1]=4 279 B12R1.21 NC(=O)CSc1ccc(cc1)O 271570a_203496583355_100000149456 [1,0,0,0,0,0|2,0,1]=4 280 B12R1.21 NC(=O)CSc1ccc(cc1)O 62a_100000747473_100000185759 [1,0,0,0,0,0|2,0,1]=4 281 B12R1.21 O=C([O-])CNc1ccc(cc1)O 34a_100000185829_100020667443 [1,0,0,0,0,0|1,0,2]=4 282 B12R1.21 O=C([O-])CSc1ccc(cc1)O 62a_100020667443_100000185759 [1,0,0,0,0,0|1,0,2]=4 283 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_200025704644 [1,0,0,0,0,0|2,0,1]=4 284 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_200025704644 [1,0,0,0,0,0|2,0,1]=4 285 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)F 1458a_100000182136_200025704644 [1,0,0,0,0,0|2,0,1]=4 286 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)I 1458a_100102526154_200025704644 [1,0,0,0,0,0|2,0,1]=4 287 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Br 1458a_100000217147_200025704644 [1,0,0,0,0,0|2,0,1]=4 288 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200025704644 [1,0,0,0,0,0|2,0,1]=4 289 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)F 1458a_100000198493_200025704644 [1,0,0,0,0,0|2,0,1]=4 290 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)I 1458a_100011217499_200025704644 [1,0,0,0,0,0|2,0,1]=4 291 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)O 1458a_100000742835_200025704644 [1,0,0,0,0,0|1,0,1]=3 292 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)O 1458a_100000031633_200025704644 [1,0,0,0,0,0|2,0,1]=4 293 B12R1.43 C/C(=C\c1ccccc1)/C(=O)[13CH3] 1458a_100016990649_200025704644 [1,0,0,0,0,0|2,0,1]=4 294 B12R1.43 C=C(Br)C(=O)Nc1ccccc1 11a_100000106764_100009813364 [1,0,0,0,0,0|3,0,0]=4 295 B12R1.43 C=C(Br)C(=O)Nc1ccccc1 1626a_100000106764_100009813364 [1,0,0,0,0,0|3,0,0]=4 296 B12R1.43 C=C(C)C(=O)Cc1ccccc1 1458a_100000185857_100015291786 [1,0,0,0,0,0|2,0,0]=3 297 B12R1.43 C=C(C)C(=O)Cc1ccccn1 1458a_100000185857_100000721315 [1,0,0,0,0,0|3,0,0]=4 298 B12R1.43 C=C(C)C(=O)Cc1cccnc1 1458a_100000185857_100000733263 [1,0,0,0,0,0|3,0,0]=4 299 B12R1.43 C=C(C)C(=O)Cc1ccncc1 1458a_100000185857_100000705612 [1,0,0,0,0,0|3,0,0]=4 300 B12R1.43 C=C(C)C(=O)Nc1ccccc1 11a_100000106764_100000185857 [1,0,0,0,0,0|3,0,0]=4 301 B12R1.43 C=C(C)C(=O)Nc1ccccc1 1626a_100000106764_100000185857 [1,0,0,0,0,0|3,0,0]=4 302 B12R1.43 C=C(C)C(=O)Nc1ccccc1 22a_100000106764_100000185857 [1,0,0,0,0,0|3,0,0]=4 303 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 11a_100000106764_100000039160 [1,0,0,0,0,0|3,0,0]=4 304 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 1626a_100000106764_100000039160 [1,0,0,0,0,0|3,0,0]=4 305 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 22a_100000106764_100000039160 [1,0,0,0,0,0|3,0,0]=4 306 B12R1.43 C=C(F)C(=O)Nc1ccccc1 11a_100000106764_100000036797 [1,0,0,0,0,0|3,0,0]=4 307 B12R1.43 C=C(F)C(=O)Nc1ccccc1 1626a_100000106764_100000036797 [1,0,0,0,0,0|3,0,0]=4 308 B12R1.43 C=C(F)C(=O)Nc1ccccc1 22a_100000106764_100000036797 [1,0,0,0,0,0|3,0,0]=4 309 B12R1.43 CC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_200000210301 [1,0,0,0,0,0|2,0,1]=4 310 B12R1.43 CC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_200000210301 [1,0,0,0,0,0|2,0,1]=4 311 B12R1.43 CC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_200000210301 [1,0,0,0,0,0|2,0,1]=4 312 B12R1.43 CC(=O)C(=O)Nc1ccccc1 1458a_100000738435_200000210301 [1,0,0,0,0,0|2,0,0]=3 313 B12R1.43 CC(=O)C(C)Cc1ccccc1 1458a_100000070787_200011218536 [1,0,0,0,0,0|2,0,1]=4 314 B12R1.43 CC(=O)C(C)Cc1ccccc1 1458a_100000754839_200000210301 [1,0,0,0,0,0|2,0,1]=4 315 B12R1.43 CC(=O)N(C)Cc1ccccc1 11a_100000186898_100015343762 [1,0,0,0,0,0|3,0,0]=4 316 B12R1.43 CC(=O)N(C)Cc1ccccc1 1626a_100000186898_100015343762 [1,0,0,0,0,0|3,0,0]=4 317 B12R1.43 CC(=O)N(C)Cc1ccccc1 240690a_100000186898_100015343762 [1,0,0,0,0,0|3,0,0]=4 318 B12R1.43 CC(=O)N(C)Cc1ccccc1 527a_100000186898_100103153847 [1,0,0,0,0,0|3,0,0]=4 319 B12R1.43 CC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_200000210301 [1,0,0,0,0,0|1,0,2]=4 320 B12R1.43 CC(C)C(=O)Cc1ccccc1 1458a_100000210198_100015291786 [1,0,0,0,0,0|2,0,1]=4 321 B12R1.43 CC(Cc1ccccc1)C(=O)[13CH3] 1458a_100000754839_200025704644 [1,0,0,0,0,0|2,0,1]=4 322 B12R1.43 CC(F)C(=O)Cc1ccccc1 1458a_100000062450_100015291786 [1,0,0,0,0,0|2,0,1]=4 323 B12R1.43 C[C@@H](O)C(=O)Cc1ccccc1 1458a_100000717761_100015291786 [1,0,0,0,0,0|1,0,1]=3 324 B12R1.43 C[C@@H](O)C(=O)Cc1ccccn1 1458a_100000717761_100000721315 [1,0,0,0,0,0|2,0,1]=4 325 B12R1.43 C[C@@H](O)C(=O)Cc1cccnc1 1458a_100000717761_100000733263 [1,0,0,0,0,0|2,0,1]=4 326 B12R1.43 C[C@@H](O)C(=O)Cc1ccncc1 1458a_100000717761_100000705612 [1,0,0,0,0,0|2,0,1]=4 327 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 22a_100000106764_100000717761 [1,0,0,0,0,0|2,0,1]=4 328 B12R1.43 C[C@H](O)C(=O)Cc1ccccc1 1458a_217856618621_100015291786 [1,0,0,0,0,0|1,0,1]=3 329 B12R1.43 C[C@H](O)C(=O)Cc1ccccn1 1458a_217856618621_100000721315 [1,0,0,0,0,0|2,0,1]=4 330 B12R1.43 C[C@H](O)C(=O)Cc1cccnc1 1458a_217856618621_100000733263 [1,0,0,0,0,0|2,0,1]=4 331 B12R1.43 C[C@H](O)C(=O)Cc1ccncc1 1458a_217856618621_100000705612 [1,0,0,0,0,0|2,0,1]=4 332 B12R1.43 C[C@H](O)C(=O)Nc1ccccc1 1626a_100000106764_217856618621 [1,0,0,0,0,0|2,0,1]=4 333 B12R1.43 C[C@H](O)C(=O)Nc1ccccc1 22a_100000106764_217856618621 [1,0,0,0,0,0|2,0,1]=4 334 B12R1.43 NC(=O)C(=O)Nc1ccccc1 22a_100000106764_100011215815 [1,0,0,0,0,0|2,0,0]=3 335 B12R1.43 O=C(Cc1ccccc1)C(O)O 1458a_100000233687_100015291786 [1,0,0,0,0,0|0,0,2]=3 336 B12R1.43 O=C(Cc1ccccn1)C(O)O 1458a_100000233687_100000721315 [1,0,0,0,0,0|1,0,2]=4 337 B12R1.43 O=C(Cc1cccnc1)C(O)O 1458a_100000233687_100000733263 [1,0,0,0,0,0|1,0,2]=4 338 B12R1.43 O=C(Cc1ccncc1)C(O)O 1458a_100000233687_100000705612 [1,0,0,0,0,0|1,0,2]=4 339 B12R1.43 O=C(Nc1ccccc1)C(O)O 22a_100000106764_100000233687 [1,0,0,0,0,0|1,0,2]=4 340 B12R1.43 [13CH3]C(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_200025704644 [1,0,0,0,0,0|2,0,1]=4 341 B12R1.43 [13CH3]C(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_200025704644 [1,0,0,0,0,0|2,0,1]=4 342 B12R1.43 [13CH3]C(=O)C(=O)Nc1ccccc1 1458a_100000738435_200025704644 [1,0,0,0,0,0|2,0,0]=3 343 B12R1.43 [13CH3]C(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_200025704644 [1,0,0,0,0,0|1,0,2]=4 344 B12R1.49 C#CC(=O)Cc1ccc(cc1)Br 1458a_100000211873_100000189115 [1,0,0,0,0,0|2,0,1]=4 345 B12R1.49 C#CC(=O)Cc1ccc(cc1)C 1458a_100000211873_100000210814 [1,0,0,0,0,0|2,0,1]=4 346 B12R1.49 C#CC(=O)Cc1ccc(cc1)Cl 1458a_100000211873_100000694040 [1,0,0,0,0,0|2,0,1]=4 347 B12R1.49 C#CC(=O)Cc1ccc(cc1)F 1458a_100000211873_100000198546 [1,0,0,0,0,0|2,0,1]=4 348 B12R1.49 C#CC(=O)Cc1ccc(cc1)I 1458a_100000211873_100000189116 [1,0,0,0,0,0|2,0,1]=4 349 B12R1.49 C=CC(=O)Cc1ccc(cc1)Br 1458a_100000185746_100000189115 [1,0,0,0,0,0|2,0,0]=3 350 B12R1.49 C=CC(=O)Cc1ccc(cc1)C 1458a_100000185746_100000210814 [1,0,0,0,0,0|2,0,0]=3 351 B12R1.49 C=CC(=O)Cc1ccc(cc1)Cl 1458a_100000185746_100000694040 [1,0,0,0,0,0|2,0,0]=3 352 B12R1.49 C=CC(=O)Cc1ccc(cc1)F 1458a_100000185746_100000198546 [1,0,0,0,0,0|2,0,0]=3 353 B12R1.49 C=CC(=O)Cc1ccc(cc1)I 1458a_100000185746_100000189116 [1,0,0,0,0,0|2,0,0]=3 354 B12R1.49 C=CC(=O)Cc1ccc(cn1)Br 1458a_100000185746_100000702658 [1,0,0,0,0,0|3,0,0]=4 355 B12R1.49 C=CC(=O)Cc1ccc(cn1)C 1458a_100000185746_100000691093 [1,0,0,0,0,0|3,0,0]=4 356 B12R1.49 C=CC(=O)Cc1ccc(cn1)Cl 1458a_100000185746_100012066911 [1,0,0,0,0,0|3,0,0]=4 357 B12R1.49 C=CC(=O)Cc1ccc(cn1)F 1458a_100000185746_100000703193 [1,0,0,0,0,0|3,0,0]=4 358 B12R1.49 C=CC(=O)Cc1ccc(nc1)Br 1458a_100000185746_100009831999 [1,0,0,0,0,0|3,0,0]=4 359 B12R1.49 C=CC(=O)Cc1ccc(nc1)C 1458a_100000185746_100016987292 [1,0,0,0,0,0|3,0,0]=4 360 B12R1.49 C=CC(=O)Cc1ccc(nc1)Cl 1458a_100000185746_100000735431 [1,0,0,0,0,0|3,0,0]=4 361 B12R1.49 C=CC(=O)Cc1ccc(nc1)F 1458a_100000185746_100009820150 [1,0,0,0,0,0|3,0,0]=4 362 B12R1.49 C=CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000185746 [1,0,0,0,0,0|3,0,0]=4 363 B12R1.49 C=CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000185746 [1,0,0,0,0,0|3,0,0]=4 364 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000185746 [1,0,0,0,0,0|3,0,0]=4 365 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000185746 [1,0,0,0,0,0|3,0,0]=4 366 B12R1.49 C=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000185746 [1,0,0,0,0,0|3,0,0]=4 367 B12R1.49 C=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000185746 [1,0,0,0,0,0|3,0,0]=4 368 B12R1.49 C=CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000185746 [1,0,0,0,0,0|3,0,0]=4 369 B12R1.49 C=CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000185746 [1,0,0,0,0,0|3,0,0]=4 370 B12R1.49 C=CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000185746 [1,0,0,0,0,0|3,0,0]=4 371 B12R1.49 C=CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000185746 [1,0,0,0,0,0|3,0,0]=4 372 B12R1.49 C=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000185746 [1,0,0,0,0,0|2,0,0]=3 373 B12R1.49 CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210202 [1,0,0,0,0,0|2,0,1]=4 374 B12R1.49 CCC(=O)Cc1ccc(cc1)Br 1458a_100000210414_100000189115 [1,0,0,0,0,0|2,0,1]=4 375 B12R1.49 CCC(=O)Cc1ccc(cc1)C 1458a_100000210414_100000210814 [1,0,0,0,0,0|2,0,1]=4 376 B12R1.49 CCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210202 [1,0,0,0,0,0|2,0,1]=4 377 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl 1458a_100000210414_100000694040 [1,0,0,0,0,0|2,0,1]=4 378 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210202 [1,0,0,0,0,0|2,0,1]=4 379 B12R1.49 CCC(=O)Cc1ccc(cc1)F 1458a_100000210414_100000198546 [1,0,0,0,0,0|2,0,1]=4 380 B12R1.49 CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210202 [1,0,0,0,0,0|2,0,1]=4 381 B12R1.49 CCC(=O)Cc1ccc(cc1)I 1458a_100000210414_100000189116 [1,0,0,0,0,0|2,0,1]=4 382 B12R1.49 CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210202 [1,0,0,0,0,0|2,0,1]=4 383 B12R1.49 CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210202 [1,0,0,0,0,0|1,0,1]=3 384 B12R1.49 CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210414 [1,0,0,0,0,0|2,0,1]=4 385 B12R1.49 CCC(=O)Oc1ccc(cc1)O 271570a_203496583355_200009811598 [1,0,0,0,0,0|2,0,1]=4 386 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 11a_106832991635_100000198978 [1,0,0,0,0,0|3,0,0]=4 387 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 240690a_100102657272_100000198978 [1,0,0,0,0,0|3,0,0]=4 388 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 527a_100102657272_100000198978 [1,0,0,0,0,0|3,0,0]=4 389 B12R1.49 CNC(=O)Cc1ccc(cc1)C 11a_106832991635_100000212244 [1,0,0,0,0,0|3,0,0]=4 390 B12R1.49 CNC(=O)Cc1ccc(cc1)C 240690a_100102657272_100000212244 [1,0,0,0,0,0|3,0,0]=4 391 B12R1.49 CNC(=O)Cc1ccc(cc1)C 527a_100102657272_100000212244 [1,0,0,0,0,0|3,0,0]=4 392 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 11a_106832991635_100000211027 [1,0,0,0,0,0|3,0,0]=4 393 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 240690a_100102657272_100000211027 [1,0,0,0,0,0|3,0,0]=4 394 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 527a_100102657272_100000211027 [1,0,0,0,0,0|3,0,0]=4 395 B12R1.49 CNC(=O)Cc1ccc(cc1)F 11a_106832991635_100000210951 [1,0,0,0,0,0|3,0,0]=4 396 B12R1.49 CNC(=O)Cc1ccc(cc1)F 1626a_100102657272_100000210951 [1,0,0,0,0,0|3,0,0]=4 397 B12R1.49 CNC(=O)Cc1ccc(cc1)F 240690a_100102657272_100000210951 [1,0,0,0,0,0|3,0,0]=4 398 B12R1.49 CNC(=O)Cc1ccc(cc1)F 527a_100102657272_100000210951 [1,0,0,0,0,0|3,0,0]=4 399 B12R1.49 CNC(=O)Cc1ccc(cc1)I 11a_106832991635_100000688869 [1,0,0,0,0,0|3,0,0]=4 400 B12R1.49 CNC(=O)Cc1ccc(cc1)I 1626a_100102657272_100000688869 [1,0,0,0,0,0|3,0,0]=4 401 B12R1.49 CNC(=O)Cc1ccc(cc1)I 240690a_100102657272_100000688869 [1,0,0,0,0,0|3,0,0]=4 402 B12R1.49 CNC(=O)Cc1ccc(cc1)I 527a_100102657272_100000688869 [1,0,0,0,0,0|3,0,0]=4 403 B12R1.49 CNC(=O)Cc1ccc(cc1)O 1626a_100102657272_100000198540 [1,0,0,0,0,0|2,0,0]=3 404 B12R1.49 CNC(=O)Cc1ccc(cc1)O 240690a_100102657272_100000198540 [1,0,0,0,0,0|2,0,0]=3 405 B12R1.49 CNC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000155101 [1,0,0,0,0,0|2,0,0]=3 406 B12R1.49 CNC(=O)Cc1ccc(cc1)O 527a_100102657272_100000198540 [1,0,0,0,0,0|2,0,0]=3 407 B12R1.49 CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100102657272 [1,0,0,0,0,0|3,0,0]=4 408 B12R1.49 COC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000149743 [1,0,0,0,0,0|2,0,0]=3 409 B12R1.49 COC(=O)Cc1ccc(cn1)O 271570a_203496583355_100012362609 [1,0,0,0,0,0|3,0,0]=4 410 B12R1.49 COC(=O)Cc1ccc(nc1)O 271570a_203496583355_100000071674 [1,0,0,0,0,0|3,0,0]=4 411 B12R1.49 COC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000181880 [1,0,0,0,0,0|3,0,0]=4 412 B12R1.49 Cc1ccc(cc1)CC(=O)CF 1458a_100000212244_100015361967 [1,0,0,0,0,0|2,0,1]=4 413 B12R1.49 Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000210814 [1,0,0,0,0,0|1,0,1]=3 414 B12R1.49 Cc1ccc(cc1)NC(=O)CO 22a_100000124888_100000210174 [1,0,0,0,0,0|2,0,1]=4 415 B12R1.49 Cc1ccc(cc1)NC(=O)CO 527a_100000124888_100000210174 [1,0,0,0,0,0|2,0,1]=4 416 B12R1.49 Cc1ccc(cn1)CC(=O)CO 1458a_100000210174_100016987292 [1,0,0,0,0,0|2,0,1]=4 417 B12R1.49 Cc1ccc(nc1)CC(=O)CO 1458a_100000210174_100000691093 [1,0,0,0,0,0|2,0,1]=4 418 B12R1.49 O=C(CF)Cc1ccc(cc1)Br 1458a_100000198978_100015361967 [1,0,0,0,0,0|2,0,1]=4 419 B12R1.49 O=C(CF)Cc1ccc(cc1)Cl 1458a_100000211027_100015361967 [1,0,0,0,0,0|2,0,1]=4 420 B12R1.49 O=C(CF)Cc1ccc(cc1)F 1458a_100000210951_100015361967 [1,0,0,0,0,0|2,0,1]=4 421 B12R1.49 O=C(CF)Cc1ccc(cc1)I 1458a_100000688869_100015361967 [1,0,0,0,0,0|2,0,1]=4 422 B12R1.49 O=C(CF)Cc1ccc(cc1)O 1458a_100000198540_100015361967 [1,0,0,0,0,0|1,0,1]=3 423 B12R1.49 O=C(CO)Cc1ccc(cc1)Br 1458a_100000210174_100000189115 [1,0,0,0,0,0|1,0,1]=3 424 B12R1.49 O=C(CO)Cc1ccc(cc1)Cl 1458a_100000210174_100000694040 [1,0,0,0,0,0|1,0,1]=3 425 B12R1.49 O=C(CO)Cc1ccc(cc1)F 1458a_100000210174_100000198546 [1,0,0,0,0,0|1,0,1]=3 426 B12R1.49 O=C(CO)Cc1ccc(cc1)I 1458a_100000210174_100000189116 [1,0,0,0,0,0|1,0,1]=3 427 B12R1.49 O=C(CO)Cc1ccc(cn1)Br 1458a_100000210174_100000702658 [1,0,0,0,0,0|2,0,1]=4 428 B12R1.49 O=C(CO)Cc1ccc(cn1)Cl 1458a_100000210174_100012066911 [1,0,0,0,0,0|2,0,1]=4 429 B12R1.49 O=C(CO)Cc1ccc(cn1)F 1458a_100000210174_100000703193 [1,0,0,0,0,0|2,0,1]=4 430 B12R1.49 O=C(CO)Cc1ccc(nc1)Br 1458a_100000210174_100009831999 [1,0,0,0,0,0|2,0,1]=4 431 B12R1.49 O=C(CO)Cc1ccc(nc1)Cl 1458a_100000210174_100000735431 [1,0,0,0,0,0|2,0,1]=4 432 B12R1.49 O=C(CO)Cc1ccc(nc1)F 1458a_100000210174_100009820150 [1,0,0,0,0,0|2,0,1]=4 433 B12R1.49 O=C(CO)Nc1ccc(cc1)Br 22a_100000210018_100000210174 [1,0,0,0,0,0|2,0,1]=4 434 B12R1.49 O=C(CO)Nc1ccc(cc1)Br 527a_100000210018_100000210174 [1,0,0,0,0,0|2,0,1]=4 435 B12R1.49 O=C(CO)Nc1ccc(cc1)Cl 22a_100000210052_100000210174 [1,0,0,0,0,0|2,0,1]=4 436 B12R1.49 O=C(CO)Nc1ccc(cc1)Cl 527a_100000210052_100000210174 [1,0,0,0,0,0|2,0,1]=4 437 B12R1.49 O=C(CO)Nc1ccc(cc1)F 22a_100000185862_100000210174 [1,0,0,0,0,0|2,0,1]=4 438 B12R1.49 O=C(CO)Nc1ccc(cc1)F 527a_100000185862_100000210174 [1,0,0,0,0,0|2,0,1]=4 439 B12R1.49 O=C(CO)Nc1ccc(cc1)I 22a_100000185761_100000210174 [1,0,0,0,0,0|2,0,1]=4 440 B12R1.49 O=C(CO)Nc1ccc(cc1)I 527a_100000185761_100000210174 [1,0,0,0,0,0|2,0,1]=4 441 B12R1.49 O=C(CO)Nc1ccc(cc1)O 22a_100000185829_100000210174 [1,0,0,0,0,0|1,0,1]=3 442 B14R1.3 C#Cc1ccc(cc1)CC(=O)C(=C)C 1458a_100000185857_100000140223 [0,1,0,0,0,0|3,0,0]=4 443 B14R1.3 C#Cc1ccc(cc1)CC(=O)C(O)O 1458a_100000233687_100000140223 [0,1,0,0,0,0|1,0,2]=4 444 B14R1.3 C#Cc1ccc(cc1)CC(=O)[C@@H](C)O 1458a_100000717761_100000140223 [0,1,0,0,0,0|2,0,1]=4 445 B14R1.3 C#Cc1ccc(cc1)CC(=O)[C@H](C)O 1458a_217856618621_100000140223 [0,1,0,0,0,0|2,0,1]=4 446 B14R1.3 C#Cc1ccc(cc1)NC(=O)C(=O)N 22a_100011215031_100011215815 [0,1,0,0,0,0|3,0,0]=4 447 B14R1.3 C=C(Br)C(=O)Nc1ccc(cc1)OC 11a_100000184247_100009813364 [0,1,0,0,0,0|3,0,0]=4 448 B14R1.3 C=C(Br)C(=O)Nc1ccc(cc1)OC 1626a_100000184247_100009813364 [0,1,0,0,0,0|3,0,0]=4 449 B14R1.3 C=C(C)C(=O)Cc1ccc(cc1)C#N 1458a_100000185857_100000184898 [0,1,0,0,0,0|3,0,0]=4 450 B14R1.3 C=C(C)C(=O)Cc1ccc(cc1)C=O 1458a_100000185857_100000075337 [0,1,0,0,0,0|2,0,1]=4 451 B14R1.3 C=C(C)C(=O)Cc1ccc(cc1)CC 1458a_100000185857_100000747183 [0,1,0,0,0,0|3,0,0]=4 452 B14R1.3 C=C(C)C(=O)Cc1ccc(cc1)CO 1458a_100000185857_100000067286 [0,1,0,0,0,0|2,0,0]=3 453 B14R1.3 C=C(C)C(=O)Cc1ccc(cc1)SC 1458a_100000185857_100000181263 [0,1,0,0,0,0|2,1,0]=4 454 B14R1.3 C=C(C)C(=O)Cc1ccc(cn1)OC 1458a_100000185857_200000757186 [0,1,0,0,0,0|3,0,0]=4 455 B14R1.3 C=C(C)C(=O)Cc1ccc(nc1)OC 1458a_100000185857_100020631284 [0,1,0,0,0,0|3,0,0]=4 456 B14R1.3 C=C(C)C(=O)Nc1ccc(cc1)CO 22a_100011215238_100000185857 [0,1,0,0,0,0|3,0,0]=4 457 B14R1.3 C=C(C)C(=O)Nc1ccc(cc1)OC 11a_100000184247_100000185857 [0,1,0,0,0,0|3,0,0]=4 458 B14R1.3 C=C(C)C(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000185857 [0,1,0,0,0,0|3,0,0]=4 459 B14R1.3 C=C(C)C(=O)Nc1ccc(cc1)OC 22a_100000184247_100000185857 [0,1,0,0,0,0|3,0,0]=4 460 B14R1.3 C=C(C)C(=O)Nc1ccc(cc1)OC 34a_200000065598_200000210301 [0,1,0,0,0,0|3,0,0]=4 461 B14R1.3 C=C(C)C(=O)Nc1ccc(cc1)O[13CH3] 34a_200000065598_200025704644 [0,1,0,0,0,0|3,0,0]=4 462 B14R1.3 C=C(Cl)C(=O)Nc1ccc(cc1)CO 22a_100011215238_100000039160 [0,1,0,0,0,0|3,0,0]=4 463 B14R1.3 C=C(Cl)C(=O)Nc1ccc(cc1)OC 11a_100000184247_100000039160 [0,1,0,0,0,0|3,0,0]=4 464 B14R1.3 C=C(Cl)C(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000039160 [0,1,0,0,0,0|3,0,0]=4 465 B14R1.3 C=C(Cl)C(=O)Nc1ccc(cc1)OC 22a_100000184247_100000039160 [0,1,0,0,0,0|3,0,0]=4 466 B14R1.3 C=C(F)C(=O)Nc1ccc(cc1)CO 22a_100011215238_100000036797 [0,1,0,0,0,0|3,0,0]=4 467 B14R1.3 C=C(F)C(=O)Nc1ccc(cc1)OC 11a_100000184247_100000036797 [0,1,0,0,0,0|3,0,0]=4 468 B14R1.3 C=C(F)C(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000036797 [0,1,0,0,0,0|3,0,0]=4 469 B14R1.3 C=C(F)C(=O)Nc1ccc(cc1)OC 22a_100000184247_100000036797 [0,1,0,0,0,0|3,0,0]=4 470 B14R1.3 C=Cc1ccc(cc1)CC(=O)C(=C)C 1458a_100000185857_100000034074 [0,1,0,0,0,0|3,0,0]=4 471 B14R1.3 C=Cc1ccc(cc1)CC(=O)C(O)O 1458a_100000233687_100000034074 [0,1,0,0,0,0|1,0,2]=4 472 B14R1.3 C=Cc1ccc(cc1)CC(=O)[C@@H](C)O 1458a_100000717761_100000034074 [0,1,0,0,0,0|2,0,1]=4 473 B14R1.3 C=Cc1ccc(cc1)CC(=O)[C@H](C)O 1458a_217856618621_100000034074 [0,1,0,0,0,0|2,0,1]=4 474 B14R1.3 C=Cc1ccc(cc1)NC(=O)C(=O)N 22a_100011218248_100011215815 [0,1,0,0,0,0|3,0,0]=4 475 B14R1.3 CC(C)C(=O)Cc1ccc(cc1)CO 1458a_100000210198_100000067286 [0,1,0,0,0,0|2,0,1]=4 476 B14R1.3 CC(C)C(=O)Cc1ccc(cc1)CO 1458a_100011356463_100000210206 [0,1,0,0,0,0|2,0,1]=4 477 B14R1.3 CC(F)C(=O)Cc1ccc(cc1)CO 1458a_100000062450_100000067286 [0,1,0,0,0,0|2,0,1]=4 478 B14R1.3 CCc1ccc(cc1)CC(=O)C(O)O 1458a_100000233687_100000747183 [0,1,0,0,0,0|1,0,2]=4 479 B14R1.3 CCc1ccc(cc1)CC(=O)[C@@H](C)O 1458a_100000717761_100000747183 [0,1,0,0,0,0|2,0,1]=4 480 B14R1.3 CCc1ccc(cc1)CC(=O)[C@H](C)O 1458a_217856618621_100000747183 [0,1,0,0,0,0|2,0,1]=4 481 B14R1.3 CCc1ccc(cc1)NC(=O)C(=O)N 22a_100000211069_100011215815 [0,1,0,0,0,0|3,0,0]=4 482 B14R1.3 CN(C)C(=O)Cc1ccc(cc1)CO 240690a_100102631434_100011356463 [0,1,0,0,0,0|3,0,0]=4 483 B14R1.3 COc1ccc(cc1)CC(=O)C(C)C 1458a_100000210706_100000210206 [0,1,0,0,0,0|2,0,1]=4 484 B14R1.3 COc1ccc(cc1)CC(=O)N(C)C 11a_100102631434_100000210706 [0,1,0,0,0,0|3,0,0]=4 485 B14R1.3 COc1ccc(cc1)CC(=O)N(C)C 240690a_100102631434_100000210706 [0,1,0,0,0,0|3,0,0]=4 486 B14R1.3 COc1ccc(cc1)CC(=O)N(C)C 527a_100102631434_100000210706 [0,1,0,0,0,0|3,0,0]=4 487 B14R1.3 COc1ccc(cc1)CN(C)C(=O)C 11a_100000184145_100015343762 [0,1,0,0,0,0|3,0,0]=4 488 B14R1.3 COc1ccc(cc1)CN(C)C(=O)C 1626a_100000184145_100015343762 [0,1,0,0,0,0|3,0,0]=4 489 B14R1.3 COc1ccc(cc1)CN(C)C(=O)C 240690a_100000184145_100015343762 [0,1,0,0,0,0|3,0,0]=4 490 B14R1.3 COc1ccc(cc1)CN(C)C(=O)C 527a_100000184145_100103153847 [0,1,0,0,0,0|3,0,0]=4 491 B14R1.3 COc1ccc(cc1)C[C@H](N)C(=O)N 34a_100011423149_200000210301 [0,1,0,0,0,0|2,0,1]=4 492 B14R1.3 COc1ccc(cc1)NC(=O)C(=O)N 22a_100000184247_100011215815 [0,1,0,0,0,0|2,0,0]=3 493 B14R1.3 COc1ccc(cc1)NC(=O)C(O)O 22a_100000184247_100000233687 [0,1,0,0,0,0|1,0,2]=4 494 B14R1.3 COc1ccc(cc1)NC(=O)[C@@H](C)O 22a_100000184247_100000717761 [0,1,0,0,0,0|2,0,1]=4 495 B14R1.3 COc1ccc(cc1)NC(=O)[C@H](C)O 1626a_100000184247_217856618621 [0,1,0,0,0,0|2,0,1]=4 496 B14R1.3 COc1ccc(cc1)NC(=O)[C@H](C)O 22a_100000184247_217856618621 [0,1,0,0,0,0|2,0,1]=4 497 B14R1.3 COc1ccc(cn1)CC(=O)C(O)O 1458a_100000233687_100020631284 [0,1,0,0,0,0|1,0,2]=4 498 B14R1.3 COc1ccc(cn1)CC(=O)[C@@H](C)O 1458a_100000717761_100020631284 [0,1,0,0,0,0|2,0,1]=4 499 B14R1.3 COc1ccc(cn1)CC(=O)[C@H](C)O 1458a_217856618621_100020631284 [0,1,0,0,0,0|2,0,1]=4 500 B14R1.3 COc1ccc(nc1)CC(=O)C(O)O 1458a_100000233687_200000757186 [0,1,0,0,0,0|1,0,2]=4 501 B14R1.3 COc1ccc(nc1)CC(=O)[C@@H](C)O 1458a_100000717761_200000757186 [0,1,0,0,0,0|2,0,1]=4 502 B14R1.3 COc1ccc(nc1)CC(=O)[C@H](C)O 1458a_217856618621_200000757186 [0,1,0,0,0,0|2,0,1]=4 503 B14R1.3 CSc1ccc(cc1)CC(=O)C(O)O 1458a_100000233687_100000181263 [0,1,0,0,0,0|0,1,2]=4 504 B14R1.3 CSc1ccc(cc1)CC(=O)[C@@H](C)O 1458a_100000717761_100000181263 [0,1,0,0,0,0|1,1,1]=4 505 B14R1.3 CSc1ccc(cc1)CC(=O)[C@H](C)O 1458a_217856618621_100000181263 [0,1,0,0,0,0|1,1,1]=4 506 B14R1.3 CSc1ccc(cc1)NC(=O)C(=O)N 22a_100000212337_100011215815 [0,1,0,0,0,0|2,1,0]=4 507 B14R1.3 C[C@@H](O)C(=O)Cc1ccc(cc1)C#N 1458a_100000717761_100000184898 [0,1,0,0,0,0|2,0,1]=4 508 B14R1.3 C[C@@H](O)C(=O)Cc1ccc(cc1)C=O 1458a_100000717761_100000075337 [0,1,0,0,0,0|1,0,2]=4 509 B14R1.3 C[C@@H](O)C(=O)Cc1ccc(cc1)CO 1458a_100000717761_100000067286 [0,1,0,0,0,0|1,0,1]=3 510 B14R1.3 C[C@@H](O)C(=O)Nc1ccc(cc1)CO 22a_100011215238_100000717761 [0,1,0,0,0,0|2,0,1]=4 511 B14R1.3 C[C@H](O)C(=O)Cc1ccc(cc1)C#N 1458a_217856618621_100000184898 [0,1,0,0,0,0|2,0,1]=4 512 B14R1.3 C[C@H](O)C(=O)Cc1ccc(cc1)C=O 1458a_217856618621_100000075337 [0,1,0,0,0,0|1,0,2]=4 513 B14R1.3 C[C@H](O)C(=O)Cc1ccc(cc1)CO 1458a_217856618621_100000067286 [0,1,0,0,0,0|1,0,1]=3 514 B14R1.3 C[C@H](O)C(=O)Nc1ccc(cc1)CO 22a_100011215238_217856618621 [0,1,0,0,0,0|2,0,1]=4 515 B14R1.3 N#Cc1ccc(cc1)CC(=O)C(O)O 1458a_100000233687_100000184898 [0,1,0,0,0,0|1,0,2]=4 516 B14R1.3 NC(=O)C(=O)Nc1ccc(cc1)CO 22a_100011215238_100011215815 [0,1,0,0,0,0|2,0,0]=3 517 B14R1.3 O=C(Cc1ccc(cc1)CO)C(O)O 1458a_100000233687_100000067286 [0,1,0,0,0,0|0,0,2]=3 518 B14R1.3 O=C(Nc1ccc(cc1)CO)C(O)O 22a_100011215238_100000233687 [0,1,0,0,0,0|1,0,2]=4 519 B14R1.3 O=Cc1ccc(cc1)CC(=O)C(O)O 1458a_100000233687_100000075337 [0,1,0,0,0,0|0,0,3]=4 520 B14R1.3 [13CH3]Oc1ccc(cc1)C[C@H](N)C(=O)N 34a_100011423149_200025704644 [0,1,0,0,0,0|2,0,1]=4 521 B14R1.132 C=C(C)C(=O)C(C)c1ccc(cc1)Br 1458a_100000185857_100000755118 [0,1,0,0,0,0|3,0,0]=4 522 B14R1.132 C=C(C)C(=O)C(C)c1ccc(cc1)C 1458a_100000185857_100011261388 [0,1,0,0,0,0|3,0,0]=4 523 B14R1.132 C=C(C)C(=O)C(C)c1ccc(cc1)Cl 1458a_100000185857_100000684792 [0,1,0,0,0,0|3,0,0]=4 524 B14R1.132 C=C(C)C(=O)C(C)c1ccc(cc1)F 1458a_100000185857_100000743420 [0,1,0,0,0,0|3,0,0]=4 525 B14R1.132 C=C(C)C(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000185857 [0,1,0,0,0,0|3,0,0]=4 526 B14R1.132 C=C(Cl)C(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000039160 [0,1,0,0,0,0|3,0,0]=4 527 B14R1.132 C=C(F)C(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000036797 [0,1,0,0,0,0|3,0,0]=4 528 B14R1.132 CC(C(=O)C(O)O)c1ccc(cc1)Br 1458a_100000233687_100000755118 [0,1,0,0,0,0|1,0,2]=4 529 B14R1.132 CC(C(=O)C(O)O)c1ccc(cc1)Cl 1458a_100000233687_100000684792 [0,1,0,0,0,0|1,0,2]=4 530 B14R1.132 CC(C(=O)C(O)O)c1ccc(cc1)F 1458a_100000233687_100000743420 [0,1,0,0,0,0|1,0,2]=4 531 B14R1.132 CC(C(=O)N(C)C)c1ccc(cc1)O 240690a_100102631434_100000031422 [0,1,0,0,0,0|3,0,0]=4 532 B14R1.132 CC(C(=O)[C@@H](C)O)c1ccc(cc1)Br 1458a_100000717761_100000755118 [0,1,0,0,0,0|2,0,1]=4 533 B14R1.132 CC(C(=O)[C@@H](C)O)c1ccc(cc1)Cl 1458a_100000717761_100000684792 [0,1,0,0,0,0|2,0,1]=4 534 B14R1.132 CC(C(=O)[C@@H](C)O)c1ccc(cc1)F 1458a_100000717761_100000743420 [0,1,0,0,0,0|2,0,1]=4 535 B14R1.132 CC(C(=O)[C@H](C)O)c1ccc(cc1)Br 1458a_217856618621_100000755118 [0,1,0,0,0,0|2,0,1]=4 536 B14R1.132 CC(C(=O)[C@H](C)O)c1ccc(cc1)Cl 1458a_217856618621_100000684792 [0,1,0,0,0,0|2,0,1]=4 537 B14R1.132 CC(C(=O)[C@H](C)O)c1ccc(cc1)F 1458a_217856618621_100000743420 [0,1,0,0,0,0|2,0,1]=4 538 B14R1.132 CC(C)C(=O)C(C)c1ccc(cc1)O 1458a_100000031422_100000210206 [0,1,0,0,0,0|2,0,1]=4 539 B14R1.132 CC(C)C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000210206 [0,1,0,0,0,0|2,0,1]=4 540 B14R1.132 CN(C(=O)C(=O)N)c1ccc(cc1)Br 22a_100000219623_100011215815 [0,1,0,0,0,0|3,0,0]=4 541 B14R1.132 CN(C(=O)C(=O)N)c1ccc(cc1)Cl 22a_100020629279_100011215815 [0,1,0,0,0,0|3,0,0]=4 542 B14R1.132 CN(C(=O)C(=O)N)c1ccc(cc1)F 22a_100000219829_100011215815 [0,1,0,0,0,0|3,0,0]=4 543 B14R1.132 CN(C(=O)C(=O)N)c1ccc(cc1)I 22a_100000743151_100011215815 [0,1,0,0,0,0|3,0,0]=4 544 B14R1.132 CN(C(=O)C(=O)N)c1ccc(cc1)O 22a_100000182112_100011215815 [0,1,0,0,0,0|2,0,0]=3 545 B14R1.132 CN(C(=O)C(O)O)c1ccc(cc1)O 22a_100000182112_100000233687 [0,1,0,0,0,0|1,0,2]=4 546 B14R1.132 CN(C)C(=O)C(O)c1ccc(cc1)O 240690a_100102631434_100011215213 [0,1,0,0,0,0|3,0,0]=4 547 B14R1.132 C[C@@H](O)C(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000717761 [0,1,0,0,0,0|2,0,1]=4 548 B14R1.132 C[C@H](O)C(=O)N(C)c1ccc(cc1)O 22a_100000182112_217856618621 [0,1,0,0,0,0|2,0,1]=4 549 B14R1.132 Cc1ccc(cc1)C(C)C(=O)C(O)O 1458a_100000233687_100011261388 [0,1,0,0,0,0|1,0,2]=4 550 B14R1.132 Cc1ccc(cc1)C(C)C(=O)[C@@H](C)O 1458a_100000717761_100011261388 [0,1,0,0,0,0|2,0,1]=4 551 B14R1.132 Cc1ccc(cc1)C(C)C(=O)[C@H](C)O 1458a_217856618621_100011261388 [0,1,0,0,0,0|2,0,1]=4 552 B14R1.132 Cc1ccc(cc1)N(C)C(=O)C(=O)N 22a_100000219977_100011215815 [0,1,0,0,0,0|3,0,0]=4 553 B14R1.134 C#CC(C)C(=O)Cc1ccc(cc1)O 1458a_100000198540_200000035995 [0,1,0,0,0,0|2,0,1]=4 554 B14R1.134 C/C=C(\C)/C(=O)Cc1ccc(cc1)Br 1458a_100020587367_100000189115 [0,1,0,0,0,0|3,0,0]=4 555 B14R1.134 C/C=C(\C)/C(=O)Cc1ccc(cc1)C 1458a_100020587367_100000210814 [0,1,0,0,0,0|3,0,0]=4 556 B14R1.134 C/C=C(\C)/C(=O)Cc1ccc(cc1)Cl 1458a_100020587367_100000694040 [0,1,0,0,0,0|3,0,0]=4 557 B14R1.134 C/C=C(\C)/C(=O)Cc1ccc(cc1)F 1458a_100020587367_100000198546 [0,1,0,0,0,0|3,0,0]=4 558 B14R1.134 C/C=C(\C)/C(=O)Cc1ccc(cc1)I 1458a_100020587367_100000189116 [0,1,0,0,0,0|3,0,0]=4 559 B14R1.134 C/C=C(\C)/C(=O)Nc1ccc(cc1)O 22a_100000185829_100020587367 [0,1,0,0,0,0|3,0,0]=4 560 B14R1.134 C=C(CO)C(=O)Nc1ccc(cc1)Br 22a_100000210018_200000705526 [0,1,0,0,0,0|3,0,0]=4 561 B14R1.134 C=C(CO)C(=O)Nc1ccc(cc1)C 22a_100000124888_200000705526 [0,1,0,0,0,0|3,0,0]=4 562 B14R1.134 C=C(CO)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_200000705526 [0,1,0,0,0,0|3,0,0]=4 563 B14R1.134 C=C(CO)C(=O)Nc1ccc(cc1)F 22a_100000185862_200000705526 [0,1,0,0,0,0|3,0,0]=4 564 B14R1.134 C=C(CO)C(=O)Nc1ccc(cc1)I 22a_100000185761_200000705526 [0,1,0,0,0,0|3,0,0]=4 565 B14R1.134 C=C(CO)C(=O)Nc1ccc(cc1)O 22a_100000185829_200000705526 [0,1,0,0,0,0|2,0,0]=3 566 B14R1.134 C=CC(=O)N(C)Cc1ccc(cc1)O 240690a_100000207500_200121576911 [0,1,0,0,0,0|3,0,0]=4 567 B14R1.134 CC(C#N)C(=O)Cc1ccc(cc1)O 1458a_100000198540_100000703298 [0,1,0,0,0,0|2,0,1]=4 568 B14R1.134 CCC(=O)C(=O)Nc1ccc(cc1)C 1458a_100000189662_100000210202 [0,1,0,0,0,0|3,0,0]=4 569 B14R1.134 CCC(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_100000210202 [0,1,0,0,0,0|1,0,2]=4 570 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)O 240690a_100000207500_100000210414 [0,1,0,0,0,0|3,0,0]=4 571 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)O 527a_100000207500_100000210414 [0,1,0,0,0,0|3,0,0]=4 572 B14R1.134 CCC(C)C(=O)Cc1ccc(cc1)O 1458a_100000198540_100000758301 [0,1,0,0,0,0|2,0,1]=4 573 B14R1.134 CCC(O)C(=O)Cc1ccc(cc1)Br 1458a_100011196387_100000189115 [0,1,0,0,0,0|2,0,1]=4 574 B14R1.134 CCC(O)C(=O)Cc1ccc(cc1)C 1458a_100011196387_100000210814 [0,1,0,0,0,0|2,0,1]=4 575 B14R1.134 CCC(O)C(=O)Cc1ccc(cc1)Cl 1458a_100011196387_100000694040 [0,1,0,0,0,0|2,0,1]=4 576 B14R1.134 CCC(O)C(=O)Cc1ccc(cc1)F 1458a_100011196387_100000198546 [0,1,0,0,0,0|2,0,1]=4 577 B14R1.134 CCC(O)C(=O)Cc1ccc(cc1)I 1458a_100011196387_100000189116 [0,1,0,0,0,0|2,0,1]=4 578 B14R1.134 CCC(O)C(=O)Nc1ccc(cc1)O 22a_100000185829_100011196387 [0,1,0,0,0,0|2,0,1]=4 579 B14R1.134 CCN(C)C(=O)Cc1ccc(cc1)O 1626a_100000225621_100000198540 [0,1,0,0,0,0|3,0,0]=4 580 B14R1.134 CCN(C)C(=O)Cc1ccc(cc1)O 240690a_100000225621_100000198540 [0,1,0,0,0,0|3,0,0]=4 581 B14R1.134 CCN(C)C(=O)Cc1ccc(cc1)O 527a_100000225621_100000198540 [0,1,0,0,0,0|3,0,0]=4 582 B14R1.134 CN(Cc1ccc(cc1)Br)C(=O)CO 240690a_100000180866_100000210174 [0,1,0,0,0,0|3,0,0]=4 583 B14R1.134 CN(Cc1ccc(cc1)Br)C(=O)CO 527a_100000180866_100000210174 [0,1,0,0,0,0|3,0,0]=4 584 B14R1.134 CN(Cc1ccc(cc1)Cl)C(=O)CO 240690a_100000184517_100000210174 [0,1,0,0,0,0|3,0,0]=4 585 B14R1.134 CN(Cc1ccc(cc1)Cl)C(=O)CO 527a_100000184517_100000210174 [0,1,0,0,0,0|3,0,0]=4 586 B14R1.134 CN(Cc1ccc(cc1)F)C(=O)CO 240690a_100000184576_100000210174 [0,1,0,0,0,0|3,0,0]=4 587 B14R1.134 CN(Cc1ccc(cc1)F)C(=O)CO 527a_100000184576_100000210174 [0,1,0,0,0,0|3,0,0]=4 588 B14R1.134 CN(Cc1ccc(cc1)O)C(=O)CO 240690a_100000207500_100000210174 [0,1,0,0,0,0|2,0,0]=3 589 B14R1.134 CN(Cc1ccc(cc1)O)C(=O)CO 527a_100000207500_100000210174 [0,1,0,0,0,0|2,0,0]=3 590 B14R1.134 CNC(=O)C(=O)Cc1ccc(cc1)Br 1458a_100011218921_100000189115 [0,1,0,0,0,0|2,0,0]=3 591 B14R1.134 CNC(=O)C(=O)Cc1ccc(cc1)C 1458a_100011218921_100000210814 [0,1,0,0,0,0|2,0,0]=3 592 B14R1.134 CNC(=O)C(=O)Cc1ccc(cc1)Cl 1458a_100011218921_100000694040 [0,1,0,0,0,0|2,0,0]=3 593 B14R1.134 CNC(=O)C(=O)Cc1ccc(cc1)F 1458a_100011218921_100000198546 [0,1,0,0,0,0|2,0,0]=3 594 B14R1.134 CNC(=O)C(=O)Cc1ccc(cc1)I 1458a_100011218921_100000189116 [0,1,0,0,0,0|2,0,0]=3 595 B14R1.134 CNC(=O)C(=O)Cc1ccc(cn1)Br 1458a_100011218921_100000702658 [0,1,0,0,0,0|3,0,0]=4 596 B14R1.134 CNC(=O)C(=O)Cc1ccc(cn1)C 1458a_100011218921_100000691093 [0,1,0,0,0,0|3,0,0]=4 597 B14R1.134 CNC(=O)C(=O)Cc1ccc(cn1)Cl 1458a_100011218921_100012066911 [0,1,0,0,0,0|3,0,0]=4 598 B14R1.134 CNC(=O)C(=O)Cc1ccc(cn1)F 1458a_100011218921_100000703193 [0,1,0,0,0,0|3,0,0]=4 599 B14R1.134 CNC(=O)C(=O)Cc1ccc(nc1)Br 1458a_100011218921_100009831999 [0,1,0,0,0,0|3,0,0]=4 600 B14R1.134 CNC(=O)C(=O)Cc1ccc(nc1)C 1458a_100011218921_100016987292 [0,1,0,0,0,0|3,0,0]=4 601 B14R1.134 CNC(=O)C(=O)Cc1ccc(nc1)Cl 1458a_100011218921_100000735431 [0,1,0,0,0,0|3,0,0]=4 602 B14R1.134 CNC(=O)C(=O)Cc1ccc(nc1)F 1458a_100011218921_100009820150 [0,1,0,0,0,0|3,0,0]=4 603 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100011218921 [0,1,0,0,0,0|3,0,0]=4 604 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100011218921 [0,1,0,0,0,0|3,0,0]=4 605 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Br 527a_100000210018_100011218921 [0,1,0,0,0,0|3,0,0]=4 606 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)C 1626a_100000124888_100011218921 [0,1,0,0,0,0|3,0,0]=4 607 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)C 1626a_100102657272_100000189662 [0,1,0,0,0,0|3,0,0]=4 608 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)C 22a_100000124888_100011218921 [0,1,0,0,0,0|3,0,0]=4 609 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)C 240690a_100102657272_100000189662 [0,1,0,0,0,0|3,0,0]=4 610 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)C 527a_100000124888_100011218921 [0,1,0,0,0,0|3,0,0]=4 611 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100011218921 [0,1,0,0,0,0|3,0,0]=4 612 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Cl 1626a_100102657272_100000199041 [0,1,0,0,0,0|3,0,0]=4 613 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100011218921 [0,1,0,0,0,0|3,0,0]=4 614 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Cl 240690a_100102657272_100000199041 [0,1,0,0,0,0|3,0,0]=4 615 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Cl 527a_100000210052_100011218921 [0,1,0,0,0,0|3,0,0]=4 616 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100011218921 [0,1,0,0,0,0|3,0,0]=4 617 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)F 1626a_100102657272_100011297306 [0,1,0,0,0,0|3,0,0]=4 618 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)F 22a_100000185862_100011218921 [0,1,0,0,0,0|3,0,0]=4 619 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)F 240690a_100102657272_100011297306 [0,1,0,0,0,0|3,0,0]=4 620 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)F 527a_100000185862_100011218921 [0,1,0,0,0,0|3,0,0]=4 621 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100011218921 [0,1,0,0,0,0|3,0,0]=4 622 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)I 22a_100000185761_100011218921 [0,1,0,0,0,0|3,0,0]=4 623 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)I 527a_100000185761_100011218921 [0,1,0,0,0,0|3,0,0]=4 624 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)O 22a_100000185829_100011218921 [0,1,0,0,0,0|2,0,0]=3 625 B14R1.134 CNC(=O)C(=O)Sc1ccc(cc1)C 11a_106832991635_100009913200 [0,1,0,0,0,0|3,0,0]=4 626 B14R1.134 CNC(=O)C(=O)Sc1ccc(cc1)C 1626a_100102657272_100009913200 [0,1,0,0,0,0|3,0,0]=4 627 B14R1.134 CNC(=O)C(=O)Sc1ccc(cc1)C 240690a_100102657272_100009913200 [0,1,0,0,0,0|3,0,0]=4 628 B14R1.134 CNC(=O)C(=O)Sc1ccc(cc1)C 527a_100102657272_100009913200 [0,1,0,0,0,0|3,0,0]=4 629 B14R1.134 CNC(=O)C(O)Cc1ccc(cc1)O 240690a_100102657272_100015278814 [0,1,0,0,0,0|1,0,2]=4 630 B14R1.134 CNC(=O)N(C)Cc1ccc(cc1)O 2708a_100102657272_100000207500 [0,1,0,0,0,0|3,0,0]=4 631 B14R1.134 CNC(=O)N(C)Cc1ccc(cc1)O 273464a_100102657272_100000207500 [0,1,0,0,0,0|3,0,0]=4 632 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100000024059 [0,1,0,0,0,0|2,0,0]=3 633 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000024059 [0,1,0,0,0,0|2,0,0]=3 634 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)Br 527a_100000210018_100000024059 [0,1,0,0,0,0|2,0,0]=3 635 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)C 11a_100000124888_100000024059 [0,1,0,0,0,0|2,0,0]=3 636 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)C 1626a_100000124888_100000024059 [0,1,0,0,0,0|2,0,0]=3 637 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)C 527a_100000124888_100000024059 [0,1,0,0,0,0|2,0,0]=3 638 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000024059 [0,1,0,0,0,0|2,0,0]=3 639 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000024059 [0,1,0,0,0,0|2,0,0]=3 640 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000024059 [0,1,0,0,0,0|2,0,0]=3 641 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)F 11a_100000185862_100000024059 [0,1,0,0,0,0|2,0,0]=3 642 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100000024059 [0,1,0,0,0,0|2,0,0]=3 643 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)F 527a_100000185862_100000024059 [0,1,0,0,0,0|2,0,0]=3 644 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)I 11a_100000185761_100000024059 [0,1,0,0,0,0|2,0,0]=3 645 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100000024059 [0,1,0,0,0,0|2,0,0]=3 646 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)I 527a_100000185761_100000024059 [0,1,0,0,0,0|2,0,0]=3 647 B14R1.134 COC(=O)C(C)Nc1ccc(cc1)O 34a_100000185829_100000211248 [0,1,0,0,0,0|2,0,1]=4 648 B14R1.134 COC(=O)C(C)Sc1ccc(cc1)O 62a_100000211248_100000185759 [0,1,0,0,0,0|2,0,1]=4 649 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(cc1)O 271570a_203496583355_100032004906 [0,1,0,0,0,0|1,0,1]=3 650 B14R1.134 COC(=O)[C@H](N)Cc1ccc(cc1)O 271570a_203496583355_100150708851 [0,1,0,0,0,0|1,0,1]=3 651 B14R1.134 COC(C)C(=O)Cc1ccc(cc1)Br 1458a_100000743197_100000189115 [0,1,0,0,0,0|2,0,1]=4 652 B14R1.134 COC(C)C(=O)Cc1ccc(cc1)C 1458a_100000743197_100000210814 [0,1,0,0,0,0|2,0,1]=4 653 B14R1.134 COC(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000743197_100000694040 [0,1,0,0,0,0|2,0,1]=4 654 B14R1.134 COC(C)C(=O)Cc1ccc(cc1)F 1458a_100000743197_100000198546 [0,1,0,0,0,0|2,0,1]=4 655 B14R1.134 COC(C)C(=O)Cc1ccc(cc1)I 1458a_100000743197_100000189116 [0,1,0,0,0,0|2,0,1]=4 656 B14R1.134 COC(C)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000743197 [0,1,0,0,0,0|2,0,1]=4 657 B14R1.134 CON(C)C(=O)Cc1ccc(cc1)O 271570a_203496583355_200000153862 [0,1,0,0,0,0|2,0,0]=3 658 B14R1.134 Cc1ccc(cc1)CC(=O)C(O)CO 1458a_100011215603_100000210814 [0,1,0,0,0,0|1,0,2]=4 659 B14R1.134 Cc1ccc(cc1)CN(C)C(=O)CO 240690a_100000744650_100000210174 [0,1,0,0,0,0|3,0,0]=4 660 B14R1.134 Cc1ccc(cc1)CN(C)C(=O)CO 527a_100000744650_100000210174 [0,1,0,0,0,0|3,0,0]=4 661 B14R1.134 Cc1ccc(cc1)NC(=O)C(=O)CF 1458a_100000189662_100015361967 [0,1,0,0,0,0|3,0,0]=4 662 B14R1.134 O=C(CF)C(O)Cc1ccc(cc1)O 1458a_100015278814_100015361967 [0,1,0,0,0,0|1,0,2]=4 663 B14R1.134 O=C(Cc1ccc(cc1)Br)C(O)CO 1458a_100011215603_100000189115 [0,1,0,0,0,0|1,0,2]=4 664 B14R1.134 O=C(Cc1ccc(cc1)Cl)C(O)CO 1458a_100011215603_100000694040 [0,1,0,0,0,0|1,0,2]=4 665 B14R1.134 O=C(Cc1ccc(cc1)F)C(O)CO 1458a_100011215603_100000198546 [0,1,0,0,0,0|1,0,2]=4 666 B14R1.134 O=C(Cc1ccc(cc1)I)C(O)CO 1458a_100011215603_100000189116 [0,1,0,0,0,0|1,0,2]=4 667 B14R1.134 O=C(Nc1ccc(cc1)O)C(O)CO 22a_100000185829_100011215603 [0,1,0,0,0,0|1,0,2]=4 668 B14R1.536 CC(=O)C(=Cc1ccc(cc1)O)C#N 1458a_100000162680_200000210301 [0,1,0,0,0,0|2,0,1]=4 669 B14R1.536 CCN(Cc1ccc(cc1)O)C(=O)C 240690a_100000748449_100015343762 [0,1,0,0,0,0|3,0,0]=4 670 B14R1.536 CN[C@@H](Cc1ccc(cc1)O)C(=O)N 2230a_100011423149_200000210301 [0,1,0,0,0,0|2,0,1]=4 671 B14R1.536 CN[C@@H](Cc1ccc(cc1)O)C(=O)N 34a_100011423149_200000210301 [0,1,0,0,0,0|2,0,1]=4 672 B14R1.536 [13CH3]C(=O)C(=Cc1ccc(cc1)O)C#N 1458a_100000162680_200025704644 [0,1,0,0,0,0|2,0,1]=4 673 B14R1.536 [13CH3]N[C@@H](Cc1ccc(cc1)O)C(=O)N 2230a_100011423149_200025704644 [0,1,0,0,0,0|2,0,1]=4 674 B14R1.536 [13CH3]N[C@@H](Cc1ccc(cc1)O)C(=O)N 34a_100011423149_200025704644 [0,1,0,0,0,0|2,0,1]=4 675 B14R1.686 C=C(Br)C(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100009813364 [0,1,0,0,0,0|3,0,0]=4 676 B14R1.686 C=C(C)C(=O)Cc1cc(=O)c(co1)O 1458a_100000185857_100000010605 [0,1,0,0,0,0|3,0,0]=4 677 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)Br)Br 1458a_100000185857_100012353900 [0,1,0,0,0,0|3,0,0]=4 678 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)Br)C 1458a_100000185857_100012232412 [0,1,0,0,0,0|3,0,0]=4 679 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000185857_100012353894 [0,1,0,0,0,0|3,0,0]=4 680 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)Br)F 1458a_100000185857_100011206884 [0,1,0,0,0,0|3,0,0]=4 681 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)C)Br 1458a_100000185857_100000727479 [0,1,0,0,0,0|3,0,0]=4 682 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)C)C 1458a_100000185857_100000742320 [0,1,0,0,0,0|3,0,0]=4 683 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)C)Cl 1458a_100000185857_100012184735 [0,1,0,0,0,0|3,0,0]=4 684 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)C)F 1458a_100000185857_100011216667 [0,1,0,0,0,0|3,0,0]=4 685 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000185857_100012353895 [0,1,0,0,0,0|3,0,0]=4 686 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)Cl)C 1458a_100000185857_100011823929 [0,1,0,0,0,0|3,0,0]=4 687 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000185857_100000184707 [0,1,0,0,0,0|3,0,0]=4 688 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)Cl)F 1458a_100000185857_100000717365 [0,1,0,0,0,0|3,0,0]=4 689 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)Cl)I 1458a_100000185857_100012349665 [0,1,0,0,0,0|3,0,0]=4 690 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)F)Br 1458a_100000185857_100000767054 [0,1,0,0,0,0|3,0,0]=4 691 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)F)C 1458a_100000185857_100011217369 [0,1,0,0,0,0|3,0,0]=4 692 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)F)Cl 1458a_100000185857_100000716492 [0,1,0,0,0,0|3,0,0]=4 693 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)F)F 1458a_100000185857_100000757363 [0,1,0,0,0,0|3,0,0]=4 694 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)F)I 1458a_100000185857_100010149604 [0,1,0,0,0,0|3,0,0]=4 695 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)I)Br 1458a_100000185857_100010146616 [0,1,0,0,0,0|3,0,0]=4 696 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)I)C 1458a_100000185857_100010206137 [0,1,0,0,0,0|3,0,0]=4 697 B14R1.686 C=C(C)C(=O)Cc1ccc(c(c1)I)F 1458a_100000185857_100010188208 [0,1,0,0,0,0|3,0,0]=4 698 B14R1.686 C=C(C)C(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000185857 [0,1,0,0,0,0|3,0,0]=4 699 B14R1.686 C=C(C)C(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100000185857 [0,1,0,0,0,0|3,0,0]=4 700 B14R1.686 C=C(C)C(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000185857 [0,1,0,0,0,0|3,0,0]=4 701 B14R1.686 C=C(C)C(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000185857 [0,1,0,0,0,0|3,0,0]=4 702 B14R1.686 C=C(C)C(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000185857 [0,1,0,0,0,0|3,0,0]=4 703 B14R1.686 C=C(C)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000185857 [0,1,0,0,0,0|3,0,0]=4 704 B14R1.686 C=C(Cl)C(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000039160 [0,1,0,0,0,0|3,0,0]=4 705 B14R1.686 C=C(Cl)C(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100000039160 [0,1,0,0,0,0|3,0,0]=4 706 B14R1.686 C=C(Cl)C(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000039160 [0,1,0,0,0,0|3,0,0]=4 707 B14R1.686 C=C(Cl)C(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000039160 [0,1,0,0,0,0|3,0,0]=4 708 B14R1.686 C=C(Cl)C(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000039160 [0,1,0,0,0,0|3,0,0]=4 709 B14R1.686 C=C(Cl)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000039160 [0,1,0,0,0,0|3,0,0]=4 710 B14R1.686 C=C(F)C(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000036797 [0,1,0,0,0,0|3,0,0]=4 711 B14R1.686 C=C(F)C(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100000036797 [0,1,0,0,0,0|3,0,0]=4 712 B14R1.686 C=C(F)C(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000036797 [0,1,0,0,0,0|3,0,0]=4 713 B14R1.686 C=C(F)C(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000036797 [0,1,0,0,0,0|3,0,0]=4 714 B14R1.686 C=C(F)C(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000036797 [0,1,0,0,0,0|3,0,0]=4 715 B14R1.686 C=C(F)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000036797 [0,1,0,0,0,0|3,0,0]=4 716 B14R1.686 CC(=O)C(=O)Nc1ccc(c(c1)C)C 1458a_100000189585_200000210301 [0,1,0,0,0,0|3,0,0]=4 717 B14R1.686 CC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200000210301 [0,1,0,0,0,0|1,0,2]=4 718 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)O)O 240690a_100020587154_100015343762 [0,1,0,0,0,0|3,0,0]=4 719 B14R1.686 CC(C)C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000210206 [0,1,0,0,0,0|2,0,1]=4 720 B14R1.686 CC(C)C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000210206 [0,1,0,0,0,0|2,0,1]=4 721 B14R1.686 CC(C)C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100000210206 [0,1,0,0,0,0|2,0,1]=4 722 B14R1.686 CC(C)C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210206 [0,1,0,0,0,0|2,0,1]=4 723 B14R1.686 CN(C)C(=O)Cc1ccc(c(c1)Br)O 240690a_100102631434_100009990404 [0,1,0,0,0,0|3,0,0]=4 724 B14R1.686 CN(C)C(=O)Cc1ccc(c(c1)Br)O 527a_100102631434_100009990404 [0,1,0,0,0,0|3,0,0]=4 725 B14R1.686 CN(C)C(=O)Cc1ccc(c(c1)Cl)O 240690a_100102631434_100000035197 [0,1,0,0,0,0|3,0,0]=4 726 B14R1.686 CN(C)C(=O)Cc1ccc(c(c1)Cl)O 527a_100102631434_100000035197 [0,1,0,0,0,0|3,0,0]=4 727 B14R1.686 CN(C)C(=O)Cc1ccc(c(c1)F)O 240690a_100102631434_100000039761 [0,1,0,0,0,0|3,0,0]=4 728 B14R1.686 CN(C)C(=O)Cc1ccc(c(c1)F)O 527a_100102631434_100000039761 [0,1,0,0,0,0|3,0,0]=4 729 B14R1.686 CN(C)C(=O)Cc1ccc(c(c1)O)O 527a_100102631434_100000031429 [0,1,0,0,0,0|3,0,0]=4 730 B14R1.686 C[C@@H](O)C(=O)Cc1cc(=O)c(co1)O 1458a_100000717761_100000010605 [0,1,0,0,0,0|2,0,1]=4 731 B14R1.686 C[C@@H](O)C(=O)Cc1ccc(c(c1)Br)Br 1458a_100000717761_100012353900 [0,1,0,0,0,0|2,0,1]=4 732 B14R1.686 C[C@@H](O)C(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000717761_100012353894 [0,1,0,0,0,0|2,0,1]=4 733 B14R1.686 C[C@@H](O)C(=O)Cc1ccc(c(c1)Br)F 1458a_100000717761_100011206884 [0,1,0,0,0,0|2,0,1]=4 734 B14R1.686 C[C@@H](O)C(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000717761_100012353895 [0,1,0,0,0,0|2,0,1]=4 735 B14R1.686 C[C@@H](O)C(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000717761_100000184707 [0,1,0,0,0,0|2,0,1]=4 736 B14R1.686 C[C@@H](O)C(=O)Cc1ccc(c(c1)Cl)F 1458a_100000717761_100000717365 [0,1,0,0,0,0|2,0,1]=4 737 B14R1.686 C[C@@H](O)C(=O)Cc1ccc(c(c1)Cl)I 1458a_100000717761_100012349665 [0,1,0,0,0,0|2,0,1]=4 738 B14R1.686 C[C@@H](O)C(=O)Cc1ccc(c(c1)F)Br 1458a_100000717761_100000767054 [0,1,0,0,0,0|2,0,1]=4 739 B14R1.686 C[C@@H](O)C(=O)Cc1ccc(c(c1)F)Cl 1458a_100000717761_100000716492 [0,1,0,0,0,0|2,0,1]=4 740 B14R1.686 C[C@@H](O)C(=O)Cc1ccc(c(c1)F)F 1458a_100000717761_100000757363 [0,1,0,0,0,0|2,0,1]=4 741 B14R1.686 C[C@@H](O)C(=O)Cc1ccc(c(c1)F)I 1458a_100000717761_100010149604 [0,1,0,0,0,0|2,0,1]=4 742 B14R1.686 C[C@@H](O)C(=O)Cc1ccc(c(c1)I)Br 1458a_100000717761_100010146616 [0,1,0,0,0,0|2,0,1]=4 743 B14R1.686 C[C@@H](O)C(=O)Cc1ccc(c(c1)I)F 1458a_100000717761_100010188208 [0,1,0,0,0,0|2,0,1]=4 744 B14R1.686 C[C@@H](O)C(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000717761 [0,1,0,0,0,0|2,0,1]=4 745 B14R1.686 C[C@@H](O)C(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000717761 [0,1,0,0,0,0|2,0,1]=4 746 B14R1.686 C[C@@H](O)C(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000717761 [0,1,0,0,0,0|2,0,1]=4 747 B14R1.686 C[C@@H](O)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000717761 [0,1,0,0,0,0|2,0,1]=4 748 B14R1.686 C[C@H](O)C(=O)Cc1cc(=O)c(co1)O 1458a_217856618621_100000010605 [0,1,0,0,0,0|2,0,1]=4 749 B14R1.686 C[C@H](O)C(=O)Cc1ccc(c(c1)Br)Br 1458a_217856618621_100012353900 [0,1,0,0,0,0|2,0,1]=4 750 B14R1.686 C[C@H](O)C(=O)Cc1ccc(c(c1)Br)Cl 1458a_217856618621_100012353894 [0,1,0,0,0,0|2,0,1]=4 751 B14R1.686 C[C@H](O)C(=O)Cc1ccc(c(c1)Br)F 1458a_217856618621_100011206884 [0,1,0,0,0,0|2,0,1]=4 752 B14R1.686 C[C@H](O)C(=O)Cc1ccc(c(c1)Cl)Br 1458a_217856618621_100012353895 [0,1,0,0,0,0|2,0,1]=4 753 B14R1.686 C[C@H](O)C(=O)Cc1ccc(c(c1)Cl)Cl 1458a_217856618621_100000184707 [0,1,0,0,0,0|2,0,1]=4 754 B14R1.686 C[C@H](O)C(=O)Cc1ccc(c(c1)Cl)F 1458a_217856618621_100000717365 [0,1,0,0,0,0|2,0,1]=4 755 B14R1.686 C[C@H](O)C(=O)Cc1ccc(c(c1)Cl)I 1458a_217856618621_100012349665 [0,1,0,0,0,0|2,0,1]=4 756 B14R1.686 C[C@H](O)C(=O)Cc1ccc(c(c1)F)Br 1458a_217856618621_100000767054 [0,1,0,0,0,0|2,0,1]=4 757 B14R1.686 C[C@H](O)C(=O)Cc1ccc(c(c1)F)Cl 1458a_217856618621_100000716492 [0,1,0,0,0,0|2,0,1]=4 758 B14R1.686 C[C@H](O)C(=O)Cc1ccc(c(c1)F)F 1458a_217856618621_100000757363 [0,1,0,0,0,0|2,0,1]=4 759 B14R1.686 C[C@H](O)C(=O)Cc1ccc(c(c1)F)I 1458a_217856618621_100010149604 [0,1,0,0,0,0|2,0,1]=4 760 B14R1.686 C[C@H](O)C(=O)Cc1ccc(c(c1)I)Br 1458a_217856618621_100010146616 [0,1,0,0,0,0|2,0,1]=4 761 B14R1.686 C[C@H](O)C(=O)Cc1ccc(c(c1)I)F 1458a_217856618621_100010188208 [0,1,0,0,0,0|2,0,1]=4 762 B14R1.686 C[C@H](O)C(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_217856618621 [0,1,0,0,0,0|2,0,1]=4 763 B14R1.686 C[C@H](O)C(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_217856618621 [0,1,0,0,0,0|2,0,1]=4 764 B14R1.686 C[C@H](O)C(=O)Nc1ccc(c(c1)F)O 22a_100011220035_217856618621 [0,1,0,0,0,0|2,0,1]=4 765 B14R1.686 C[C@H](O)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_217856618621 [0,1,0,0,0,0|2,0,1]=4 766 B14R1.686 Cc1cc(ccc1Br)CC(=O)C(O)O 1458a_100000233687_100000727479 [0,1,0,0,0,0|1,0,2]=4 767 B14R1.686 Cc1cc(ccc1Br)CC(=O)[C@@H](C)O 1458a_100000717761_100000727479 [0,1,0,0,0,0|2,0,1]=4 768 B14R1.686 Cc1cc(ccc1Br)CC(=O)[C@H](C)O 1458a_217856618621_100000727479 [0,1,0,0,0,0|2,0,1]=4 769 B14R1.686 Cc1cc(ccc1Br)NC(=O)C(=O)N 22a_100000210723_100011215815 [0,1,0,0,0,0|3,0,0]=4 770 B14R1.686 Cc1cc(ccc1Cl)CC(=O)C(O)O 1458a_100000233687_100012184735 [0,1,0,0,0,0|1,0,2]=4 771 B14R1.686 Cc1cc(ccc1Cl)CC(=O)[C@@H](C)O 1458a_100000717761_100012184735 [0,1,0,0,0,0|2,0,1]=4 772 B14R1.686 Cc1cc(ccc1Cl)CC(=O)[C@H](C)O 1458a_217856618621_100012184735 [0,1,0,0,0,0|2,0,1]=4 773 B14R1.686 Cc1cc(ccc1Cl)NC(=O)C(=O)N 22a_100000187808_100011215815 [0,1,0,0,0,0|3,0,0]=4 774 B14R1.686 Cc1cc(ccc1F)CC(=O)C(O)O 1458a_100000233687_100011216667 [0,1,0,0,0,0|1,0,2]=4 775 B14R1.686 Cc1cc(ccc1F)CC(=O)[C@@H](C)O 1458a_100000717761_100011216667 [0,1,0,0,0,0|2,0,1]=4 776 B14R1.686 Cc1cc(ccc1F)CC(=O)[C@H](C)O 1458a_217856618621_100011216667 [0,1,0,0,0,0|2,0,1]=4 777 B14R1.686 Cc1cc(ccc1F)NC(=O)C(=O)N 22a_100000750164_100011215815 [0,1,0,0,0,0|3,0,0]=4 778 B14R1.686 Cc1cc(ccc1I)NC(=O)C(=O)N 22a_100000198070_100011215815 [0,1,0,0,0,0|3,0,0]=4 779 B14R1.686 Cc1cc(ccc1O)CC(=O)C(C)C 1458a_100000083968_100000210206 [0,1,0,0,0,0|2,0,1]=4 780 B14R1.686 Cc1cc(ccc1O)CC(=O)N(C)C 240690a_100102631434_100000083968 [0,1,0,0,0,0|3,0,0]=4 781 B14R1.686 Cc1cc(ccc1O)CC(=O)N(C)C 527a_100102631434_100000083968 [0,1,0,0,0,0|3,0,0]=4 782 B14R1.686 Cc1cc(ccc1O)NC(=O)C(=O)N 22a_100011218179_100011215815 [0,1,0,0,0,0|2,0,0]=3 783 B14R1.686 Cc1cc(ccc1O)NC(=O)C(O)O 22a_100011218179_100000233687 [0,1,0,0,0,0|1,0,2]=4 784 B14R1.686 Cc1cc(ccc1O)NC(=O)[C@@H](C)O 22a_100011218179_100000717761 [0,1,0,0,0,0|2,0,1]=4 785 B14R1.686 Cc1cc(ccc1O)NC(=O)[C@H](C)O 22a_100011218179_217856618621 [0,1,0,0,0,0|2,0,1]=4 786 B14R1.686 Cc1ccc(cc1Br)CC(=O)C(O)O 1458a_100000233687_100012232412 [0,1,0,0,0,0|1,0,2]=4 787 B14R1.686 Cc1ccc(cc1Br)CC(=O)[C@@H](C)O 1458a_100000717761_100012232412 [0,1,0,0,0,0|2,0,1]=4 788 B14R1.686 Cc1ccc(cc1Br)CC(=O)[C@H](C)O 1458a_217856618621_100012232412 [0,1,0,0,0,0|2,0,1]=4 789 B14R1.686 Cc1ccc(cc1Br)NC(=O)C(=O)N 22a_100000736455_100011215815 [0,1,0,0,0,0|3,0,0]=4 790 B14R1.686 Cc1ccc(cc1C)CC(=O)C(O)O 1458a_100000233687_100000742320 [0,1,0,0,0,0|1,0,2]=4 791 B14R1.686 Cc1ccc(cc1C)CC(=O)[C@@H](C)O 1458a_100000717761_100000742320 [0,1,0,0,0,0|2,0,1]=4 792 B14R1.686 Cc1ccc(cc1C)CC(=O)[C@H](C)O 1458a_217856618621_100000742320 [0,1,0,0,0,0|2,0,1]=4 793 B14R1.686 Cc1ccc(cc1C)NC(=O)C(=O)N 22a_100000724040_100011215815 [0,1,0,0,0,0|3,0,0]=4 794 B14R1.686 Cc1ccc(cc1C)NC(=O)C(=O)[13CH3] 1458a_100000189585_200025704644 [0,1,0,0,0,0|3,0,0]=4 795 B14R1.686 Cc1ccc(cc1Cl)CC(=O)C(O)O 1458a_100000233687_100011823929 [0,1,0,0,0,0|1,0,2]=4 796 B14R1.686 Cc1ccc(cc1Cl)CC(=O)[C@@H](C)O 1458a_100000717761_100011823929 [0,1,0,0,0,0|2,0,1]=4 797 B14R1.686 Cc1ccc(cc1Cl)CC(=O)[C@H](C)O 1458a_217856618621_100011823929 [0,1,0,0,0,0|2,0,1]=4 798 B14R1.686 Cc1ccc(cc1Cl)NC(=O)C(=O)N 22a_100000188892_100011215815 [0,1,0,0,0,0|3,0,0]=4 799 B14R1.686 Cc1ccc(cc1F)CC(=O)C(O)O 1458a_100000233687_100011217369 [0,1,0,0,0,0|1,0,2]=4 800 B14R1.686 Cc1ccc(cc1F)CC(=O)[C@@H](C)O 1458a_100000717761_100011217369 [0,1,0,0,0,0|2,0,1]=4 801 B14R1.686 Cc1ccc(cc1F)CC(=O)[C@H](C)O 1458a_217856618621_100011217369 [0,1,0,0,0,0|2,0,1]=4 802 B14R1.686 Cc1ccc(cc1F)NC(=O)C(=O)N 22a_100000210958_100011215815 [0,1,0,0,0,0|3,0,0]=4 803 B14R1.686 Cc1ccc(cc1I)CC(=O)C(O)O 1458a_100000233687_100010206137 [0,1,0,0,0,0|1,0,2]=4 804 B14R1.686 Cc1ccc(cc1I)CC(=O)[C@@H](C)O 1458a_100000717761_100010206137 [0,1,0,0,0,0|2,0,1]=4 805 B14R1.686 Cc1ccc(cc1I)CC(=O)[C@H](C)O 1458a_217856618621_100010206137 [0,1,0,0,0,0|2,0,1]=4 806 B14R1.686 Cc1ccc(cc1I)NC(=O)C(=O)N 22a_100000184131_100011215815 [0,1,0,0,0,0|3,0,0]=4 807 B14R1.686 Cc1ccc(cc1O)NC(=O)C(=O)N 22a_100000759471_100011215815 [0,1,0,0,0,0|3,0,0]=4 808 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)Br)Br 22a_100011306057_100011215815 [0,1,0,0,0,0|3,0,0]=4 809 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)Br)Cl 22a_100000686031_100011215815 [0,1,0,0,0,0|3,0,0]=4 810 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)Br)F 22a_100000760356_100011215815 [0,1,0,0,0,0|3,0,0]=4 811 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)Br)I 22a_100000750458_100011215815 [0,1,0,0,0,0|3,0,0]=4 812 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100011215815 [0,1,0,0,0,0|2,0,0]=3 813 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)Cl)Br 22a_100000687081_100011215815 [0,1,0,0,0,0|3,0,0]=4 814 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)Cl)Cl 22a_100000184108_100011215815 [0,1,0,0,0,0|3,0,0]=4 815 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)Cl)F 22a_100000211060_100011215815 [0,1,0,0,0,0|3,0,0]=4 816 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)Cl)I 22a_100000761885_100011215815 [0,1,0,0,0,0|3,0,0]=4 817 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100011215815 [0,1,0,0,0,0|2,0,0]=3 818 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)F)Br 22a_100000759894_100011215815 [0,1,0,0,0,0|3,0,0]=4 819 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)F)Cl 22a_100000739366_100011215815 [0,1,0,0,0,0|3,0,0]=4 820 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)F)F 22a_100000210724_100011215815 [0,1,0,0,0,0|3,0,0]=4 821 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)F)I 22a_100011356925_100011215815 [0,1,0,0,0,0|3,0,0]=4 822 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100011215815 [0,1,0,0,0,0|2,0,0]=3 823 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)I)Br 22a_100000750459_100011215815 [0,1,0,0,0,0|3,0,0]=4 824 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)I)Cl 22a_100012360549_100011215815 [0,1,0,0,0,0|3,0,0]=4 825 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)I)F 22a_114828291077_100011215815 [0,1,0,0,0,0|3,0,0]=4 826 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100011215815 [0,1,0,0,0,0|3,0,0]=4 827 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100011215815 [0,1,0,0,0,0|3,0,0]=4 828 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100011215815 [0,1,0,0,0,0|2,0,0]=3 829 B14R1.686 O=C(Cc1cc(=O)c(co1)O)C(O)O 1458a_100000233687_100000010605 [0,1,0,0,0,0|1,0,2]=4 830 B14R1.686 O=C(Cc1ccc(c(c1)Br)Br)C(O)O 1458a_100000233687_100012353900 [0,1,0,0,0,0|1,0,2]=4 831 B14R1.686 O=C(Cc1ccc(c(c1)Br)Cl)C(O)O 1458a_100000233687_100012353894 [0,1,0,0,0,0|1,0,2]=4 832 B14R1.686 O=C(Cc1ccc(c(c1)Br)F)C(O)O 1458a_100000233687_100011206884 [0,1,0,0,0,0|1,0,2]=4 833 B14R1.686 O=C(Cc1ccc(c(c1)Cl)Br)C(O)O 1458a_100000233687_100012353895 [0,1,0,0,0,0|1,0,2]=4 834 B14R1.686 O=C(Cc1ccc(c(c1)Cl)Cl)C(O)O 1458a_100000233687_100000184707 [0,1,0,0,0,0|1,0,2]=4 835 B14R1.686 O=C(Cc1ccc(c(c1)Cl)F)C(O)O 1458a_100000233687_100000717365 [0,1,0,0,0,0|1,0,2]=4 836 B14R1.686 O=C(Cc1ccc(c(c1)Cl)I)C(O)O 1458a_100000233687_100012349665 [0,1,0,0,0,0|1,0,2]=4 837 B14R1.686 O=C(Cc1ccc(c(c1)F)Br)C(O)O 1458a_100000233687_100000767054 [0,1,0,0,0,0|1,0,2]=4 838 B14R1.686 O=C(Cc1ccc(c(c1)F)Cl)C(O)O 1458a_100000233687_100000716492 [0,1,0,0,0,0|1,0,2]=4 839 B14R1.686 O=C(Cc1ccc(c(c1)F)F)C(O)O 1458a_100000233687_100000757363 [0,1,0,0,0,0|1,0,2]=4 840 B14R1.686 O=C(Cc1ccc(c(c1)F)I)C(O)O 1458a_100000233687_100010149604 [0,1,0,0,0,0|1,0,2]=4 841 B14R1.686 O=C(Cc1ccc(c(c1)I)Br)C(O)O 1458a_100000233687_100010146616 [0,1,0,0,0,0|1,0,2]=4 842 B14R1.686 O=C(Cc1ccc(c(c1)I)F)C(O)O 1458a_100000233687_100010188208 [0,1,0,0,0,0|1,0,2]=4 843 B14R1.686 O=C(Nc1ccc(c(c1)Br)O)C(O)O 22a_100011534360_100000233687 [0,1,0,0,0,0|1,0,2]=4 844 B14R1.686 O=C(Nc1ccc(c(c1)Cl)O)C(O)O 22a_100000744943_100000233687 [0,1,0,0,0,0|1,0,2]=4 845 B14R1.686 O=C(Nc1ccc(c(c1)F)O)C(O)O 22a_100011220035_100000233687 [0,1,0,0,0,0|1,0,2]=4 846 B14R1.686 [13CH3]C(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200025704644 [0,1,0,0,0,0|1,0,2]=4 847 B14R1.700 CC(C)(O)C(=O)Cc1ccc(cc1)Br 1458a_100000242741_100000189115 [0,1,0,0,0,0|2,0,1]=4 848 B14R1.700 CC(C)(O)C(=O)Cc1ccc(cc1)Cl 1458a_100000242741_100000694040 [0,1,0,0,0,0|2,0,1]=4 849 B14R1.700 CC(C)(O)C(=O)Cc1ccc(cc1)F 1458a_100000242741_100000198546 [0,1,0,0,0,0|2,0,1]=4 850 B14R1.700 CC(C)(O)C(=O)Cc1ccc(cc1)I 1458a_100000242741_100000189116 [0,1,0,0,0,0|2,0,1]=4 851 B14R1.700 CC(C)(O)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000242741 [0,1,0,0,0,0|2,0,1]=4 852 B14R1.700 Cc1ccc(cc1)CC(=O)C(C)(C)O 1458a_100000242741_100000210814 [0,1,0,0,0,0|2,0,1]=4 853 B14R1.700 O=C(Cc1ccc(cc1)O)C(F)(F)F 1458a_100000198540_200000243211 [0,1,0,0,0,0|2,0,1]=4 854 B14R1.700 O=C(Cc1ccc(cc1)O)C(F)(F)F 271570a_203496583355_200000689239 [0,1,0,0,0,0|2,0,1]=4 855 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1Br)Br 1458a_100000185857_200012351560 [0,1,0,0,0,0|3,0,0]=4 856 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1Br)Cl 1458a_100000185857_100000755608 [0,1,0,0,0,0|3,0,0]=4 857 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1Br)F 1458a_100000185857_100000243222 [0,1,0,0,0,0|3,0,0]=4 858 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1Br)I 1458a_100000185857_100010146610 [0,1,0,0,0,0|3,0,0]=4 859 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1C)Br 1458a_100000185857_100000708836 [0,1,0,0,0,0|3,0,0]=4 860 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1C)C 1458a_100000185857_100011219618 [0,1,0,0,0,0|3,0,0]=4 861 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1C)Cl 1458a_100000185857_100012361307 [0,1,0,0,0,0|3,0,0]=4 862 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1C)F 1458a_100000185857_100000700533 [0,1,0,0,0,0|3,0,0]=4 863 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1Cl)Br 1458a_100000185857_100011740631 [0,1,0,0,0,0|3,0,0]=4 864 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1Cl)C 1458a_100000185857_100012349684 [0,1,0,0,0,0|3,0,0]=4 865 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1Cl)Cl 1458a_100000185857_100000188473 [0,1,0,0,0,0|3,0,0]=4 866 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1Cl)F 1458a_100000185857_100011216360 [0,1,0,0,0,0|3,0,0]=4 867 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1F)Br 1458a_100000185857_100000211606 [0,1,0,0,0,0|3,0,0]=4 868 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1F)C 1458a_100000185857_100012002367 [0,1,0,0,0,0|3,0,0]=4 869 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1F)Cl 1458a_100000185857_100000709361 [0,1,0,0,0,0|3,0,0]=4 870 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1F)F 1458a_100000185857_100000748237 [0,1,0,0,0,0|3,0,0]=4 871 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1F)I 1458a_100000185857_100010244991 [0,1,0,0,0,0|3,0,0]=4 872 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1I)Br 1458a_100000185857_100010146615 [0,1,0,0,0,0|3,0,0]=4 873 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1I)Cl 1458a_100000185857_100010254388 [0,1,0,0,0,0|3,0,0]=4 874 B14R1.6049 C=C(C)C(=O)Cc1ccc(cc1I)F 1458a_100000185857_100012354799 [0,1,0,0,0,0|3,0,0]=4 875 B14R1.6049 C=C(C)C(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000185857 [0,1,0,0,0,0|3,0,0]=4 876 B14R1.6049 C=C(C)C(=O)Nc1ccc(cc1C)O 22a_100000756630_100000185857 [0,1,0,0,0,0|3,0,0]=4 877 B14R1.6049 C=C(C)C(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000185857 [0,1,0,0,0,0|3,0,0]=4 878 B14R1.6049 C=C(C)C(=O)Nc1ccc(cc1F)O 22a_100000759473_100000185857 [0,1,0,0,0,0|3,0,0]=4 879 B14R1.6049 C=C(C)C(=O)Nc1ccc(cc1I)O 22a_100010084370_100000185857 [0,1,0,0,0,0|3,0,0]=4 880 B14R1.6049 C=C(C)C(=O)Nc1ccc(cc1O)O 22a_100000106777_100000185857 [0,1,0,0,0,0|3,0,0]=4 881 B14R1.6049 C=C(Cl)C(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000039160 [0,1,0,0,0,0|3,0,0]=4 882 B14R1.6049 C=C(Cl)C(=O)Nc1ccc(cc1C)O 22a_100000756630_100000039160 [0,1,0,0,0,0|3,0,0]=4 883 B14R1.6049 C=C(Cl)C(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000039160 [0,1,0,0,0,0|3,0,0]=4 884 B14R1.6049 C=C(Cl)C(=O)Nc1ccc(cc1F)O 22a_100000759473_100000039160 [0,1,0,0,0,0|3,0,0]=4 885 B14R1.6049 C=C(Cl)C(=O)Nc1ccc(cc1I)O 22a_100010084370_100000039160 [0,1,0,0,0,0|3,0,0]=4 886 B14R1.6049 C=C(Cl)C(=O)Nc1ccc(cc1O)O 22a_100000106777_100000039160 [0,1,0,0,0,0|3,0,0]=4 887 B14R1.6049 C=C(F)C(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000036797 [0,1,0,0,0,0|3,0,0]=4 888 B14R1.6049 C=C(F)C(=O)Nc1ccc(cc1C)O 22a_100000756630_100000036797 [0,1,0,0,0,0|3,0,0]=4 889 B14R1.6049 C=C(F)C(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000036797 [0,1,0,0,0,0|3,0,0]=4 890 B14R1.6049 C=C(F)C(=O)Nc1ccc(cc1F)O 22a_100000759473_100000036797 [0,1,0,0,0,0|3,0,0]=4 891 B14R1.6049 C=C(F)C(=O)Nc1ccc(cc1I)O 22a_100010084370_100000036797 [0,1,0,0,0,0|3,0,0]=4 892 B14R1.6049 C=C(F)C(=O)Nc1ccc(cc1O)O 22a_100000106777_100000036797 [0,1,0,0,0,0|3,0,0]=4 893 B14R1.6049 CC(=O)C(=O)Nc1ccc(cc1C)C 1458a_200011297145_200000210301 [0,1,0,0,0,0|3,0,0]=4 894 B14R1.6049 CC(C)C(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100000210206 [0,1,0,0,0,0|2,0,1]=4 895 B14R1.6049 CC(C)C(=O)Cc1ccc(cc1F)O 1458a_100000090534_100000210206 [0,1,0,0,0,0|2,0,1]=4 896 B14R1.6049 CN(C)C(=O)Cc1ccc(cc1Br)O 240690a_100102631434_100010176083 [0,1,0,0,0,0|3,0,0]=4 897 B14R1.6049 CN(C)C(=O)Cc1ccc(cc1Br)O 527a_100102631434_100010176083 [0,1,0,0,0,0|3,0,0]=4 898 B14R1.6049 CN(C)C(=O)Cc1ccc(cc1F)O 240690a_100102631434_100000090534 [0,1,0,0,0,0|3,0,0]=4 899 B14R1.6049 CN(C)C(=O)Cc1ccc(cc1F)O 527a_100102631434_100000090534 [0,1,0,0,0,0|3,0,0]=4 900 B14R1.6049 C[C@@H](O)C(=O)Cc1ccc(cc1Br)Br 1458a_100000717761_200012351560 [0,1,0,0,0,0|2,0,1]=4 901 B14R1.6049 C[C@@H](O)C(=O)Cc1ccc(cc1Br)Cl 1458a_100000717761_100000755608 [0,1,0,0,0,0|2,0,1]=4 902 B14R1.6049 C[C@@H](O)C(=O)Cc1ccc(cc1Br)F 1458a_100000717761_100000243222 [0,1,0,0,0,0|2,0,1]=4 903 B14R1.6049 C[C@@H](O)C(=O)Cc1ccc(cc1Br)I 1458a_100000717761_100010146610 [0,1,0,0,0,0|2,0,1]=4 904 B14R1.6049 C[C@@H](O)C(=O)Cc1ccc(cc1Cl)Br 1458a_100000717761_100011740631 [0,1,0,0,0,0|2,0,1]=4 905 B14R1.6049 C[C@@H](O)C(=O)Cc1ccc(cc1Cl)Cl 1458a_100000717761_100000188473 [0,1,0,0,0,0|2,0,1]=4 906 B14R1.6049 C[C@@H](O)C(=O)Cc1ccc(cc1Cl)F 1458a_100000717761_100011216360 [0,1,0,0,0,0|2,0,1]=4 907 B14R1.6049 C[C@@H](O)C(=O)Cc1ccc(cc1F)Br 1458a_100000717761_100000211606 [0,1,0,0,0,0|2,0,1]=4 908 B14R1.6049 C[C@@H](O)C(=O)Cc1ccc(cc1F)Cl 1458a_100000717761_100000709361 [0,1,0,0,0,0|2,0,1]=4 909 B14R1.6049 C[C@@H](O)C(=O)Cc1ccc(cc1F)F 1458a_100000717761_100000748237 [0,1,0,0,0,0|2,0,1]=4 910 B14R1.6049 C[C@@H](O)C(=O)Cc1ccc(cc1F)I 1458a_100000717761_100010244991 [0,1,0,0,0,0|2,0,1]=4 911 B14R1.6049 C[C@@H](O)C(=O)Cc1ccc(cc1I)Br 1458a_100000717761_100010146615 [0,1,0,0,0,0|2,0,1]=4 912 B14R1.6049 C[C@@H](O)C(=O)Cc1ccc(cc1I)Cl 1458a_100000717761_100010254388 [0,1,0,0,0,0|2,0,1]=4 913 B14R1.6049 C[C@@H](O)C(=O)Cc1ccc(cc1I)F 1458a_100000717761_100012354799 [0,1,0,0,0,0|2,0,1]=4 914 B14R1.6049 C[C@@H](O)C(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000717761 [0,1,0,0,0,0|2,0,1]=4 915 B14R1.6049 C[C@@H](O)C(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000717761 [0,1,0,0,0,0|2,0,1]=4 916 B14R1.6049 C[C@@H](O)C(=O)Nc1ccc(cc1F)O 22a_100000759473_100000717761 [0,1,0,0,0,0|2,0,1]=4 917 B14R1.6049 C[C@@H](O)C(=O)Nc1ccc(cc1I)O 22a_100010084370_100000717761 [0,1,0,0,0,0|2,0,1]=4 918 B14R1.6049 C[C@@H](O)C(=O)Nc1ccc(cc1O)O 22a_100000106777_100000717761 [0,1,0,0,0,0|2,0,1]=4 919 B14R1.6049 C[C@H](O)C(=O)Cc1ccc(cc1Br)Br 1458a_217856618621_200012351560 [0,1,0,0,0,0|2,0,1]=4 920 B14R1.6049 C[C@H](O)C(=O)Cc1ccc(cc1Br)Cl 1458a_217856618621_100000755608 [0,1,0,0,0,0|2,0,1]=4 921 B14R1.6049 C[C@H](O)C(=O)Cc1ccc(cc1Br)F 1458a_217856618621_100000243222 [0,1,0,0,0,0|2,0,1]=4 922 B14R1.6049 C[C@H](O)C(=O)Cc1ccc(cc1Br)I 1458a_217856618621_100010146610 [0,1,0,0,0,0|2,0,1]=4 923 B14R1.6049 C[C@H](O)C(=O)Cc1ccc(cc1Cl)Br 1458a_217856618621_100011740631 [0,1,0,0,0,0|2,0,1]=4 924 B14R1.6049 C[C@H](O)C(=O)Cc1ccc(cc1Cl)Cl 1458a_217856618621_100000188473 [0,1,0,0,0,0|2,0,1]=4 925 B14R1.6049 C[C@H](O)C(=O)Cc1ccc(cc1Cl)F 1458a_217856618621_100011216360 [0,1,0,0,0,0|2,0,1]=4 926 B14R1.6049 C[C@H](O)C(=O)Cc1ccc(cc1F)Br 1458a_217856618621_100000211606 [0,1,0,0,0,0|2,0,1]=4 927 B14R1.6049 C[C@H](O)C(=O)Cc1ccc(cc1F)Cl 1458a_217856618621_100000709361 [0,1,0,0,0,0|2,0,1]=4 928 B14R1.6049 C[C@H](O)C(=O)Cc1ccc(cc1F)F 1458a_217856618621_100000748237 [0,1,0,0,0,0|2,0,1]=4 929 B14R1.6049 C[C@H](O)C(=O)Cc1ccc(cc1F)I 1458a_217856618621_100010244991 [0,1,0,0,0,0|2,0,1]=4 930 B14R1.6049 C[C@H](O)C(=O)Cc1ccc(cc1I)Br 1458a_217856618621_100010146615 [0,1,0,0,0,0|2,0,1]=4 931 B14R1.6049 C[C@H](O)C(=O)Cc1ccc(cc1I)Cl 1458a_217856618621_100010254388 [0,1,0,0,0,0|2,0,1]=4 932 B14R1.6049 C[C@H](O)C(=O)Cc1ccc(cc1I)F 1458a_217856618621_100012354799 [0,1,0,0,0,0|2,0,1]=4 933 B14R1.6049 C[C@H](O)C(=O)Nc1ccc(cc1Br)O 22a_100012001276_217856618621 [0,1,0,0,0,0|2,0,1]=4 934 B14R1.6049 C[C@H](O)C(=O)Nc1ccc(cc1Cl)O 22a_100011215599_217856618621 [0,1,0,0,0,0|2,0,1]=4 935 B14R1.6049 C[C@H](O)C(=O)Nc1ccc(cc1F)O 22a_100000759473_217856618621 [0,1,0,0,0,0|2,0,1]=4 936 B14R1.6049 C[C@H](O)C(=O)Nc1ccc(cc1I)O 22a_100010084370_217856618621 [0,1,0,0,0,0|2,0,1]=4 937 B14R1.6049 C[C@H](O)C(=O)Nc1ccc(cc1O)O 22a_100000106777_217856618621 [0,1,0,0,0,0|2,0,1]=4 938 B14R1.6049 Cc1cc(ccc1CC(=O)C(O)O)Br 1458a_100000233687_100000708836 [0,1,0,0,0,0|1,0,2]=4 939 B14R1.6049 Cc1cc(ccc1CC(=O)C(O)O)Cl 1458a_100000233687_100012361307 [0,1,0,0,0,0|1,0,2]=4 940 B14R1.6049 Cc1cc(ccc1CC(=O)C(O)O)F 1458a_100000233687_100000700533 [0,1,0,0,0,0|1,0,2]=4 941 B14R1.6049 Cc1cc(ccc1CC(=O)[C@@H](C)O)Br 1458a_100000717761_100000708836 [0,1,0,0,0,0|2,0,1]=4 942 B14R1.6049 Cc1cc(ccc1CC(=O)[C@@H](C)O)Cl 1458a_100000717761_100012361307 [0,1,0,0,0,0|2,0,1]=4 943 B14R1.6049 Cc1cc(ccc1CC(=O)[C@@H](C)O)F 1458a_100000717761_100000700533 [0,1,0,0,0,0|2,0,1]=4 944 B14R1.6049 Cc1cc(ccc1CC(=O)[C@H](C)O)Br 1458a_217856618621_100000708836 [0,1,0,0,0,0|2,0,1]=4 945 B14R1.6049 Cc1cc(ccc1CC(=O)[C@H](C)O)Cl 1458a_217856618621_100012361307 [0,1,0,0,0,0|2,0,1]=4 946 B14R1.6049 Cc1cc(ccc1CC(=O)[C@H](C)O)F 1458a_217856618621_100000700533 [0,1,0,0,0,0|2,0,1]=4 947 B14R1.6049 Cc1cc(ccc1NC(=O)C(=O)N)Br 22a_100000211769_100011215815 [0,1,0,0,0,0|3,0,0]=4 948 B14R1.6049 Cc1cc(ccc1NC(=O)C(=O)N)Cl 22a_100000210418_100011215815 [0,1,0,0,0,0|3,0,0]=4 949 B14R1.6049 Cc1cc(ccc1NC(=O)C(=O)N)F 22a_100000211637_100011215815 [0,1,0,0,0,0|3,0,0]=4 950 B14R1.6049 Cc1cc(ccc1NC(=O)C(=O)N)I 22a_100000184554_100011215815 [0,1,0,0,0,0|3,0,0]=4 951 B14R1.6049 Cc1cc(ccc1NC(=O)C(=O)N)O 22a_100000756630_100011215815 [0,1,0,0,0,0|2,0,0]=3 952 B14R1.6049 Cc1cc(ccc1NC(=O)C(O)O)O 22a_100000756630_100000233687 [0,1,0,0,0,0|1,0,2]=4 953 B14R1.6049 Cc1cc(ccc1NC(=O)[C@@H](C)O)O 22a_100000756630_100000717761 [0,1,0,0,0,0|2,0,1]=4 954 B14R1.6049 Cc1cc(ccc1NC(=O)[C@H](C)O)O 22a_100000756630_217856618621 [0,1,0,0,0,0|2,0,1]=4 955 B14R1.6049 Cc1ccc(c(c1)C)CC(=O)C(O)O 1458a_100000233687_100011219618 [0,1,0,0,0,0|1,0,2]=4 956 B14R1.6049 Cc1ccc(c(c1)C)CC(=O)[C@@H](C)O 1458a_100000717761_100011219618 [0,1,0,0,0,0|2,0,1]=4 957 B14R1.6049 Cc1ccc(c(c1)C)CC(=O)[C@H](C)O 1458a_217856618621_100011219618 [0,1,0,0,0,0|2,0,1]=4 958 B14R1.6049 Cc1ccc(c(c1)C)NC(=O)C(=O)N 22a_100000736561_100011215815 [0,1,0,0,0,0|3,0,0]=4 959 B14R1.6049 Cc1ccc(c(c1)C)NC(=O)C(=O)[13CH3] 1458a_200011297145_200025704644 [0,1,0,0,0,0|3,0,0]=4 960 B14R1.6049 Cc1ccc(c(c1)Cl)CC(=O)C(O)O 1458a_100000233687_100012349684 [0,1,0,0,0,0|1,0,2]=4 961 B14R1.6049 Cc1ccc(c(c1)Cl)CC(=O)[C@@H](C)O 1458a_100000717761_100012349684 [0,1,0,0,0,0|2,0,1]=4 962 B14R1.6049 Cc1ccc(c(c1)Cl)CC(=O)[C@H](C)O 1458a_217856618621_100012349684 [0,1,0,0,0,0|2,0,1]=4 963 B14R1.6049 Cc1ccc(c(c1)Cl)NC(=O)C(=O)N 22a_100000210522_100011215815 [0,1,0,0,0,0|3,0,0]=4 964 B14R1.6049 Cc1ccc(c(c1)F)CC(=O)C(O)O 1458a_100000233687_100012002367 [0,1,0,0,0,0|1,0,2]=4 965 B14R1.6049 Cc1ccc(c(c1)F)CC(=O)[C@@H](C)O 1458a_100000717761_100012002367 [0,1,0,0,0,0|2,0,1]=4 966 B14R1.6049 Cc1ccc(c(c1)F)CC(=O)[C@H](C)O 1458a_217856618621_100012002367 [0,1,0,0,0,0|2,0,1]=4 967 B14R1.6049 Cc1ccc(c(c1)F)NC(=O)C(=O)N 22a_100000211023_100011215815 [0,1,0,0,0,0|3,0,0]=4 968 B14R1.6049 Cc1ccc(c(c1)O)NC(=O)C(=O)N 22a_100000211527_100011215815 [0,1,0,0,0,0|3,0,0]=4 969 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1Br)O 22a_100012001276_100011215815 [0,1,0,0,0,0|2,0,0]=3 970 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100011215815 [0,1,0,0,0,0|3,0,0]=4 971 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1Cl)F 22a_100000212003_100011215815 [0,1,0,0,0,0|3,0,0]=4 972 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1Cl)I 22a_100011218065_100011215815 [0,1,0,0,0,0|3,0,0]=4 973 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100011215815 [0,1,0,0,0,0|2,0,0]=3 974 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1F)Br 22a_100000210722_100011215815 [0,1,0,0,0,0|3,0,0]=4 975 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1F)Cl 22a_100000211020_100011215815 [0,1,0,0,0,0|3,0,0]=4 976 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1F)F 22a_100000210720_100011215815 [0,1,0,0,0,0|3,0,0]=4 977 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1F)I 22a_100011215594_100011215815 [0,1,0,0,0,0|3,0,0]=4 978 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1F)O 22a_100000759473_100011215815 [0,1,0,0,0,0|2,0,0]=3 979 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1I)F 22a_100000760547_100011215815 [0,1,0,0,0,0|3,0,0]=4 980 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1I)O 22a_100010084370_100011215815 [0,1,0,0,0,0|2,0,0]=3 981 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1O)Br 22a_100000739049_100011215815 [0,1,0,0,0,0|3,0,0]=4 982 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100011215815 [0,1,0,0,0,0|3,0,0]=4 983 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1O)F 22a_100000753323_100011215815 [0,1,0,0,0,0|3,0,0]=4 984 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1O)I 22a_100000057187_100011215815 [0,1,0,0,0,0|3,0,0]=4 985 B14R1.6049 NC(=O)C(=O)Nc1ccc(cc1O)O 22a_100000106777_100011215815 [0,1,0,0,0,0|2,0,0]=3 986 B14R1.6049 O=C(Cc1ccc(cc1Br)Br)C(O)O 1458a_100000233687_200012351560 [0,1,0,0,0,0|1,0,2]=4 987 B14R1.6049 O=C(Cc1ccc(cc1Br)Cl)C(O)O 1458a_100000233687_100000755608 [0,1,0,0,0,0|1,0,2]=4 988 B14R1.6049 O=C(Cc1ccc(cc1Br)F)C(O)O 1458a_100000233687_100000243222 [0,1,0,0,0,0|1,0,2]=4 989 B14R1.6049 O=C(Cc1ccc(cc1Br)I)C(O)O 1458a_100000233687_100010146610 [0,1,0,0,0,0|1,0,2]=4 990 B14R1.6049 O=C(Cc1ccc(cc1Cl)Br)C(O)O 1458a_100000233687_100011740631 [0,1,0,0,0,0|1,0,2]=4 991 B14R1.6049 O=C(Cc1ccc(cc1Cl)Cl)C(O)O 1458a_100000233687_100000188473 [0,1,0,0,0,0|1,0,2]=4 992 B14R1.6049 O=C(Cc1ccc(cc1Cl)F)C(O)O 1458a_100000233687_100011216360 [0,1,0,0,0,0|1,0,2]=4 993 B14R1.6049 O=C(Cc1ccc(cc1F)Br)C(O)O 1458a_100000233687_100000211606 [0,1,0,0,0,0|1,0,2]=4 994 B14R1.6049 O=C(Cc1ccc(cc1F)Cl)C(O)O 1458a_100000233687_100000709361 [0,1,0,0,0,0|1,0,2]=4 995 B14R1.6049 O=C(Cc1ccc(cc1F)F)C(O)O 1458a_100000233687_100000748237 [0,1,0,0,0,0|1,0,2]=4 996 B14R1.6049 O=C(Cc1ccc(cc1F)I)C(O)O 1458a_100000233687_100010244991 [0,1,0,0,0,0|1,0,2]=4 997 B14R1.6049 O=C(Cc1ccc(cc1I)Br)C(O)O 1458a_100000233687_100010146615 [0,1,0,0,0,0|1,0,2]=4 998 B14R1.6049 O=C(Cc1ccc(cc1I)Cl)C(O)O 1458a_100000233687_100010254388 [0,1,0,0,0,0|1,0,2]=4 999 B14R1.6049 O=C(Cc1ccc(cc1I)F)C(O)O 1458a_100000233687_100012354799 [0,1,0,0,0,0|1,0,2]=4 1000 B14R1.6049 O=C(Nc1ccc(cc1Br)O)C(O)O 22a_100012001276_100000233687 [0,1,0,0,0,0|1,0,2]=4 1001 B14R1.6049 O=C(Nc1ccc(cc1Cl)O)C(O)O 22a_100011215599_100000233687 [0,1,0,0,0,0|1,0,2]=4 1002 B14R1.6049 O=C(Nc1ccc(cc1F)O)C(O)O 22a_100000759473_100000233687 [0,1,0,0,0,0|1,0,2]=4 1003 B14R1.6049 O=C(Nc1ccc(cc1I)O)C(O)O 22a_100010084370_100000233687 [0,1,0,0,0,0|1,0,2]=4 1004 B14R2.949 Cc1ccc(cc1)CC(=O)C2CO2 1458a_100000701028_100000210814 [0,0,0,1,0,0|2,0,1]=4 1005 B14R2.949 O=C(Cc1ccc(cc1)Br)C2CO2 1458a_100000701028_100000189115 [0,0,0,1,0,0|2,0,1]=4 1006 B14R2.949 O=C(Cc1ccc(cc1)Cl)C2CO2 1458a_100000701028_100000694040 [0,0,0,1,0,0|2,0,1]=4 1007 B14R2.949 O=C(Cc1ccc(cc1)F)C2CO2 1458a_100000701028_100000198546 [0,0,0,1,0,0|2,0,1]=4 1008 B14R2.949 O=C(Cc1ccc(cc1)I)C2CO2 1458a_100000701028_100000189116 [0,0,0,1,0,0|2,0,1]=4 1009 B14R2.949 O=C(Nc1ccc(cc1)O)C2CO2 22a_100000185829_100000701028 [0,0,0,1,0,0|2,0,1]=4 1010 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)O 240690a_100015195982_100015343762 [0,0,0,1,0,0|3,0,0]=4 1011 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)O 271570a_203496583355_200015237658 [0,0,0,1,0,0|3,0,0]=4 1012 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)O 527a_100015195982_100103153847 [0,0,0,1,0,0|3,0,0]=4 1013 B14R2.4529 CC(=O)c1cc2cc(ccc2o1)O 271570a_203496583355_100000181247 [0,0,0,1,0,0|3,0,0]=4 1014 B14R2.4529 CC(=O)c1nc2ccc(cc2[nH]1)O 271570a_203496583355_200011795181 [0,0,0,1,0,0|3,0,0]=4 1015 B14R2.4529 NC(=O)c1cc2cc(ccc2[nH]1)O 271570a_203496583355_100009814496 [0,0,0,1,0,0|3,0,0]=4 1016 B14R2.4529 NC(=O)c1cc2cc(ccc2o1)O 271570a_203496583355_100000185017 [0,0,0,1,0,0|3,0,0]=4 1017 B14R2.4529 NC(=O)c1cc2ccc(cc2[nH]1)O 271570a_203496583355_100009814495 [0,0,0,1,0,0|2,0,1]=4 1018 B14R2.8239 O=c1[nH]c2cc(cnc2[nH]c1=O)O 271570a_203496583355_100009812773 [0,0,0,1,0,0|3,0,0]=4 1019 B14R2.8239 O=c1[nH]c2ccc(cc2[nH]c1=O)O 271570a_203496583355_100011221361 [0,0,0,1,0,0|2,0,0]=3 1020 B14R2.8239 Oc1ccc2cc(c(cc2c1)O)O 271570a_203496583355_100010179872 [0,0,0,1,0,0|1,0,2]=4 1021 B12R1.20 CC(=C(C)c1ccc(cc1)O)C 271570a_200000049429_100000185759 [0,0,0,0,1,0|3,0,0]=4 1022 B12R1.20 CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_200000210301 [0,0,0,0,1,0|2,0,1]=4 1023 B12R1.20 CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200000210301 [0,0,0,0,1,0|1,0,2]=4 1024 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000070787 [0,0,0,0,1,0|3,0,0]=4 1025 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 271570a_203496583355_200009816415 [0,0,0,0,1,0|3,0,0]=4 1026 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 527a_100000182112_100103153847 [0,0,0,0,1,0|3,0,0]=4 1027 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)O 1458a_100000031422_200025704644 [0,0,0,0,1,0|2,0,1]=4 1028 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 1458a_100000212099_100000210206 [0,0,0,0,1,0|2,0,1]=4 1029 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100011220430 [0,0,0,0,1,0|2,0,1]=4 1030 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 240690a_100102631434_100000212099 [0,0,0,0,1,0|3,0,0]=4 1031 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100000159574 [0,0,0,0,1,0|3,0,0]=4 1032 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 527a_100102631434_100000212099 [0,0,0,0,1,0|3,0,0]=4 1033 B12R1.20 NC(=O)C(=O)c1ccc(cc1)O 271570a_203496583355_200009822167 [0,0,0,0,1,0|1,0,0]=2 1034 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200025704644 [0,0,0,0,1,0|1,0,2]=4 1035 B14R1.679 C=C(Br)C(=O)NCc1ccc(cc1)Br 11a_100000174875_100009813364 [0,0,0,0,0,1|3,0,0]=4 1036 B14R1.679 C=C(Br)C(=O)NCc1ccc(cc1)Br 1626a_100000174875_100009813364 [0,0,0,0,0,1|3,0,0]=4 1037 B14R1.679 C=C(Br)C(=O)NCc1ccc(cc1)C 11a_100000174908_100009813364 [0,0,0,0,0,1|3,0,0]=4 1038 B14R1.679 C=C(Br)C(=O)NCc1ccc(cc1)C 1626a_100000174908_100009813364 [0,0,0,0,0,1|3,0,0]=4 1039 B14R1.679 C=C(Br)C(=O)NCc1ccc(cc1)Cl 11a_100000174871_100009813364 [0,0,0,0,0,1|3,0,0]=4 1040 B14R1.679 C=C(Br)C(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100009813364 [0,0,0,0,0,1|3,0,0]=4 1041 B14R1.679 C=C(Br)C(=O)NCc1ccc(cc1)F 11a_100000174882_100009813364 [0,0,0,0,0,1|3,0,0]=4 1042 B14R1.679 C=C(Br)C(=O)NCc1ccc(cc1)F 1626a_100000174882_100009813364 [0,0,0,0,0,1|3,0,0]=4 1043 B14R1.679 C=C(Br)C(=O)NCc1ccc(cc1)I 11a_100016989417_100009813364 [0,0,0,0,0,1|3,0,0]=4 1044 B14R1.679 C=C(Br)C(=O)NCc1ccc(cc1)I 1626a_100016989417_100009813364 [0,0,0,0,0,1|3,0,0]=4 1045 B14R1.679 C=C(Br)C(=O)NCc1ccc(nc1)O 11a_100000757128_100009813364 [0,0,0,0,0,1|3,0,0]=4 1046 B14R1.679 C=C(C)C(=O)CCc1ccc(cc1)Br 1458a_100000185857_100011740612 [0,0,0,0,0,1|3,0,0]=4 1047 B14R1.679 C=C(C)C(=O)CCc1ccc(cc1)C 1458a_100000185857_100011713686 [0,0,0,0,0,1|3,0,0]=4 1048 B14R1.679 C=C(C)C(=O)CCc1ccc(cc1)Cl 1458a_100000185857_100011713675 [0,0,0,0,0,1|3,0,0]=4 1049 B14R1.679 C=C(C)C(=O)CCc1ccc(cc1)F 1458a_100000185857_100011217392 [0,0,0,0,0,1|3,0,0]=4 1050 B14R1.679 C=C(C)C(=O)CCc1ccc(cc1)O 1458a_100000185857_100009816426 [0,0,0,0,0,1|2,0,0]=3 1051 B14R1.679 C=C(C)C(=O)NCc1ccc(cc1)Br 11a_100000174875_100000185857 [0,0,0,0,0,1|3,0,0]=4 1052 B14R1.679 C=C(C)C(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000185857 [0,0,0,0,0,1|3,0,0]=4 1053 B14R1.679 C=C(C)C(=O)NCc1ccc(cc1)C 11a_100000174908_100000185857 [0,0,0,0,0,1|3,0,0]=4 1054 B14R1.679 C=C(C)C(=O)NCc1ccc(cc1)C 1626a_100000174908_100000185857 [0,0,0,0,0,1|3,0,0]=4 1055 B14R1.679 C=C(C)C(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000185857 [0,0,0,0,0,1|3,0,0]=4 1056 B14R1.679 C=C(C)C(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000185857 [0,0,0,0,0,1|3,0,0]=4 1057 B14R1.679 C=C(C)C(=O)NCc1ccc(cc1)F 11a_100000174882_100000185857 [0,0,0,0,0,1|3,0,0]=4 1058 B14R1.679 C=C(C)C(=O)NCc1ccc(cc1)F 1626a_100000174882_100000185857 [0,0,0,0,0,1|3,0,0]=4 1059 B14R1.679 C=C(C)C(=O)NCc1ccc(cc1)I 11a_100016989417_100000185857 [0,0,0,0,0,1|3,0,0]=4 1060 B14R1.679 C=C(C)C(=O)NCc1ccc(cc1)I 1626a_100016989417_100000185857 [0,0,0,0,0,1|3,0,0]=4 1061 B14R1.679 C=C(C)C(=O)NCc1ccc(nc1)O 11a_100000757128_100000185857 [0,0,0,0,0,1|3,0,0]=4 1062 B14R1.679 C=C(Cl)C(=O)NCc1ccc(cc1)Br 11a_100000174875_100000039160 [0,0,0,0,0,1|3,0,0]=4 1063 B14R1.679 C=C(Cl)C(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000039160 [0,0,0,0,0,1|3,0,0]=4 1064 B14R1.679 C=C(Cl)C(=O)NCc1ccc(cc1)C 11a_100000174908_100000039160 [0,0,0,0,0,1|3,0,0]=4 1065 B14R1.679 C=C(Cl)C(=O)NCc1ccc(cc1)C 1626a_100000174908_100000039160 [0,0,0,0,0,1|3,0,0]=4 1066 B14R1.679 C=C(Cl)C(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000039160 [0,0,0,0,0,1|3,0,0]=4 1067 B14R1.679 C=C(Cl)C(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000039160 [0,0,0,0,0,1|3,0,0]=4 1068 B14R1.679 C=C(Cl)C(=O)NCc1ccc(cc1)F 11a_100000174882_100000039160 [0,0,0,0,0,1|3,0,0]=4 1069 B14R1.679 C=C(Cl)C(=O)NCc1ccc(cc1)F 1626a_100000174882_100000039160 [0,0,0,0,0,1|3,0,0]=4 1070 B14R1.679 C=C(Cl)C(=O)NCc1ccc(cc1)I 11a_100016989417_100000039160 [0,0,0,0,0,1|3,0,0]=4 1071 B14R1.679 C=C(Cl)C(=O)NCc1ccc(cc1)I 1626a_100016989417_100000039160 [0,0,0,0,0,1|3,0,0]=4 1072 B14R1.679 C=C(Cl)C(=O)NCc1ccc(nc1)O 11a_100000757128_100000039160 [0,0,0,0,0,1|3,0,0]=4 1073 B14R1.679 C=C(F)C(=O)NCc1ccc(cc1)Br 11a_100000174875_100000036797 [0,0,0,0,0,1|3,0,0]=4 1074 B14R1.679 C=C(F)C(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000036797 [0,0,0,0,0,1|3,0,0]=4 1075 B14R1.679 C=C(F)C(=O)NCc1ccc(cc1)C 11a_100000174908_100000036797 [0,0,0,0,0,1|3,0,0]=4 1076 B14R1.679 C=C(F)C(=O)NCc1ccc(cc1)C 1626a_100000174908_100000036797 [0,0,0,0,0,1|3,0,0]=4 1077 B14R1.679 C=C(F)C(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000036797 [0,0,0,0,0,1|3,0,0]=4 1078 B14R1.679 C=C(F)C(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000036797 [0,0,0,0,0,1|3,0,0]=4 1079 B14R1.679 C=C(F)C(=O)NCc1ccc(cc1)F 11a_100000174882_100000036797 [0,0,0,0,0,1|3,0,0]=4 1080 B14R1.679 C=C(F)C(=O)NCc1ccc(cc1)F 1626a_100000174882_100000036797 [0,0,0,0,0,1|3,0,0]=4 1081 B14R1.679 C=C(F)C(=O)NCc1ccc(cc1)I 11a_100016989417_100000036797 [0,0,0,0,0,1|3,0,0]=4 1082 B14R1.679 C=C(F)C(=O)NCc1ccc(cc1)I 1626a_100016989417_100000036797 [0,0,0,0,0,1|3,0,0]=4 1083 B14R1.679 C=C(F)C(=O)NCc1ccc(nc1)O 11a_100000757128_100000036797 [0,0,0,0,0,1|3,0,0]=4 1084 B14R1.679 CC(=O)C(=O)CNc1ccc(cc1)Br 34a_100000210018_100011261029 [0,0,0,0,0,1|2,0,0]=3 1085 B14R1.679 CC(=O)C(=O)CNc1ccc(cc1)C 34a_100000124888_100011261029 [0,0,0,0,0,1|2,0,0]=3 1086 B14R1.679 CC(=O)C(=O)CNc1ccc(cc1)Cl 34a_100000210052_100011261029 [0,0,0,0,0,1|2,0,0]=3 1087 B14R1.679 CC(=O)C(=O)CNc1ccc(cc1)F 34a_100000185862_100011261029 [0,0,0,0,0,1|2,0,0]=3 1088 B14R1.679 CC(=O)C(=O)CNc1ccc(cc1)I 34a_100000185761_100011261029 [0,0,0,0,0,1|2,0,0]=3 1089 B14R1.679 CC(=O)C(=O)CNc1ccc(cc1)O 34a_100000185829_100011261029 [0,0,0,0,0,1|1,0,0]=2 1090 B14R1.679 CC(=O)C(=O)COc1ccc(=O)[nH]c1 34a_100000075641_100011261029 [0,0,0,0,0,1|2,0,1]=4 1091 B14R1.679 CC(=O)C(=O)COc1ccc(cc1)Br 34a_100000185759_100011261029 [0,0,0,0,0,1|2,0,0]=3 1092 B14R1.679 CC(=O)C(=O)COc1ccc(cc1)C 34a_100000210336_100011261029 [0,0,0,0,0,1|2,0,0]=3 1093 B14R1.679 CC(=O)C(=O)COc1ccc(cc1)Cl 34a_100000210216_100011261029 [0,0,0,0,0,1|2,0,0]=3 1094 B14R1.679 CC(=O)C(=O)COc1ccc(cc1)F 34a_100000210339_100011261029 [0,0,0,0,0,1|2,0,0]=3 1095 B14R1.679 CC(=O)C(=O)COc1ccc(cc1)I 34a_100000212066_100011261029 [0,0,0,0,0,1|2,0,0]=3 1096 B14R1.679 CC(=O)C(=O)COc1ccc(cc1)N 34a_100000185829_100011261029 [0,0,0,0,0,1|2,0,0]=3 1097 B14R1.679 CC(=O)C(=O)COc1ccc(cn1)C 34a_100000759353_100011261029 [0,0,0,0,0,1|3,0,0]=4 1098 B14R1.679 CC(=O)C(=O)COc1ccc(cn1)Cl 34a_100011215309_100011261029 [0,0,0,0,0,1|3,0,0]=4 1099 B14R1.679 CC(=O)C(=O)COc1ccc(cn1)F 34a_100000742473_100011261029 [0,0,0,0,0,1|3,0,0]=4 1100 B14R1.679 CC(=O)C(=O)COc1ccc(cn1)N 34a_100000729260_100011261029 [0,0,0,0,0,1|3,0,0]=4 1101 B14R1.679 CC(=O)C(=O)COc1ccc(nc1)Br 34a_100000685995_100011261029 [0,0,0,0,0,1|3,0,0]=4 1102 B14R1.679 CC(=O)C(=O)COc1ccc(nc1)C 34a_100000745506_100011261029 [0,0,0,0,0,1|3,0,0]=4 1103 B14R1.679 CC(=O)C(=O)COc1ccc(nc1)Cl 34a_100000744096_100011261029 [0,0,0,0,0,1|3,0,0]=4 1104 B14R1.679 CC(=O)C(=O)COc1ccc(nc1)F 34a_100000688820_100011261029 [0,0,0,0,0,1|3,0,0]=4 1105 B14R1.679 CC(=O)C(=O)COc1ccc(nc1)I 34a_100000687607_100011261029 [0,0,0,0,0,1|3,0,0]=4 1106 B14R1.679 CC(=O)C(=O)COc1ccc(nc1)N 34a_100015188713_100011261029 [0,0,0,0,0,1|3,0,0]=4 1107 B14R1.679 CC(=O)C(=O)CSc1cc[n+](cc1)[O-] 62a_100011261029_100000039755 [0,0,0,0,0,1|2,0,1]=4 1108 B14R1.679 CC(=O)C(=O)CSc1ccc(=O)[nH]c1 62a_100000212171_100011261029 [0,0,0,0,0,1|2,0,1]=4 1109 B14R1.679 CC(=O)C(=O)CSc1ccc(=O)[nH]c1 62a_100011261029_100000212171 [0,0,0,0,0,1|2,0,1]=4 1110 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)Br 62a_100000752885_100011261029 [0,0,0,0,0,1|2,0,0]=3 1111 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)Br 62a_100011261029_100000752885 [0,0,0,0,0,1|2,0,0]=3 1112 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)C 62a_100000186775_100011261029 [0,0,0,0,0,1|2,0,0]=3 1113 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)C 62a_100011261029_100000186775 [0,0,0,0,0,1|2,0,0]=3 1114 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)Cl 62a_100000755918_100011261029 [0,0,0,0,0,1|2,0,0]=3 1115 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)Cl 62a_100011261029_100000755918 [0,0,0,0,0,1|2,0,0]=3 1116 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)F 62a_100000211213_100011261029 [0,0,0,0,0,1|2,0,0]=3 1117 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)F 62a_100011261029_100000211213 [0,0,0,0,0,1|2,0,0]=3 1118 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)N 62a_100000185761_100011261029 [0,0,0,0,0,1|2,0,0]=3 1119 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)N 62a_100011261029_100000185761 [0,0,0,0,0,1|2,0,0]=3 1120 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)O 62a_100011261029_100000185759 [0,0,0,0,0,1|1,0,0]=2 1121 B14R1.679 CC(=O)C(=O)CSc1ccc(cn1)Br 62a_100000686858_100011261029 [0,0,0,0,0,1|3,0,0]=4 1122 B14R1.679 CC(=O)C(=O)CSc1ccc(cn1)Br 62a_100011261029_100000686858 [0,0,0,0,0,1|3,0,0]=4 1123 B14R1.679 CC(=O)C(=O)CSc1ccc(cn1)C 62a_100011192072_100011261029 [0,0,0,0,0,1|3,0,0]=4 1124 B14R1.679 CC(=O)C(=O)CSc1ccc(cn1)C 62a_100011261029_100000754016 [0,0,0,0,0,1|3,0,0]=4 1125 B14R1.679 CC(=O)C(=O)CSc1ccc(cn1)Cl 62a_100011261029_100011356976 [0,0,0,0,0,1|3,0,0]=4 1126 B14R1.679 CC(=O)C(=O)CSc1ccc(cn1)Cl 62a_100011356976_100011261029 [0,0,0,0,0,1|3,0,0]=4 1127 B14R1.679 CC(=O)C(=O)CSc1ccc(cn1)F 62a_100000744514_100011261029 [0,0,0,0,0,1|3,0,0]=4 1128 B14R1.679 CC(=O)C(=O)CSc1ccc(cn1)F 62a_100011261029_100000744514 [0,0,0,0,0,1|3,0,0]=4 1129 B14R1.679 CC(=O)C(=O)CSc1ccc(cn1)N 62a_100000737798_100011261029 [0,0,0,0,0,1|3,0,0]=4 1130 B14R1.679 CC(=O)C(=O)CSc1ccc(cn1)N 62a_100011261029_100000737798 [0,0,0,0,0,1|3,0,0]=4 1131 B14R1.679 CC(=O)C(=O)CSc1ccc(cn1)O 62a_100000685995_100011261029 [0,0,0,0,0,1|2,0,0]=3 1132 B14R1.679 CC(=O)C(=O)CSc1ccc(cn1)O 62a_100011261029_100000744096 [0,0,0,0,0,1|2,0,0]=3 1133 B14R1.679 CC(=O)C(=O)CSc1ccc(nc1)Br 62a_100009814638_100011261029 [0,0,0,0,0,1|3,0,0]=4 1134 B14R1.679 CC(=O)C(=O)CSc1ccc(nc1)Br 62a_100011261029_100009814638 [0,0,0,0,0,1|3,0,0]=4 1135 B14R1.679 CC(=O)C(=O)CSc1ccc(nc1)C 62a_100000751577_100011261029 [0,0,0,0,0,1|3,0,0]=4 1136 B14R1.679 CC(=O)C(=O)CSc1ccc(nc1)C 62a_100011261029_100000751577 [0,0,0,0,0,1|3,0,0]=4 1137 B14R1.679 CC(=O)C(=O)CSc1ccc(nc1)Cl 62a_100000034144_100011261029 [0,0,0,0,0,1|3,0,0]=4 1138 B14R1.679 CC(=O)C(=O)CSc1ccc(nc1)Cl 62a_100011261029_100000034144 [0,0,0,0,0,1|3,0,0]=4 1139 B14R1.679 CC(=O)C(=O)CSc1ccc(nc1)F 62a_100000042367_100011261029 [0,0,0,0,0,1|3,0,0]=4 1140 B14R1.679 CC(=O)C(=O)CSc1ccc(nc1)F 62a_100011261029_100000042367 [0,0,0,0,0,1|3,0,0]=4 1141 B14R1.679 CC(=O)C(=O)CSc1ccc(nc1)N 62a_100000187370_100011261029 [0,0,0,0,0,1|3,0,0]=4 1142 B14R1.679 CC(=O)C(=O)CSc1ccc(nc1)N 62a_100011261029_100000187370 [0,0,0,0,0,1|3,0,0]=4 1143 B14R1.679 CC(=O)C(=O)CSc1cnc(cn1)O 62a_100011261029_100015839800 [0,0,0,0,0,1|3,0,0]=4 1144 B14R1.679 CC(=O)C(=O)CSc1cnc(cn1)O 62a_100011934580_100011261029 [0,0,0,0,0,1|3,0,0]=4 1145 B14R1.679 CC(=O)C(=O)CSc1ncc(cn1)O 62a_100000730009_100011261029 [0,0,0,0,0,1|3,0,0]=4 1146 B14R1.679 CC(=O)C(=O)CSc1ncc(cn1)O 62a_100011261029_100000092845 [0,0,0,0,0,1|3,0,0]=4 1147 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)O 240690a_100016989440_100015343762 [0,0,0,0,0,1|3,0,0]=4 1148 B14R1.679 CC(C)C(=O)CCc1ccc(cc1)O 1458a_100000210198_100009816426 [0,0,0,0,0,1|2,0,1]=4 1149 B14R1.679 CC(C)C(=O)CCc1ccc(cc1)O 1458a_100000742835_100000210206 [0,0,0,0,0,1|2,0,1]=4 1150 B14R1.679 CC(C)C(=O)CNc1ccc(cc1)O 34a_100000185829_100000753385 [0,0,0,0,0,1|2,0,1]=4 1151 B14R1.679 CC(C)C(=O)COc1ccc(cc1)O 1458a_100000031633_100000210206 [0,0,0,0,0,1|2,0,1]=4 1152 B14R1.679 CC(C)C(=O)CSc1ccc(cc1)O 62a_100000753385_100000185759 [0,0,0,0,0,1|2,0,1]=4 1153 B14R1.679 CC(C)C(=O)NCc1ccc(cc1)O 240690a_100000185549_100000210198 [0,0,0,0,0,1|2,0,1]=4 1154 B14R1.679 CC(C)C(=O)NCc1ccc(cc1)O 527a_100000185549_100000210198 [0,0,0,0,0,1|2,0,1]=4 1155 B14R1.679 CC(F)C(=O)CCc1ccc(cc1)O 1458a_100000062450_100009816426 [0,0,0,0,0,1|2,0,1]=4 1156 B14R1.679 CC(F)C(=O)NCc1ccc(cc1)O 240690a_100000185549_100000062450 [0,0,0,0,0,1|2,0,1]=4 1157 B14R1.679 CC(F)C(=O)NCc1ccc(cc1)O 527a_100000185549_100000062450 [0,0,0,0,0,1|2,0,1]=4 1158 B14R1.679 CC(NCc1ccc(cc1)O)C(=O)N 34a_100000185549_100000702099 [0,0,0,0,0,1|2,0,1]=4 1159 B14R1.679 CN(C)C(=O)CCc1ccc(cc1)O 240690a_100102631434_100000742835 [0,0,0,0,0,1|3,0,0]=4 1160 B14R1.679 CN(C)C(=O)CCc1ccc(cc1)O 271570a_200010232142_100000185759 [0,0,0,0,0,1|3,0,0]=4 1161 B14R1.679 CN(C)C(=O)CNc1ccc(cc1)O 34a_100000185829_100000692301 [0,0,0,0,0,1|3,0,0]=4 1162 B14R1.679 CN(C)C(=O)COc1ccc(cc1)O 240690a_100102631434_100000031633 [0,0,0,0,0,1|3,0,0]=4 1163 B14R1.679 CN(C)C(=O)COc1ccc(cc1)O 527a_100102631434_100000031633 [0,0,0,0,0,1|3,0,0]=4 1164 B14R1.679 CN(C)C(=O)CSc1ccc(cc1)O 62a_100000692301_100000185759 [0,0,0,0,0,1|3,0,0]=4 1165 B14R1.679 CN(C)C(=O)NCc1ccc(cc1)O 2708a_100000185549_100102631434 [0,0,0,0,0,1|3,0,0]=4 1166 B14R1.679 C[C@@H](O)C(=O)CCc1ccc(cc1)Br 1458a_100000717761_100011740612 [0,0,0,0,0,1|2,0,1]=4 1167 B14R1.679 C[C@@H](O)C(=O)CCc1ccc(cc1)Cl 1458a_100000717761_100011713675 [0,0,0,0,0,1|2,0,1]=4 1168 B14R1.679 C[C@@H](O)C(=O)CCc1ccc(cc1)F 1458a_100000717761_100011217392 [0,0,0,0,0,1|2,0,1]=4 1169 B14R1.679 C[C@@H](O)C(=O)CCc1ccc(cc1)O 1458a_100000717761_100009816426 [0,0,0,0,0,1|1,0,1]=3 1170 B14R1.679 C[C@@H](O)C(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000717761 [0,0,0,0,0,1|2,0,1]=4 1171 B14R1.679 C[C@@H](O)C(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000717761 [0,0,0,0,0,1|2,0,1]=4 1172 B14R1.679 C[C@@H](O)C(=O)NCc1ccc(cc1)F 240690a_100000174882_100000717761 [0,0,0,0,0,1|2,0,1]=4 1173 B14R1.679 C[C@@H](O)C(=O)NCc1ccc(cc1)I 240690a_100016989417_100000717761 [0,0,0,0,0,1|2,0,1]=4 1174 B14R1.679 C[C@@H](O)C(=O)NCc1ccc(cc1)O 240690a_100000185549_100000717761 [0,0,0,0,0,1|1,0,1]=3 1175 B14R1.679 C[C@@H](O)C(=O)NCc1ccc(cn1)O 240690a_100020605196_100000717761 [0,0,0,0,0,1|2,0,1]=4 1176 B14R1.679 C[C@@H](O)C(=O)NCc1ccc(nc1)O 240690a_100000757128_100000717761 [0,0,0,0,0,1|2,0,1]=4 1177 B14R1.679 C[C@H](NCc1ccc(cc1)Br)C(=O)O 269956a_100000743915_100011217064 [0,0,0,0,0,1|2,0,1]=4 1178 B14R1.679 C[C@H](NCc1ccc(cc1)Cl)C(=O)O 269956a_100000743915_100000187161 [0,0,0,0,0,1|2,0,1]=4 1179 B14R1.679 C[C@H](NCc1ccc(cc1)F)C(=O)O 269956a_100000743915_100000198546 [0,0,0,0,0,1|2,0,1]=4 1180 B14R1.679 C[C@H](NCc1ccc(cc1)I)C(=O)O 269956a_100000743915_100000189116 [0,0,0,0,0,1|2,0,1]=4 1181 B14R1.679 C[C@H](O)C(=O)CCc1ccc(cc1)Br 1458a_217856618621_100011740612 [0,0,0,0,0,1|2,0,1]=4 1182 B14R1.679 C[C@H](O)C(=O)CCc1ccc(cc1)Cl 1458a_217856618621_100011713675 [0,0,0,0,0,1|2,0,1]=4 1183 B14R1.679 C[C@H](O)C(=O)CCc1ccc(cc1)F 1458a_217856618621_100011217392 [0,0,0,0,0,1|2,0,1]=4 1184 B14R1.679 C[C@H](O)C(=O)CCc1ccc(cc1)O 1458a_217856618621_100009816426 [0,0,0,0,0,1|1,0,1]=3 1185 B14R1.679 C[C@H](O)C(=O)NCc1ccc(cc1)Br 1626a_100000174875_217856618621 [0,0,0,0,0,1|2,0,1]=4 1186 B14R1.679 C[C@H](O)C(=O)NCc1ccc(cc1)Br 240690a_100000174875_217856618621 [0,0,0,0,0,1|2,0,1]=4 1187 B14R1.679 C[C@H](O)C(=O)NCc1ccc(cc1)Cl 1626a_100000174871_217856618621 [0,0,0,0,0,1|2,0,1]=4 1188 B14R1.679 C[C@H](O)C(=O)NCc1ccc(cc1)Cl 240690a_100000174871_217856618621 [0,0,0,0,0,1|2,0,1]=4 1189 B14R1.679 C[C@H](O)C(=O)NCc1ccc(cc1)F 1626a_100000174882_217856618621 [0,0,0,0,0,1|2,0,1]=4 1190 B14R1.679 C[C@H](O)C(=O)NCc1ccc(cc1)F 240690a_100000174882_217856618621 [0,0,0,0,0,1|2,0,1]=4 1191 B14R1.679 C[C@H](O)C(=O)NCc1ccc(cc1)I 1626a_100016989417_217856618621 [0,0,0,0,0,1|2,0,1]=4 1192 B14R1.679 C[C@H](O)C(=O)NCc1ccc(cc1)I 240690a_100016989417_217856618621 [0,0,0,0,0,1|2,0,1]=4 1193 B14R1.679 C[C@H](O)C(=O)NCc1ccc(cc1)O 240690a_100000185549_217856618621 [0,0,0,0,0,1|1,0,1]=3 1194 B14R1.679 C[C@H](O)C(=O)NCc1ccc(cn1)O 240690a_100020605196_217856618621 [0,0,0,0,0,1|2,0,1]=4 1195 B14R1.679 C[C@H](O)C(=O)NCc1ccc(nc1)O 240690a_100000757128_217856618621 [0,0,0,0,0,1|2,0,1]=4 1196 B14R1.679 Cc1ccc(cc1)CCC(=O)C(O)O 1458a_100000233687_100011713686 [0,0,0,0,0,1|1,0,2]=4 1197 B14R1.679 Cc1ccc(cc1)CCC(=O)[C@@H](C)O 1458a_100000717761_100011713686 [0,0,0,0,0,1|2,0,1]=4 1198 B14R1.679 Cc1ccc(cc1)CCC(=O)[C@H](C)O 1458a_217856618621_100011713686 [0,0,0,0,0,1|2,0,1]=4 1199 B14R1.679 Cc1ccc(cc1)CNC(=O)C(=O)N 240690a_100000174908_100011215815 [0,0,0,0,0,1|2,0,0]=3 1200 B14R1.679 Cc1ccc(cc1)CNC(=O)C(O)O 240690a_100000174908_100000233687 [0,0,0,0,0,1|1,0,2]=4 1201 B14R1.679 Cc1ccc(cc1)CNC(=O)[C@@H](C)O 240690a_100000174908_100000717761 [0,0,0,0,0,1|2,0,1]=4 1202 B14R1.679 Cc1ccc(cc1)CNC(=O)[C@H](C)O 1626a_100000174908_217856618621 [0,0,0,0,0,1|2,0,1]=4 1203 B14R1.679 Cc1ccc(cc1)CNC(=O)[C@H](C)O 240690a_100000174908_217856618621 [0,0,0,0,0,1|2,0,1]=4 1204 B14R1.679 Cc1ccc(cc1)CN[C@@H](C)C(=O)O 269956a_100000743915_100000210814 [0,0,0,0,0,1|2,0,1]=4 1205 B14R1.679 Cc1ccc(cc1)NNC(=O)C(=O)N 22a_100000683527_100011215815 [0,0,0,0,0,1|3,0,0]=4 1206 B14R1.679 Cc1ccc(cn1)CNC(=O)C(=O)N 240690a_100000740942_100011215815 [0,0,0,0,0,1|3,0,0]=4 1207 B14R1.679 Cc1ccc(nc1)CNC(=O)C(=O)N 240690a_100015187455_100011215815 [0,0,0,0,0,1|3,0,0]=4 1208 B14R1.679 NC(=O)C(=O)NCc1ccc(cc1)Br 240690a_100000174875_100011215815 [0,0,0,0,0,1|2,0,0]=3 1209 B14R1.679 NC(=O)C(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100011215815 [0,0,0,0,0,1|2,0,0]=3 1210 B14R1.679 NC(=O)C(=O)NCc1ccc(cc1)F 240690a_100000174882_100011215815 [0,0,0,0,0,1|2,0,0]=3 1211 B14R1.679 NC(=O)C(=O)NCc1ccc(cc1)I 240690a_100016989417_100011215815 [0,0,0,0,0,1|2,0,0]=3 1212 B14R1.679 NC(=O)C(=O)NCc1ccc(cc1)O 240690a_100000185549_100011215815 [0,0,0,0,0,1|1,0,0]=2 1213 B14R1.679 NC(=O)C(=O)NCc1ccc(cn1)Br 240690a_100015188789_100011215815 [0,0,0,0,0,1|3,0,0]=4 1214 B14R1.679 NC(=O)C(=O)NCc1ccc(cn1)Cl 240690a_100000697193_100011215815 [0,0,0,0,0,1|3,0,0]=4 1215 B14R1.679 NC(=O)C(=O)NCc1ccc(cn1)F 240690a_100020620131_100011215815 [0,0,0,0,0,1|3,0,0]=4 1216 B14R1.679 NC(=O)C(=O)NCc1ccc(cn1)O 240690a_100020605196_100011215815 [0,0,0,0,0,1|2,0,0]=3 1217 B14R1.679 NC(=O)C(=O)NCc1ccc(nc1)Br 240690a_100009817727_100011215815 [0,0,0,0,0,1|3,0,0]=4 1218 B14R1.679 NC(=O)C(=O)NCc1ccc(nc1)Cl 240690a_100000735879_100011215815 [0,0,0,0,0,1|3,0,0]=4 1219 B14R1.679 NC(=O)C(=O)NCc1ccc(nc1)F 240690a_100000101913_100011215815 [0,0,0,0,0,1|3,0,0]=4 1220 B14R1.679 NC(=O)C(=O)NCc1ccc(nc1)O 240690a_100000757128_100011215815 [0,0,0,0,0,1|2,0,0]=3 1221 B14R1.679 NC(=O)C(=O)NNc1ccc(cc1)Br 22a_100000735608_100011215815 [0,0,0,0,0,1|3,0,0]=4 1222 B14R1.679 NC(=O)C(=O)NNc1ccc(cc1)Cl 22a_100000683521_100011215815 [0,0,0,0,0,1|3,0,0]=4 1223 B14R1.679 NC(=O)C(=O)NNc1ccc(cc1)F 22a_100000728448_100011215815 [0,0,0,0,0,1|3,0,0]=4 1224 B14R1.679 NC(=O)C(=O)NNc1ccc(cc1)I 22a_100016988836_100011215815 [0,0,0,0,0,1|3,0,0]=4 1225 B14R1.679 NC(=O)C(F)NCc1ccc(cc1)O 34a_100000185549_100009813875 [0,0,0,0,0,1|2,0,1]=4 1226 B14R1.679 O=C(CCc1ccc(cc1)Br)C(O)O 1458a_100000233687_100011740612 [0,0,0,0,0,1|1,0,2]=4 1227 B14R1.679 O=C(CCc1ccc(cc1)Cl)C(O)O 1458a_100000233687_100011713675 [0,0,0,0,0,1|1,0,2]=4 1228 B14R1.679 O=C(CCc1ccc(cc1)F)C(O)O 1458a_100000233687_100011217392 [0,0,0,0,0,1|1,0,2]=4 1229 B14R1.679 O=C(CCc1ccc(cc1)O)C(O)O 1458a_100000233687_100009816426 [0,0,0,0,0,1|0,0,2]=3 1230 B14R1.679 O=C(NCc1ccc(cc1)Br)C(O)O 240690a_100000174875_100000233687 [0,0,0,0,0,1|1,0,2]=4 1231 B14R1.679 O=C(NCc1ccc(cc1)Cl)C(O)O 240690a_100000174871_100000233687 [0,0,0,0,0,1|1,0,2]=4 1232 B14R1.679 O=C(NCc1ccc(cc1)F)C(O)O 240690a_100000174882_100000233687 [0,0,0,0,0,1|1,0,2]=4 1233 B14R1.679 O=C(NCc1ccc(cc1)I)C(O)O 240690a_100016989417_100000233687 [0,0,0,0,0,1|1,0,2]=4 1234 B14R1.679 O=C(NCc1ccc(cc1)O)C(F)F 240690a_100000185549_100000210393 [0,0,0,0,0,1|2,0,1]=4 1235 B14R1.679 O=C(NCc1ccc(cc1)O)C(F)F 527a_100000185549_100000210393 [0,0,0,0,0,1|2,0,1]=4 1236 B14R1.679 O=C(NCc1ccc(cc1)O)C(O)O 240690a_100000185549_100000233687 [0,0,0,0,0,1|0,0,2]=3 1237 B14R1.679 O=C(NCc1ccc(cn1)O)C(O)O 240690a_100020605196_100000233687 [0,0,0,0,0,1|1,0,2]=4 1238 B14R1.679 O=C(NCc1ccc(nc1)O)C(O)O 240690a_100000757128_100000233687 [0,0,0,0,0,1|1,0,2]=4 1239 B14R1.679 O=C([O-])C(F)NCc1ccc(cc1)O 34a_100000185549_100020610796 [0,0,0,0,0,1|1,0,2]=4 1240 B14R1.698 C=C(C)CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000748629 [0,0,0,0,0,1|3,0,0]=4 1241 B14R1.698 C=C(C)CC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000748629 [0,0,0,0,0,1|3,0,0]=4 1242 B14R1.698 C=C(C)CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000748629 [0,0,0,0,0,1|3,0,0]=4 1243 B14R1.698 C=C(C)CC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000748629 [0,0,0,0,0,1|3,0,0]=4 1244 B14R1.698 C=C(C)CC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000748629 [0,0,0,0,0,1|3,0,0]=4 1245 B14R1.698 C=C(C)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000748629 [0,0,0,0,0,1|2,0,0]=3 1246 B14R1.698 C=C(F)CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100009893438 [0,0,0,0,0,1|3,0,0]=4 1247 B14R1.698 C=C(F)CC(=O)Cc1ccc(cc1)C 1458a_100000212244_100009893438 [0,0,0,0,0,1|3,0,0]=4 1248 B14R1.698 C=C(F)CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100009893438 [0,0,0,0,0,1|3,0,0]=4 1249 B14R1.698 C=C(F)CC(=O)Cc1ccc(cc1)F 1458a_100000210951_100009893438 [0,0,0,0,0,1|3,0,0]=4 1250 B14R1.698 C=C(F)CC(=O)Cc1ccc(cc1)I 1458a_100000688869_100009893438 [0,0,0,0,0,1|3,0,0]=4 1251 B14R1.698 C=C(F)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100009893438 [0,0,0,0,0,1|2,0,0]=3 1252 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)Br)C 1458a_100000211388_100000189115 [0,0,0,0,0,1|3,0,0]=4 1253 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)Br)Cl 1458a_200042562850_100000189115 [0,0,0,0,0,1|3,0,0]=4 1254 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)Br)I 1458a_100025716642_100000189115 [0,0,0,0,0,1|3,0,0]=4 1255 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)C)C 1458a_100000211388_100000210814 [0,0,0,0,0,1|3,0,0]=4 1256 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)C)Cl 1458a_200042562850_100000210814 [0,0,0,0,0,1|3,0,0]=4 1257 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)C)I 1458a_100025716642_100000210814 [0,0,0,0,0,1|3,0,0]=4 1258 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)Cl)C 1458a_100000211388_100000694040 [0,0,0,0,0,1|3,0,0]=4 1259 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)Cl)Cl 1458a_200042562850_100000694040 [0,0,0,0,0,1|3,0,0]=4 1260 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)Cl)I 1458a_100025716642_100000694040 [0,0,0,0,0,1|3,0,0]=4 1261 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)F)C 1458a_100000211388_100000198546 [0,0,0,0,0,1|3,0,0]=4 1262 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)F)Cl 1458a_200042562850_100000198546 [0,0,0,0,0,1|3,0,0]=4 1263 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)F)I 1458a_100025716642_100000198546 [0,0,0,0,0,1|3,0,0]=4 1264 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)I)C 1458a_100000211388_100000189116 [0,0,0,0,0,1|3,0,0]=4 1265 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)I)Cl 1458a_200042562850_100000189116 [0,0,0,0,0,1|3,0,0]=4 1266 B14R1.698 CC(=CC(=O)Cc1ccc(cc1)I)I 1458a_100025716642_100000189116 [0,0,0,0,0,1|3,0,0]=4 1267 B14R1.698 CC(=CC(=O)Nc1ccc(cc1)O)C 22a_100000185829_100000211388 [0,0,0,0,0,1|3,0,0]=4 1268 B14R1.698 CC(=CC(=O)Nc1ccc(cc1)O)Cl 22a_100000185829_200042562850 [0,0,0,0,0,1|3,0,0]=4 1269 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)Br 1458a_100000070787_100000183692 [0,0,0,0,0,1|3,0,0]=4 1270 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)Br 1458a_100011623802_200000210301 [0,0,0,0,0,1|3,0,0]=4 1271 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)C 1458a_100000070787_100000182914 [0,0,0,0,0,1|3,0,0]=4 1272 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)Cl 1458a_100000070787_100000182960 [0,0,0,0,0,1|3,0,0]=4 1273 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)F 1458a_100000070787_100000181725 [0,0,0,0,0,1|3,0,0]=4 1274 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)F 1458a_200000189458_200000210301 [0,0,0,0,0,1|3,0,0]=4 1275 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)I 1458a_100000070787_100000183000 [0,0,0,0,0,1|3,0,0]=4 1276 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)O 1458a_100000070787_100000233757 [0,0,0,0,0,1|2,0,0]=3 1277 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000182854 [0,0,0,0,0,1|2,0,0]=3 1278 B14R1.698 CC(=O)CC(=O)Oc1ccc(cc1)Br 1458a_100000070787_200010760497 [0,0,0,0,0,1|3,0,0]=4 1279 B14R1.698 CC(=O)NC(C)Cc1ccc(cc1)O 240690a_100102634573_100015343762 [0,0,0,0,0,1|2,0,1]=4 1280 B14R1.698 CC(=O)NC(C)Cc1ccc(cc1)O 527a_100102634573_100103153847 [0,0,0,0,0,1|2,0,1]=4 1281 B14R1.698 CC(C)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210624 [0,0,0,0,0,1|2,0,1]=4 1282 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)O 1626a_100138425928_100000198540 [0,0,0,0,0,1|2,0,1]=4 1283 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)O 240690a_100138425928_100000198540 [0,0,0,0,0,1|2,0,1]=4 1284 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)O 527a_100138425928_100000198540 [0,0,0,0,0,1|2,0,1]=4 1285 B14R1.698 CC(O)CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100011218427 [0,0,0,0,0,1|2,0,1]=4 1286 B14R1.698 CC(O)CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100011218427 [0,0,0,0,0,1|2,0,1]=4 1287 B14R1.698 CC(O)CC(=O)Cc1ccc(cc1)F 1458a_100000210951_100011218427 [0,0,0,0,0,1|2,0,1]=4 1288 B14R1.698 CC(O)CC(=O)Cc1ccc(cc1)I 1458a_100000688869_100011218427 [0,0,0,0,0,1|2,0,1]=4 1289 B14R1.698 CC(O)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100011218427 [0,0,0,0,0,1|1,0,1]=3 1290 B14R1.698 CN(CC(=O)N)Cc1ccc(cc1)O 2230a_100000207500_100000747473 [0,0,0,0,0,1|3,0,0]=4 1291 B14R1.698 CN(CC(=O)N)Cc1ccc(cc1)O 269982a_100000207500_100000187820 [0,0,0,0,0,1|3,0,0]=4 1292 B14R1.698 CN(CC(=O)O)Cc1ccc(cc1)Br 269956a_100000746989_100011217064 [0,0,0,0,0,1|3,0,0]=4 1293 B14R1.698 CN(CC(=O)O)Cc1ccc(cc1)Cl 269956a_100000746989_100000187161 [0,0,0,0,0,1|3,0,0]=4 1294 B14R1.698 CN(CC(=O)O)Cc1ccc(cc1)Cl 269956a_100000756320_200000210301 [0,0,0,0,0,1|3,0,0]=4 1295 B14R1.698 CN(CC(=O)O)Cc1ccc(cc1)F 269956a_100000746989_100000198546 [0,0,0,0,0,1|3,0,0]=4 1296 B14R1.698 CN(CC(=O)O)Cc1ccc(cc1)I 269956a_100000746989_100000189116 [0,0,0,0,0,1|3,0,0]=4 1297 B14R1.698 CN(CC(=O)[O-])Cc1ccc(cc1)O 269982a_100000207500_100020667443 [0,0,0,0,0,1|2,0,1]=4 1298 B14R1.698 C[C@@H](O)CC(=O)Cc1ccc(cc1)Br 1458a_100011933948_100000189115 [0,0,0,0,0,1|2,0,1]=4 1299 B14R1.698 C[C@@H](O)CC(=O)Cc1ccc(cc1)Cl 1458a_100011933948_100000694040 [0,0,0,0,0,1|2,0,1]=4 1300 B14R1.698 C[C@@H](O)CC(=O)Cc1ccc(cc1)F 1458a_100011933948_100000198546 [0,0,0,0,0,1|2,0,1]=4 1301 B14R1.698 C[C@@H](O)CC(=O)Cc1ccc(cc1)I 1458a_100011933948_100000189116 [0,0,0,0,0,1|2,0,1]=4 1302 B14R1.698 C[C@@H](O)CC(=O)Nc1ccc(cc1)O 22a_100000185829_100011933948 [0,0,0,0,0,1|2,0,1]=4 1303 B14R1.698 Cc1ccc(cc1)CC(=O)C=C(Cl)Cl 1458a_100000137448_100000210814 [0,0,0,0,0,1|3,0,0]=4 1304 B14R1.698 Cc1ccc(cc1)CC(=O)CC(=O)N 1458a_100000212244_100000187820 [0,0,0,0,0,1|2,0,0]=3 1305 B14R1.698 Cc1ccc(cc1)CC(=O)CC(=O)N 1458a_100134613110_100000210814 [0,0,0,0,0,1|2,0,0]=3 1306 B14R1.698 Cc1ccc(cc1)CC(=O)CC(=O)[O-] 1458a_100000212244_100020667443 [0,0,0,0,0,1|1,0,1]=3 1307 B14R1.698 Cc1ccc(cc1)CC(=O)CC(C)O 1458a_100000212244_100011218427 [0,0,0,0,0,1|2,0,1]=4 1308 B14R1.698 Cc1ccc(cc1)CC(=O)C[C@@H](C)O 1458a_100011933948_100000210814 [0,0,0,0,0,1|2,0,1]=4 1309 B14R1.698 Cc1ccc(cc1)CC(=O)C[N+](=O)[O-] 1458a_100000212244_100000761209 [0,0,0,0,0,1|2,0,1]=4 1310 B14R1.698 Cc1ccc(cc1)CN(C)CC(=O)O 269956a_100000746989_100000210814 [0,0,0,0,0,1|3,0,0]=4 1311 B14R1.698 Cc1ccc(cc1)NC(=O)CC(=O)N 22a_100000124888_100134613110 [0,0,0,0,0,1|3,0,0]=4 1312 B14R1.698 Cc1ccc(cc1)NC(=O)CC(=O)N 527a_100000124888_100134613110 [0,0,0,0,0,1|3,0,0]=4 1313 B14R1.698 Cc1ccc(cn1)CC(=O)CC(=O)N 1458a_100000740413_100000187820 [0,0,0,0,0,1|3,0,0]=4 1314 B14R1.698 Cc1ccc(cn1)CC(=O)CC(=O)N 1458a_100134613110_100016987292 [0,0,0,0,0,1|3,0,0]=4 1315 B14R1.698 Cc1ccc(cn1)CC(=O)CC(=O)[O-] 1458a_100000740413_100020667443 [0,0,0,0,0,1|2,0,1]=4 1316 B14R1.698 Cc1ccc(nc1)CC(=O)CC(=O)N 1458a_100025705728_100000187820 [0,0,0,0,0,1|3,0,0]=4 1317 B14R1.698 Cc1ccc(nc1)CC(=O)CC(=O)N 1458a_100134613110_100000691093 [0,0,0,0,0,1|3,0,0]=4 1318 B14R1.698 Cc1ccc(nc1)CC(=O)CC(=O)[O-] 1458a_100025705728_100020667443 [0,0,0,0,0,1|2,0,1]=4 1319 B14R1.698 NC(=O)CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000187820 [0,0,0,0,0,1|2,0,0]=3 1320 B14R1.698 NC(=O)CC(=O)Cc1ccc(cc1)Br 1458a_100134613110_100000189115 [0,0,0,0,0,1|2,0,0]=3 1321 B14R1.698 NC(=O)CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000187820 [0,0,0,0,0,1|2,0,0]=3 1322 B14R1.698 NC(=O)CC(=O)Cc1ccc(cc1)Cl 1458a_100134613110_100000694040 [0,0,0,0,0,1|2,0,0]=3 1323 B14R1.698 NC(=O)CC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000187820 [0,0,0,0,0,1|2,0,0]=3 1324 B14R1.698 NC(=O)CC(=O)Cc1ccc(cc1)F 1458a_100134613110_100000198546 [0,0,0,0,0,1|2,0,0]=3 1325 B14R1.698 NC(=O)CC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000187820 [0,0,0,0,0,1|2,0,0]=3 1326 B14R1.698 NC(=O)CC(=O)Cc1ccc(cc1)I 1458a_100134613110_100000189116 [0,0,0,0,0,1|2,0,0]=3 1327 B14R1.698 NC(=O)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000187820 [0,0,0,0,0,1|1,0,0]=2 1328 B14R1.698 NC(=O)CC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000187820 [0,0,0,0,0,1|3,0,0]=4 1329 B14R1.698 NC(=O)CC(=O)Cc1ccc(cn1)Br 1458a_100134613110_100000702658 [0,0,0,0,0,1|3,0,0]=4 1330 B14R1.698 NC(=O)CC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000187820 [0,0,0,0,0,1|3,0,0]=4 1331 B14R1.698 NC(=O)CC(=O)Cc1ccc(cn1)Cl 1458a_100134613110_100012066911 [0,0,0,0,0,1|3,0,0]=4 1332 B14R1.698 NC(=O)CC(=O)Cc1ccc(cn1)F 1458a_100134613110_100000703193 [0,0,0,0,0,1|3,0,0]=4 1333 B14R1.698 NC(=O)CC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000187820 [0,0,0,0,0,1|3,0,0]=4 1334 B14R1.698 NC(=O)CC(=O)Cc1ccc(nc1)Br 1458a_100134613110_100009831999 [0,0,0,0,0,1|3,0,0]=4 1335 B14R1.698 NC(=O)CC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000187820 [0,0,0,0,0,1|3,0,0]=4 1336 B14R1.698 NC(=O)CC(=O)Cc1ccc(nc1)Cl 1458a_100134613110_100000735431 [0,0,0,0,0,1|3,0,0]=4 1337 B14R1.698 NC(=O)CC(=O)Cc1ccc(nc1)F 1458a_100134613110_100009820150 [0,0,0,0,0,1|3,0,0]=4 1338 B14R1.698 NC(=O)CC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000187820 [0,0,0,0,0,1|2,0,1]=4 1339 B14R1.698 NC(=O)CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100134613110 [0,0,0,0,0,1|3,0,0]=4 1340 B14R1.698 NC(=O)CC(=O)Nc1ccc(cc1)Br 527a_100000210018_100134613110 [0,0,0,0,0,1|3,0,0]=4 1341 B14R1.698 NC(=O)CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100134613110 [0,0,0,0,0,1|3,0,0]=4 1342 B14R1.698 NC(=O)CC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100134613110 [0,0,0,0,0,1|3,0,0]=4 1343 B14R1.698 NC(=O)CC(=O)Nc1ccc(cc1)F 22a_100000185862_100134613110 [0,0,0,0,0,1|3,0,0]=4 1344 B14R1.698 NC(=O)CC(=O)Nc1ccc(cc1)F 527a_100000185862_100134613110 [0,0,0,0,0,1|3,0,0]=4 1345 B14R1.698 NC(=O)CC(=O)Nc1ccc(cc1)I 22a_100000185761_100134613110 [0,0,0,0,0,1|3,0,0]=4 1346 B14R1.698 NC(=O)CC(=O)Nc1ccc(cc1)I 527a_100000185761_100134613110 [0,0,0,0,0,1|3,0,0]=4 1347 B14R1.698 NC(=O)CC(=O)Nc1ccc(cc1)O 22a_100000185829_100134613110 [0,0,0,0,0,1|2,0,0]=3 1348 B14R1.698 O=C(C=C(Cl)Cl)Cc1ccc(cc1)Br 1458a_100000137448_100000189115 [0,0,0,0,0,1|3,0,0]=4 1349 B14R1.698 O=C(C=C(Cl)Cl)Cc1ccc(cc1)Cl 1458a_100000137448_100000694040 [0,0,0,0,0,1|3,0,0]=4 1350 B14R1.698 O=C(C=C(Cl)Cl)Cc1ccc(cc1)F 1458a_100000137448_100000198546 [0,0,0,0,0,1|3,0,0]=4 1351 B14R1.698 O=C(C=C(Cl)Cl)Cc1ccc(cc1)I 1458a_100000137448_100000189116 [0,0,0,0,0,1|3,0,0]=4 1352 B14R1.698 O=C(Cc1ccc(cc1)Br)C[N+](=O)[O-] 1458a_100000198978_100000761209 [0,0,0,0,0,1|2,0,1]=4 1353 B14R1.698 O=C(Cc1ccc(cc1)Cl)C[N+](=O)[O-] 1458a_100000211027_100000761209 [0,0,0,0,0,1|2,0,1]=4 1354 B14R1.698 O=C(Cc1ccc(cc1)F)C[N+](=O)[O-] 1458a_100000210951_100000761209 [0,0,0,0,0,1|2,0,1]=4 1355 B14R1.698 O=C(Cc1ccc(cc1)I)C[N+](=O)[O-] 1458a_100000688869_100000761209 [0,0,0,0,0,1|2,0,1]=4 1356 B14R1.698 O=C(Cc1ccc(cc1)O)CC(F)F 1458a_100000198540_100011934356 [0,0,0,0,0,1|2,0,1]=4 1357 B14R1.698 O=C(Cc1ccc(cc1)O)C[N+](=O)[O-] 1458a_100000198540_100000761209 [0,0,0,0,0,1|1,0,1]=3 1358 B14R1.698 O=C([O-])CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100020667443 [0,0,0,0,0,1|1,0,1]=3 1359 B14R1.698 O=C([O-])CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100020667443 [0,0,0,0,0,1|1,0,1]=3 1360 B14R1.698 O=C([O-])CC(=O)Cc1ccc(cc1)F 1458a_100000210951_100020667443 [0,0,0,0,0,1|1,0,1]=3 1361 B14R1.698 O=C([O-])CC(=O)Cc1ccc(cc1)I 1458a_100000688869_100020667443 [0,0,0,0,0,1|1,0,1]=3 1362 B14R1.698 O=C([O-])CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100020667443 [0,0,0,0,0,1|0,0,1]=2 1363 B14R1.698 O=C([O-])CC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100020667443 [0,0,0,0,0,1|2,0,1]=4 1364 B14R1.698 O=C([O-])CC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100020667443 [0,0,0,0,0,1|2,0,1]=4 1365 B14R1.698 O=C([O-])CC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100020667443 [0,0,0,0,0,1|2,0,1]=4 1366 B14R1.698 O=C([O-])CC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100020667443 [0,0,0,0,0,1|2,0,1]=4 1367 B14R1.698 O=C([O-])CC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100020667443 [0,0,0,0,0,1|1,0,2]=4 1368 B14R1.698 [13CH3]C(=O)CC(=O)Nc1ccc(cc1)Br 1458a_100011623802_200025704644 [0,0,0,0,0,1|3,0,0]=4 1369 B14R1.698 [13CH3]C(=O)CC(=O)Nc1ccc(cc1)F 1458a_200000189458_200025704644 [0,0,0,0,0,1|3,0,0]=4 1370 B14R1.698 [13CH3]N(CC(=O)O)Cc1ccc(cc1)Cl 269956a_100000756320_200025704644 [0,0,0,0,0,1|3,0,0]=4 1371 B11R0.163 C=CC=CC(=O)CC(=O)C(=O)C 1458a_100016291481_100011261029 [1,0,1,0,0,0|2,0,0]=4 1372 B11R1.1 O=CCCc1ccc(cc1)O 271570a_203496583355_100011361538 [2,0,0,0,0,0|0,0,1]=3 1373 B11R1.1 O=CCNc1ccc(cc1)O 34a_100000185829_200009817547 [2,0,0,0,0,0|1,0,1]=4 1374 B11R1.1 O=CCSc1ccc(cc1)O 62a_200015260668_100000185759 [2,0,0,0,0,0|1,0,1]=4 1375 B11R1.1 OCCCc1ccc(cc1)O 271570a_203496583355_100011709247 [2,0,0,0,0,0|0,0,2]=4 1376 B11R1.91 CC(=O)C=Cc1ccccc1 1458a_100000210462_200000210301 [2,0,0,0,0,0|1,0,1]=4 1377 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000070787_100000765856 [2,0,0,0,0,0|1,0,1]=4 1378 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000185753_200000210301 [2,0,0,0,0,0|1,0,1]=4 1379 B11R1.91 CC(=O)NCc1ccccc1 11a_100015324214_100015343762 [2,0,0,0,0,0|2,0,0]=4 1380 B11R1.91 CC(=O)NCc1ccccc1 1626a_100015324214_100015343762 [2,0,0,0,0,0|2,0,0]=4 1381 B11R1.91 CC(=O)NCc1ccccc1 240690a_100015324214_100015343762 [2,0,0,0,0,0|2,0,0]=4 1382 B11R1.91 CC(=O)NCc1ccccc1 527a_100015324214_100103153847 [2,0,0,0,0,0|2,0,0]=4 1383 B11R1.91 [13CH3]C(=O)C=Cc1ccccc1 1458a_100000210462_200025704644 [2,0,0,0,0,0|1,0,1]=4 1384 B11R1.91 [13CH3]C(=O)CCc1ccccc1 1458a_100000185753_200025704644 [2,0,0,0,0,0|1,0,1]=4 1385 B11R1.40 C#CC(=O)Cc1ccccc1 1458a_100000211873_100015291786 [2,0,0,0,0,0|1,0,1]=4 1386 B11R1.40 C=CC(=O)Cc1ccccc1 1458a_100000185746_100015291786 [2,0,0,0,0,0|1,0,0]=3 1387 B11R1.40 C=CC(=O)Cc1ccccn1 1458a_100000185746_100000721315 [2,0,0,0,0,0|2,0,0]=4 1388 B11R1.40 C=CC(=O)Cc1cccnc1 1458a_100000185746_100000733263 [2,0,0,0,0,0|2,0,0]=4 1389 B11R1.40 C=CC(=O)Cc1ccncc1 1458a_100000185746_100000705612 [2,0,0,0,0,0|2,0,0]=4 1390 B11R1.40 C=CC(=O)Nc1ccccc1 1626a_100000106764_100000185746 [2,0,0,0,0,0|2,0,0]=4 1391 B11R1.40 C=CC(=O)Nc1ccccc1 22a_100000106764_100000185746 [2,0,0,0,0,0|2,0,0]=4 1392 B11R1.40 CCC(=O)Cc1ccccc1 1458a_100000210414_100015291786 [2,0,0,0,0,0|1,0,1]=4 1393 B11R1.40 O=C(CO)Cc1ccccc1 1458a_100000210174_100015291786 [2,0,0,0,0,0|0,0,1]=3 1394 B11R1.40 O=C(CO)Cc1ccccn1 1458a_100000210174_100000721315 [2,0,0,0,0,0|1,0,1]=4 1395 B11R1.40 O=C(CO)Cc1cccnc1 1458a_100000210174_100000733263 [2,0,0,0,0,0|1,0,1]=4 1396 B11R1.40 O=C(CO)Cc1ccncc1 1458a_100000210174_100000705612 [2,0,0,0,0,0|1,0,1]=4 1397 B11R1.40 O=C(CO)Nc1ccccc1 22a_100000106764_100000210174 [2,0,0,0,0,0|1,0,1]=4 1398 B11R1.40 O=C(CO)Nc1ccccc1 527a_100000106764_100000210174 [2,0,0,0,0,0|1,0,1]=4 1399 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000070787_100000189115 [2,0,0,0,0,0|1,0,1]=4 1400 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_200000210301 [2,0,0,0,0,0|1,0,1]=4 1401 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000070787_100000210814 [2,0,0,0,0,0|1,0,1]=4 1402 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000212244_200000210301 [2,0,0,0,0,0|1,0,1]=4 1403 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000070787_100000694040 [2,0,0,0,0,0|1,0,1]=4 1404 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200000210301 [2,0,0,0,0,0|1,0,1]=4 1405 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000070787_100000198546 [2,0,0,0,0,0|1,0,1]=4 1406 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000210951_200000210301 [2,0,0,0,0,0|1,0,1]=4 1407 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000070787_100000189116 [2,0,0,0,0,0|1,0,1]=4 1408 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000688869_200000210301 [2,0,0,0,0,0|1,0,1]=4 1409 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [2,0,0,0,0,0|0,0,1]=3 1410 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [2,0,0,0,0,0|0,0,1]=3 1411 B11R1.20 CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000070787 [2,0,0,0,0,0|1,0,1]=4 1412 B11R1.20 CC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000155215 [2,0,0,0,0,0|1,0,1]=4 1413 B11R1.20 CC(=O)Oc1ccc(cc1)O 271570a_203496583355_100000002173 [2,0,0,0,0,0|1,0,1]=4 1414 B11R1.20 CC(=O)Sc1ccc(cc1)O 271570a_203496583355_200009995050 [2,0,0,0,0,0|1,0,1]=4 1415 B11R1.20 Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000212244_200025704644 [2,0,0,0,0,0|1,0,1]=4 1416 B11R1.20 NC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000162331 [2,0,0,0,0,0|1,0,0]=3 1417 B11R1.20 NC(=O)Cc1ccc(cn1)O 271570a_203496583355_200010888337 [2,0,0,0,0,0|2,0,0]=4 1418 B11R1.20 NC(=O)Cc1ccc(nc1)O 271570a_203496583355_200000071513 [2,0,0,0,0,0|2,0,0]=4 1419 B11R1.20 NC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000198584 [2,0,0,0,0,0|2,0,0]=4 1420 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Br 1458a_100000198978_200025704644 [2,0,0,0,0,0|1,0,1]=4 1421 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200025704644 [2,0,0,0,0,0|1,0,1]=4 1422 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)F 1458a_100000210951_200025704644 [2,0,0,0,0,0|1,0,1]=4 1423 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)I 1458a_100000688869_200025704644 [2,0,0,0,0,0|1,0,1]=4 1424 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [2,0,0,0,0,0|0,0,1]=3 1425 B13R1.3 CC(=O)/C=C/c1ccc(cc1)O[13CH3] 34a_100000189429_200025704644 [1,1,0,0,0,0|1,0,1]=4 1426 B13R1.3 CC(=O)CCc1ccc(cc1)O[13CH3] 34a_100000198047_200025704644 [1,1,0,0,0,0|1,0,1]=4 1427 B13R1.3 CC(=O)CCc1ccc(cc1)O[13CH3] 7a_100000198047_200025704644 [1,1,0,0,0,0|1,0,1]=4 1428 B13R1.3 CC(=O)NCc1ccc(cc1)CO 240690a_100015189231_100015343762 [1,1,0,0,0,0|2,0,0]=4 1429 B13R1.3 CC(=O)NCc1ccc(cc1)CO 527a_100015189231_100103153847 [1,1,0,0,0,0|2,0,0]=4 1430 B13R1.3 COc1ccc(cc1)/C=C/C(=O)C 34a_100000189429_200000210301 [1,1,0,0,0,0|1,0,1]=4 1431 B13R1.3 COc1ccc(cc1)C=CC(=O)C 1458a_100000184205_200000210301 [1,1,0,0,0,0|1,0,1]=4 1432 B13R1.3 COc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000184205_200025704644 [1,1,0,0,0,0|1,0,1]=4 1433 B13R1.3 COc1ccc(cc1)CCC(=O)C 1458a_100000070787_100000184700 [1,1,0,0,0,0|1,0,1]=4 1434 B13R1.3 COc1ccc(cc1)CCC(=O)C 1458a_100000211712_200000210301 [1,1,0,0,0,0|1,0,1]=4 1435 B13R1.3 COc1ccc(cc1)CCC(=O)C 34a_100000198047_200000210301 [1,1,0,0,0,0|1,0,1]=4 1436 B13R1.3 COc1ccc(cc1)CCC(=O)C 7a_100000198047_200000210301 [1,1,0,0,0,0|1,0,1]=4 1437 B13R1.3 COc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000211712_200025704644 [1,1,0,0,0,0|1,0,1]=4 1438 B13R1.3 COc1ccc(cc1)CNC(=O)C 11a_100000185587_100015343762 [1,1,0,0,0,0|2,0,0]=4 1439 B13R1.3 COc1ccc(cc1)CNC(=O)C 1626a_100000185587_100015343762 [1,1,0,0,0,0|2,0,0]=4 1440 B13R1.3 COc1ccc(cc1)CNC(=O)C 240690a_100000185587_100015343762 [1,1,0,0,0,0|2,0,0]=4 1441 B13R1.3 COc1ccc(cc1)CNC(=O)C 527a_100000185587_100103153847 [1,1,0,0,0,0|2,0,0]=4 1442 B13R1.14 C#CC(=O)CCc1ccc(cc1)O 1458a_100000211873_100009816426 [1,1,0,0,0,0|1,0,1]=4 1443 B13R1.14 C=CC(=O)CCc1ccc(cc1)O 1458a_100000185746_100009816426 [1,1,0,0,0,0|1,0,1]=4 1444 B13R1.14 C=CC(=O)NCc1ccc(cc1)O 240690a_100000185549_200121576911 [1,1,0,0,0,0|2,0,0]=4 1445 B13R1.14 CCC(=O)CCc1ccc(cc1)O 1458a_100000210414_100009816426 [1,1,0,0,0,0|1,0,1]=4 1446 B13R1.14 CCC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000210202 [1,1,0,0,0,0|1,0,1]=4 1447 B13R1.14 CCC(=O)NCc1ccc(cc1)O 240690a_100000185549_100000210414 [1,1,0,0,0,0|2,0,0]=4 1448 B13R1.14 CCC(=O)NCc1ccc(cc1)O 527a_100000185549_100000210414 [1,1,0,0,0,0|2,0,0]=4 1449 B13R1.14 CNC(=O)C=Cc1ccc(cc1)O 240690a_100102657272_100016269017 [1,1,0,0,0,0|1,0,1]=4 1450 B13R1.14 CNC(=O)CCc1ccc(cc1)O 240690a_100102657272_100000742835 [1,1,0,0,0,0|1,0,1]=4 1451 B13R1.14 CNC(=O)CCc1ccc(cc1)O 271570a_203496583355_200010273138 [1,1,0,0,0,0|1,0,1]=4 1452 B13R1.14 CNC(=O)NCc1ccc(cc1)O 2708a_100000185549_106832991635 [1,1,0,0,0,0|2,0,0]=4 1453 B13R1.14 CNC(=O)NCc1ccc(cc1)O 2708a_100102657272_100000185549 [1,1,0,0,0,0|2,0,0]=4 1454 B13R1.14 CNC(=O)NCc1ccc(cc1)O 273464a_100000185549_100102657272 [1,1,0,0,0,0|2,0,0]=4 1455 B13R1.14 CNC(=O)NCc1ccc(cc1)O 273464a_100102657272_100000185549 [1,1,0,0,0,0|2,0,0]=4 1456 B13R1.14 CNC(=O)NCc1ccc(cc1)O 512a_106832991638_100000185549 [1,1,0,0,0,0|2,0,0]=4 1457 B13R1.14 COC(=O)/C=C/c1ccc(cc1)O 271570a_203496583355_100000148628 [1,1,0,0,0,0|0,0,1]=3 1458 B13R1.14 COC(=O)C#Cc1ccc(cc1)O 271570a_203496583355_100012100070 [1,1,0,0,0,0|0,0,2]=4 1459 B13R1.14 COC(=O)CCc1ccc(cc1)O 271570a_203496583355_100012357364 [1,1,0,0,0,0|0,0,1]=3 1460 B13R1.14 COC(=O)CNc1ccc(cc1)O 34a_100000185829_100000747449 [1,1,0,0,0,0|1,0,1]=4 1461 B13R1.14 COC(=O)COc1ccc(cc1)O 271570a_203496583355_100000149925 [1,1,0,0,0,0|1,0,1]=4 1462 B13R1.14 COC(=O)CSc1ccc(cc1)O 62a_100000747449_100000185759 [1,1,0,0,0,0|1,0,1]=4 1463 B13R1.14 Cc1ccc(cc1)CCC(=O)CO 1458a_100000210174_100011713686 [1,1,0,0,0,0|1,0,1]=4 1464 B13R1.14 Cc1ccc(cc1)CNC(=O)CO 240690a_100000174908_100000210174 [1,1,0,0,0,0|2,0,0]=4 1465 B13R1.14 Cc1ccc(cc1)CNC(=O)CO 527a_100000174908_100000210174 [1,1,0,0,0,0|2,0,0]=4 1466 B13R1.14 O=C(CF)CCc1ccc(cc1)O 1458a_100000742835_100015361967 [1,1,0,0,0,0|1,0,1]=4 1467 B13R1.14 O=C(CO)CCc1ccc(cc1)Br 1458a_100000210174_100011740612 [1,1,0,0,0,0|1,0,1]=4 1468 B13R1.14 O=C(CO)CCc1ccc(cc1)Cl 1458a_100000210174_100011713675 [1,1,0,0,0,0|1,0,1]=4 1469 B13R1.14 O=C(CO)CCc1ccc(cc1)F 1458a_100000210174_100011217392 [1,1,0,0,0,0|1,0,1]=4 1470 B13R1.14 O=C(CO)CCc1ccc(cc1)O 1458a_100000210174_100009816426 [1,1,0,0,0,0|0,0,1]=3 1471 B13R1.14 O=C(CO)NCc1ccc(cc1)Br 240690a_100000174875_100000210174 [1,1,0,0,0,0|2,0,0]=4 1472 B13R1.14 O=C(CO)NCc1ccc(cc1)Br 527a_100000174875_100000210174 [1,1,0,0,0,0|2,0,0]=4 1473 B13R1.14 O=C(CO)NCc1ccc(cc1)Cl 240690a_100000174871_100000210174 [1,1,0,0,0,0|2,0,0]=4 1474 B13R1.14 O=C(CO)NCc1ccc(cc1)Cl 527a_100000174871_100000210174 [1,1,0,0,0,0|2,0,0]=4 1475 B13R1.14 O=C(CO)NCc1ccc(cc1)F 240690a_100000174882_100000210174 [1,1,0,0,0,0|2,0,0]=4 1476 B13R1.14 O=C(CO)NCc1ccc(cc1)F 527a_100000174882_100000210174 [1,1,0,0,0,0|2,0,0]=4 1477 B13R1.14 O=C(CO)NCc1ccc(cc1)I 240690a_100016989417_100000210174 [1,1,0,0,0,0|2,0,0]=4 1478 B13R1.14 O=C(CO)NCc1ccc(cc1)I 527a_100016989417_100000210174 [1,1,0,0,0,0|2,0,0]=4 1479 B13R1.14 O=C(CO)NCc1ccc(cc1)O 240690a_100000185549_100000210174 [1,1,0,0,0,0|1,0,0]=3 1480 B13R1.14 O=C(CO)NCc1ccc(cc1)O 527a_100000185549_100000210174 [1,1,0,0,0,0|1,0,0]=3 1481 B13R1.14 O=C(CO)NCc1ccc(cn1)O 240690a_100020605196_100000210174 [1,1,0,0,0,0|2,0,0]=4 1482 B13R1.14 O=C(CO)NCc1ccc(nc1)O 240690a_100000757128_100000210174 [1,1,0,0,0,0|2,0,0]=4 1483 B13R1.132 CC(=O)NC(C)c1ccc(cc1)O 271570a_203496583355_100000153805 [1,1,0,0,0,0|2,0,0]=4 1484 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)O 240690a_100161106496_100015343762 [1,1,0,0,0,0|2,0,0]=4 1485 B13R1.164 CC(=O)CCc1ccc(cc1O)O 1458a_100000041388_200000210301 [1,1,0,0,0,0|1,0,1]=4 1486 B13R1.164 CC(=O)NCc1ccc(cc1Cl)O 240690a_200161156549_100015343762 [1,1,0,0,0,0|2,0,0]=4 1487 B13R1.164 CC(=O)NCc1ccc(cc1Cl)O 527a_200161156549_100103153847 [1,1,0,0,0,0|2,0,0]=4 1488 B13R1.164 [13CH3]C(=O)CCc1ccc(cc1O)O 1458a_100000041388_200025704644 [1,1,0,0,0,0|1,0,1]=4 1489 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Br)O 1458a_200103079279_200000210301 [1,1,0,0,0,0|1,0,1]=4 1490 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Cl)O 1458a_200103117615_200000210301 [1,1,0,0,0,0|1,0,1]=4 1491 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200000210301 [1,1,0,0,0,0|1,0,1]=4 1492 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000070787_200010393615 [1,1,0,0,0,0|1,0,1]=4 1493 B13R1.511 CC(=O)NCc1ccc(c(c1)F)O 240690a_100000758358_100015343762 [1,1,0,0,0,0|2,0,0]=4 1494 B13R1.511 CC(=O)NCc1ccc(c(c1)F)O 527a_100000758358_100103153847 [1,1,0,0,0,0|2,0,0]=4 1495 B13R1.511 CC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100015343762 [1,1,0,0,0,0|2,0,0]=4 1496 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Br)O 1458a_200103079279_200025704644 [1,1,0,0,0,0|1,0,1]=4 1497 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Cl)O 1458a_200103117615_200025704644 [1,1,0,0,0,0|1,0,1]=4 1498 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200025704644 [1,1,0,0,0,0|1,0,1]=4 1499 B13R1.135 C/C=C(\C)/C(=O)Cc1ccccc1 1458a_100020587367_100015291786 [1,1,0,0,0,0|2,0,0]=4 1500 B13R1.135 C=C(CO)C(=O)Nc1ccccc1 22a_100000106764_200000705526 [1,1,0,0,0,0|2,0,0]=4 1501 B13R1.135 C=C(Cc1ccccc1)C(=O)NC 11a_106832991635_100000066491 [1,1,0,0,0,0|2,0,0]=4 1502 B13R1.135 C=C(Cc1ccccc1)C(=O)NC 1626a_100102657272_100000066491 [1,1,0,0,0,0|2,0,0]=4 1503 B13R1.135 CC(Cc1ccccc1)C(=O)CO 1458a_100000210174_200011218536 [1,1,0,0,0,0|1,0,1]=4 1504 B13R1.135 CCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000210202 [1,1,0,0,0,0|2,0,0]=4 1505 B13R1.135 CCC(O)C(=O)Cc1ccccc1 1458a_100011196387_100015291786 [1,1,0,0,0,0|1,0,1]=4 1506 B13R1.135 CN(Cc1ccccc1)C(=O)CO 240690a_100000186898_100000210174 [1,1,0,0,0,0|2,0,0]=4 1507 B13R1.135 CN(Cc1ccccc1)C(=O)CO 527a_100000186898_100000210174 [1,1,0,0,0,0|2,0,0]=4 1508 B13R1.135 CNC(=O)C(=O)Cc1ccccc1 1458a_100011218921_100015291786 [1,1,0,0,0,0|1,0,0]=3 1509 B13R1.135 CNC(=O)C(=O)Cc1ccccn1 1458a_100011218921_100000721315 [1,1,0,0,0,0|2,0,0]=4 1510 B13R1.135 CNC(=O)C(=O)Cc1cccnc1 1458a_100011218921_100000733263 [1,1,0,0,0,0|2,0,0]=4 1511 B13R1.135 CNC(=O)C(=O)Cc1ccncc1 1458a_100011218921_100000705612 [1,1,0,0,0,0|2,0,0]=4 1512 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 1626a_100000106764_100011218921 [1,1,0,0,0,0|2,0,0]=4 1513 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 22a_100000106764_100011218921 [1,1,0,0,0,0|2,0,0]=4 1514 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 240690a_100102657272_100000738435 [1,1,0,0,0,0|2,0,0]=4 1515 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 527a_100000106764_100011218921 [1,1,0,0,0,0|2,0,0]=4 1516 B13R1.135 COC(=O)C(=O)Nc1ccccc1 11a_100000106764_100000024059 [1,1,0,0,0,0|1,0,0]=3 1517 B13R1.135 COC(=O)C(=O)Nc1ccccc1 1626a_100000106764_100000024059 [1,1,0,0,0,0|1,0,0]=3 1518 B13R1.135 COC(=O)C(=O)Nc1ccccc1 527a_100000106764_100000024059 [1,1,0,0,0,0|1,0,0]=3 1519 B13R1.135 COC(C)C(=O)Cc1ccccc1 1458a_100000743197_100015291786 [1,1,0,0,0,0|1,0,1]=4 1520 B13R1.135 O=C(CF)C(=O)Nc1ccccc1 1458a_100000738435_100015361967 [1,1,0,0,0,0|2,0,0]=4 1521 B13R1.135 O=C(Cc1ccccc1)C(O)CO 1458a_100011215603_100015291786 [1,1,0,0,0,0|0,0,2]=4 1522 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)Br 1458a_100000185857_100000211773 [1,1,0,0,0,0|2,0,0]=4 1523 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)C 1458a_100000185857_100000211840 [1,1,0,0,0,0|2,0,0]=4 1524 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)Cl 1458a_100000185857_100000181238 [1,1,0,0,0,0|2,0,0]=4 1525 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)F 1458a_100000185857_100000230114 [1,1,0,0,0,0|2,0,0]=4 1526 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)I 1458a_100000185857_100011218688 [1,1,0,0,0,0|2,0,0]=4 1527 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)O 1458a_100000185857_100011660834 [1,1,0,0,0,0|2,0,0]=4 1528 B13R1.148 CC(=O)C(=O)Nc1cccc(c1)Cl 1458a_200011297299_200000210301 [1,1,0,0,0,0|2,0,0]=4 1529 B13R1.148 CC(=O)C(=O)Nc1cccc(c1)F 1458a_200011297300_200000210301 [1,1,0,0,0,0|2,0,0]=4 1530 B13R1.148 C[C@@H](O)C(=O)Cc1cccc(c1)Br 1458a_100000717761_100000211773 [1,1,0,0,0,0|1,0,1]=4 1531 B13R1.148 C[C@@H](O)C(=O)Cc1cccc(c1)Cl 1458a_100000717761_100000181238 [1,1,0,0,0,0|1,0,1]=4 1532 B13R1.148 C[C@@H](O)C(=O)Cc1cccc(c1)F 1458a_100000717761_100000230114 [1,1,0,0,0,0|1,0,1]=4 1533 B13R1.148 C[C@@H](O)C(=O)Cc1cccc(c1)I 1458a_100000717761_100011218688 [1,1,0,0,0,0|1,0,1]=4 1534 B13R1.148 C[C@@H](O)C(=O)Cc1cccc(c1)O 1458a_100000717761_100011660834 [1,1,0,0,0,0|1,0,1]=4 1535 B13R1.148 C[C@H](O)C(=O)Cc1cccc(c1)Br 1458a_217856618621_100000211773 [1,1,0,0,0,0|1,0,1]=4 1536 B13R1.148 C[C@H](O)C(=O)Cc1cccc(c1)Cl 1458a_217856618621_100000181238 [1,1,0,0,0,0|1,0,1]=4 1537 B13R1.148 C[C@H](O)C(=O)Cc1cccc(c1)F 1458a_217856618621_100000230114 [1,1,0,0,0,0|1,0,1]=4 1538 B13R1.148 C[C@H](O)C(=O)Cc1cccc(c1)I 1458a_217856618621_100011218688 [1,1,0,0,0,0|1,0,1]=4 1539 B13R1.148 C[C@H](O)C(=O)Cc1cccc(c1)O 1458a_217856618621_100011660834 [1,1,0,0,0,0|1,0,1]=4 1540 B13R1.148 Cc1cccc(c1)CC(=O)C(O)O 1458a_100000233687_100000211840 [1,1,0,0,0,0|0,0,2]=4 1541 B13R1.148 Cc1cccc(c1)CC(=O)[C@@H](C)O 1458a_100000717761_100000211840 [1,1,0,0,0,0|1,0,1]=4 1542 B13R1.148 Cc1cccc(c1)CC(=O)[C@H](C)O 1458a_217856618621_100000211840 [1,1,0,0,0,0|1,0,1]=4 1543 B13R1.148 Cc1cccc(c1)NC(=O)C(=O)N 22a_100000188690_100011215815 [1,1,0,0,0,0|2,0,0]=4 1544 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)Br 22a_100000210019_100011215815 [1,1,0,0,0,0|2,0,0]=4 1545 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)Cl 22a_100000185859_100011215815 [1,1,0,0,0,0|2,0,0]=4 1546 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)F 22a_100000210047_100011215815 [1,1,0,0,0,0|2,0,0]=4 1547 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)I 22a_100000211102_100011215815 [1,1,0,0,0,0|2,0,0]=4 1548 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)O 22a_100000210217_100011215815 [1,1,0,0,0,0|2,0,0]=4 1549 B13R1.148 O=C(Cc1cccc(c1)Br)C(O)O 1458a_100000233687_100000211773 [1,1,0,0,0,0|0,0,2]=4 1550 B13R1.148 O=C(Cc1cccc(c1)Cl)C(O)O 1458a_100000233687_100000181238 [1,1,0,0,0,0|0,0,2]=4 1551 B13R1.148 O=C(Cc1cccc(c1)F)C(O)O 1458a_100000233687_100000230114 [1,1,0,0,0,0|0,0,2]=4 1552 B13R1.148 O=C(Cc1cccc(c1)I)C(O)O 1458a_100000233687_100011218688 [1,1,0,0,0,0|0,0,2]=4 1553 B13R1.148 O=C(Cc1cccc(c1)O)C(O)O 1458a_100000233687_100011660834 [1,1,0,0,0,0|0,0,2]=4 1554 B13R1.148 [13CH3]C(=O)C(=O)Nc1cccc(c1)Cl 1458a_200011297299_200025704644 [1,1,0,0,0,0|2,0,0]=4 1555 B13R1.148 [13CH3]C(=O)C(=O)Nc1cccc(c1)F 1458a_200011297300_200025704644 [1,1,0,0,0,0|2,0,0]=4 1556 B13R1.152 C=C(C)C(=O)C(C)c1ccccc1 1458a_100000185857_100000230085 [1,1,0,0,0,0|2,0,0]=4 1557 B13R1.152 CC(=O)C(=O)N(C)c1ccccc1 1458a_100011297159_200000210301 [1,1,0,0,0,0|2,0,0]=4 1558 B13R1.152 CC(C(=O)C(O)O)c1ccccc1 1458a_100000233687_100000230085 [1,1,0,0,0,0|0,0,2]=4 1559 B13R1.152 CC(C(=O)[C@@H](C)O)c1ccccc1 1458a_100000717761_100000230085 [1,1,0,0,0,0|1,0,1]=4 1560 B13R1.152 CC(C(=O)[C@H](C)O)c1ccccc1 1458a_217856618621_100000230085 [1,1,0,0,0,0|1,0,1]=4 1561 B13R1.152 CN(C(=O)C(=O)N)c1ccccc1 22a_100000210012_100011215815 [1,1,0,0,0,0|2,0,0]=4 1562 B13R1.152 CN(C(=O)C(=O)[13CH3])c1ccccc1 1458a_100011297159_200025704644 [1,1,0,0,0,0|2,0,0]=4 1563 B13R1.202 C=C(C)C(=O)Cc1ccccc1Br 1458a_100000185857_100000184730 [1,1,0,0,0,0|2,0,0]=4 1564 B13R1.202 C=C(C)C(=O)Cc1ccccc1C 1458a_100000185857_100000211839 [1,1,0,0,0,0|2,0,0]=4 1565 B13R1.202 C=C(C)C(=O)Cc1ccccc1Cl 1458a_100000185857_100000187162 [1,1,0,0,0,0|2,0,0]=4 1566 B13R1.202 C=C(C)C(=O)Cc1ccccc1F 1458a_100000185857_100000187165 [1,1,0,0,0,0|2,0,0]=4 1567 B13R1.202 C=C(C)C(=O)Cc1ccccc1I 1458a_100000185857_100011216222 [1,1,0,0,0,0|2,0,0]=4 1568 B13R1.202 CC(=O)C(=O)Nc1ccccc1C 1458a_200011297352_200000210301 [1,1,0,0,0,0|2,0,0]=4 1569 B13R1.202 CC(=O)C(=O)Nc1ccccc1F 1458a_200011297310_200000210301 [1,1,0,0,0,0|2,0,0]=4 1570 B13R1.202 C[C@@H](O)C(=O)Cc1ccccc1Br 1458a_100000717761_100000184730 [1,1,0,0,0,0|1,0,1]=4 1571 B13R1.202 C[C@@H](O)C(=O)Cc1ccccc1Cl 1458a_100000717761_100000187162 [1,1,0,0,0,0|1,0,1]=4 1572 B13R1.202 C[C@@H](O)C(=O)Cc1ccccc1F 1458a_100000717761_100000187165 [1,1,0,0,0,0|1,0,1]=4 1573 B13R1.202 C[C@@H](O)C(=O)Cc1ccccc1I 1458a_100000717761_100011216222 [1,1,0,0,0,0|1,0,1]=4 1574 B13R1.202 C[C@H](O)C(=O)Cc1ccccc1Br 1458a_217856618621_100000184730 [1,1,0,0,0,0|1,0,1]=4 1575 B13R1.202 C[C@H](O)C(=O)Cc1ccccc1Cl 1458a_217856618621_100000187162 [1,1,0,0,0,0|1,0,1]=4 1576 B13R1.202 C[C@H](O)C(=O)Cc1ccccc1F 1458a_217856618621_100000187165 [1,1,0,0,0,0|1,0,1]=4 1577 B13R1.202 C[C@H](O)C(=O)Cc1ccccc1I 1458a_217856618621_100011216222 [1,1,0,0,0,0|1,0,1]=4 1578 B13R1.202 Cc1ccccc1CC(=O)C(O)O 1458a_100000233687_100000211839 [1,1,0,0,0,0|0,0,2]=4 1579 B13R1.202 Cc1ccccc1CC(=O)[C@@H](C)O 1458a_100000717761_100000211839 [1,1,0,0,0,0|1,0,1]=4 1580 B13R1.202 Cc1ccccc1CC(=O)[C@H](C)O 1458a_217856618621_100000211839 [1,1,0,0,0,0|1,0,1]=4 1581 B13R1.202 Cc1ccccc1NC(=O)C(=O)N 22a_100015192222_100011215815 [1,1,0,0,0,0|2,0,0]=4 1582 B13R1.202 Cc1ccccc1NC(=O)C(=O)[13CH3] 1458a_200011297352_200025704644 [1,1,0,0,0,0|2,0,0]=4 1583 B13R1.202 NC(=O)C(=O)Nc1ccccc1Cl 22a_100000185783_100011215815 [1,1,0,0,0,0|2,0,0]=4 1584 B13R1.202 NC(=O)C(=O)Nc1ccccc1F 22a_100000210422_100011215815 [1,1,0,0,0,0|2,0,0]=4 1585 B13R1.202 NC(=O)C(=O)Nc1ccccc1O 22a_100000185747_100011215815 [1,1,0,0,0,0|2,0,0]=4 1586 B13R1.202 O=C(Cc1ccccc1Br)C(O)O 1458a_100000233687_100000184730 [1,1,0,0,0,0|0,0,2]=4 1587 B13R1.202 O=C(Cc1ccccc1Cl)C(O)O 1458a_100000233687_100000187162 [1,1,0,0,0,0|0,0,2]=4 1588 B13R1.202 O=C(Cc1ccccc1F)C(O)O 1458a_100000233687_100000187165 [1,1,0,0,0,0|0,0,2]=4 1589 B13R1.202 O=C(Cc1ccccc1I)C(O)O 1458a_100000233687_100011216222 [1,1,0,0,0,0|0,0,2]=4 1590 B13R1.202 [13CH3]C(=O)C(=O)Nc1ccccc1F 1458a_200011297310_200025704644 [1,1,0,0,0,0|2,0,0]=4 1591 B13R1.353 CC(C)(O)C(=O)Cc1ccccc1 1458a_100000242741_100015291786 [1,1,0,0,0,0|1,0,1]=4 1592 B13R1.5 C#CC(=O)Cc1ccc(cc1)CO 1458a_100000211873_100000067286 [1,1,0,0,0,0|1,0,1]=4 1593 B13R1.5 C#Cc1ccc(cc1)CC(=O)C=C 1458a_100000185746_100000140223 [1,1,0,0,0,0|2,0,0]=4 1594 B13R1.5 C#Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000140223 [1,1,0,0,0,0|1,0,1]=4 1595 B13R1.5 C=CC(=O)Cc1ccc(cc1)C#N 1458a_100000185746_100000184898 [1,1,0,0,0,0|2,0,0]=4 1596 B13R1.5 C=CC(=O)Cc1ccc(cc1)C=C 1458a_100000185746_100000034074 [1,1,0,0,0,0|2,0,0]=4 1597 B13R1.5 C=CC(=O)Cc1ccc(cc1)C=O 1458a_100000185746_100000075337 [1,1,0,0,0,0|1,0,1]=4 1598 B13R1.5 C=CC(=O)Cc1ccc(cc1)CC 1458a_100000185746_100000747183 [1,1,0,0,0,0|2,0,0]=4 1599 B13R1.5 C=CC(=O)Cc1ccc(cc1)CO 1458a_100000185746_100000067286 [1,1,0,0,0,0|1,0,0]=3 1600 B13R1.5 C=CC(=O)Cc1ccc(cc1)SC 1458a_100000185746_100000181263 [1,1,0,0,0,0|1,1,0]=4 1601 B13R1.5 C=CC(=O)Cc1ccc(cn1)OC 1458a_100000185746_200000757186 [1,1,0,0,0,0|2,0,0]=4 1602 B13R1.5 C=CC(=O)Cc1ccc(nc1)OC 1458a_100000185746_100020631284 [1,1,0,0,0,0|2,0,0]=4 1603 B13R1.5 C=CC(=O)Nc1ccc(cc1)CO 22a_100011215238_100000185746 [1,1,0,0,0,0|2,0,0]=4 1604 B13R1.5 C=CC(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000185746 [1,1,0,0,0,0|2,0,0]=4 1605 B13R1.5 C=CC(=O)Nc1ccc(cc1)OC 22a_100000184247_100000185746 [1,1,0,0,0,0|2,0,0]=4 1606 B13R1.5 C=CC(=O)Nc1ccc(cc1)OC 34a_100011235904_200000210301 [1,1,0,0,0,0|2,0,0]=4 1607 B13R1.5 C=CC(=O)Nc1ccc(cc1)O[13CH3] 34a_100011235904_200025704644 [1,1,0,0,0,0|2,0,0]=4 1608 B13R1.5 C=Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000034074 [1,1,0,0,0,0|1,0,1]=4 1609 B13R1.5 CCC(=O)Cc1ccc(cc1)CO 1458a_100000210414_100000067286 [1,1,0,0,0,0|1,0,1]=4 1610 B13R1.5 CCC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100000210202 [1,1,0,0,0,0|1,0,1]=4 1611 B13R1.5 CCC(=O)Cc1ccc(cc1)OC 1458a_100000210706_100000210202 [1,1,0,0,0,0|1,0,1]=4 1612 B13R1.5 CCc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000747183 [1,1,0,0,0,0|1,0,1]=4 1613 B13R1.5 CNC(=O)Cc1ccc(cc1)CO 240690a_100102657272_100011356463 [1,1,0,0,0,0|2,0,0]=4 1614 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 11a_106832991635_100000210706 [1,1,0,0,0,0|2,0,0]=4 1615 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 240690a_100102657272_100000210706 [1,1,0,0,0,0|2,0,0]=4 1616 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 34a_200000020795_200000210301 [1,1,0,0,0,0|2,0,0]=4 1617 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 527a_100102657272_100000210706 [1,1,0,0,0,0|2,0,0]=4 1618 B13R1.5 CNC(=O)Cc1ccc(cc1)O[13CH3] 34a_200000020795_200025704644 [1,1,0,0,0,0|2,0,0]=4 1619 B13R1.5 COC(=O)Cc1ccc(cc1)OC 34a_100000211648_200000210301 [1,1,0,0,0,0|2,0,0]=4 1620 B13R1.5 COC(=O)Cc1ccc(cc1)O[13CH3] 34a_100000211648_200025704644 [1,1,0,0,0,0|2,0,0]=4 1621 B13R1.5 COc1ccc(cc1)CC(=O)CF 1458a_100000210706_100015361967 [1,1,0,0,0,0|1,0,1]=4 1622 B13R1.5 COc1ccc(cc1)CC(=O)NN 34a_100000020777_200000210301 [1,1,0,0,0,0|2,0,0]=4 1623 B13R1.5 COc1ccc(cc1)NC(=O)CO 22a_100000184247_100000210174 [1,1,0,0,0,0|1,0,1]=4 1624 B13R1.5 COc1ccc(cc1)NC(=O)CO 527a_100000184247_100000210174 [1,1,0,0,0,0|1,0,1]=4 1625 B13R1.5 COc1ccc(cn1)CC(=O)CO 1458a_100000210174_100020631284 [1,1,0,0,0,0|1,0,1]=4 1626 B13R1.5 COc1ccc(nc1)CC(=O)CO 1458a_100000210174_200000757186 [1,1,0,0,0,0|1,0,1]=4 1627 B13R1.5 CSc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000181263 [1,1,0,0,0,0|0,1,1]=4 1628 B13R1.5 N#Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000184898 [1,1,0,0,0,0|1,0,1]=4 1629 B13R1.5 O=C(CF)Cc1ccc(cc1)CO 1458a_100011356463_100015361967 [1,1,0,0,0,0|1,0,1]=4 1630 B13R1.5 O=C(CO)Cc1ccc(cc1)CO 1458a_100000210174_100000067286 [1,1,0,0,0,0|0,0,1]=3 1631 B13R1.5 O=C(CO)Nc1ccc(cc1)CO 22a_100011215238_100000210174 [1,1,0,0,0,0|1,0,1]=4 1632 B13R1.5 O=Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000075337 [1,1,0,0,0,0|0,0,2]=4 1633 B13R1.5 [13CH3]Oc1ccc(cc1)CC(=O)NN 34a_100000020777_200025704644 [1,1,0,0,0,0|2,0,0]=4 1634 B13R1.19 C#CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000184674 [1,1,0,0,0,0|1,0,1]=4 1635 B13R1.19 C=CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210623 [1,1,0,0,0,0|2,0,0]=4 1636 B13R1.19 C=CCC(=O)Cc1ccc(cc1)Br 1458a_100000210193_100000189115 [1,1,0,0,0,0|2,0,0]=4 1637 B13R1.19 C=CCC(=O)Cc1ccc(cc1)C 1458a_100000210193_100000210814 [1,1,0,0,0,0|2,0,0]=4 1638 B13R1.19 C=CCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210623 [1,1,0,0,0,0|2,0,0]=4 1639 B13R1.19 C=CCC(=O)Cc1ccc(cc1)Cl 1458a_100000210193_100000694040 [1,1,0,0,0,0|2,0,0]=4 1640 B13R1.19 C=CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210623 [1,1,0,0,0,0|2,0,0]=4 1641 B13R1.19 C=CCC(=O)Cc1ccc(cc1)F 1458a_100000210193_100000198546 [1,1,0,0,0,0|2,0,0]=4 1642 B13R1.19 C=CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210623 [1,1,0,0,0,0|2,0,0]=4 1643 B13R1.19 C=CCC(=O)Cc1ccc(cc1)I 1458a_100000210193_100000189116 [1,1,0,0,0,0|2,0,0]=4 1644 B13R1.19 C=CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210623 [1,1,0,0,0,0|2,0,0]=4 1645 B13R1.19 C=CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210623 [1,1,0,0,0,0|1,0,0]=3 1646 B13R1.19 C=CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210193 [1,1,0,0,0,0|2,0,0]=4 1647 B13R1.19 CC=CC(=O)Cc1ccc(cc1)Br 1458a_100000210699_100000189115 [1,1,0,0,0,0|2,0,0]=4 1648 B13R1.19 CC=CC(=O)Cc1ccc(cc1)C 1458a_100000210699_100000210814 [1,1,0,0,0,0|2,0,0]=4 1649 B13R1.19 CC=CC(=O)Cc1ccc(cc1)Cl 1458a_100000210699_100000694040 [1,1,0,0,0,0|2,0,0]=4 1650 B13R1.19 CC=CC(=O)Cc1ccc(cc1)F 1458a_100000210699_100000198546 [1,1,0,0,0,0|2,0,0]=4 1651 B13R1.19 CC=CC(=O)Cc1ccc(cc1)I 1458a_100000210699_100000189116 [1,1,0,0,0,0|2,0,0]=4 1652 B13R1.19 CC=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210699 [1,1,0,0,0,0|2,0,0]=4 1653 B13R1.19 CCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210303 [1,1,0,0,0,0|1,0,1]=4 1654 B13R1.19 CCNC(=O)Cc1ccc(cc1)O 240690a_100015525214_100000198540 [1,1,0,0,0,0|1,0,1]=4 1655 B13R1.19 CCNC(=O)Cc1ccc(cc1)O 527a_100015525214_100000198540 [1,1,0,0,0,0|1,0,1]=4 1656 B13R1.19 CCOC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000170549 [1,1,0,0,0,0|1,0,1]=4 1657 B13R1.19 CN(CC=O)Cc1ccc(cc1)O 2230a_100000207500_200015260668 [1,1,0,0,0,0|2,0,0]=4 1658 B13R1.19 CN(CC=O)Cc1ccc(cc1)O 269982a_100000207500_200015260668 [1,1,0,0,0,0|2,0,0]=4 1659 B13R1.19 CNNC(=O)Cc1ccc(cc1)O 22a_100016993582_100000198540 [1,1,0,0,0,0|2,0,0]=4 1660 B13R1.19 COCC(=O)Cc1ccc(cc1)Br 1458a_100000210968_100000189115 [1,1,0,0,0,0|1,0,1]=4 1661 B13R1.19 COCC(=O)Cc1ccc(cc1)C 1458a_100000210968_100000210814 [1,1,0,0,0,0|1,0,1]=4 1662 B13R1.19 COCC(=O)Cc1ccc(cc1)Cl 1458a_100000210968_100000694040 [1,1,0,0,0,0|1,0,1]=4 1663 B13R1.19 COCC(=O)Cc1ccc(cc1)F 1458a_100000210968_100000198546 [1,1,0,0,0,0|1,0,1]=4 1664 B13R1.19 COCC(=O)Cc1ccc(cc1)I 1458a_100000210968_100000189116 [1,1,0,0,0,0|1,0,1]=4 1665 B13R1.19 COCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210968 [1,1,0,0,0,0|1,0,1]=4 1666 B13R1.19 COCC(=O)Nc1ccc(cc1)O 34a_100138415774_100000233757 [1,1,0,0,0,0|1,0,1]=4 1667 B13R1.19 Cc1ccc(cc1)CC(=O)C=CBr 1458a_100016273825_100000210814 [1,1,0,0,0,0|2,0,0]=4 1668 B13R1.19 Cc1ccc(cc1)CC(=O)C=CCl 1458a_200016279998_100000210814 [1,1,0,0,0,0|2,0,0]=4 1669 B13R1.19 Cc1ccc(cc1)CC(=O)C=CI 1458a_100016256311_100000210814 [1,1,0,0,0,0|2,0,0]=4 1670 B13R1.19 Cc1ccc(cc1)CC(=O)CCO 1458a_100000212244_100000211926 [1,1,0,0,0,0|1,0,1]=4 1671 B13R1.19 Cc1ccc(cc1)CC(=O)CCO 1458a_100011216618_100000210814 [1,1,0,0,0,0|1,0,1]=4 1672 B13R1.19 N#CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100011214920 [1,1,0,0,0,0|1,0,1]=4 1673 B13R1.19 O=C(C=CBr)Cc1ccc(cc1)Br 1458a_100016273825_100000189115 [1,1,0,0,0,0|2,0,0]=4 1674 B13R1.19 O=C(C=CBr)Cc1ccc(cc1)Cl 1458a_100016273825_100000694040 [1,1,0,0,0,0|2,0,0]=4 1675 B13R1.19 O=C(C=CBr)Cc1ccc(cc1)F 1458a_100016273825_100000198546 [1,1,0,0,0,0|2,0,0]=4 1676 B13R1.19 O=C(C=CBr)Cc1ccc(cc1)I 1458a_100016273825_100000189116 [1,1,0,0,0,0|2,0,0]=4 1677 B13R1.19 O=C(C=CCl)Cc1ccc(cc1)Br 1458a_200016279998_100000189115 [1,1,0,0,0,0|2,0,0]=4 1678 B13R1.19 O=C(C=CCl)Cc1ccc(cc1)Cl 1458a_200016279998_100000694040 [1,1,0,0,0,0|2,0,0]=4 1679 B13R1.19 O=C(C=CCl)Cc1ccc(cc1)F 1458a_200016279998_100000198546 [1,1,0,0,0,0|2,0,0]=4 1680 B13R1.19 O=C(C=CCl)Cc1ccc(cc1)I 1458a_200016279998_100000189116 [1,1,0,0,0,0|2,0,0]=4 1681 B13R1.19 O=C(C=CI)Cc1ccc(cc1)Br 1458a_100016256311_100000189115 [1,1,0,0,0,0|2,0,0]=4 1682 B13R1.19 O=C(C=CI)Cc1ccc(cc1)Cl 1458a_100016256311_100000694040 [1,1,0,0,0,0|2,0,0]=4 1683 B13R1.19 O=C(C=CI)Cc1ccc(cc1)F 1458a_100016256311_100000198546 [1,1,0,0,0,0|2,0,0]=4 1684 B13R1.19 O=C(C=CI)Cc1ccc(cc1)I 1458a_100016256311_100000189116 [1,1,0,0,0,0|2,0,0]=4 1685 B13R1.19 O=C(CCF)Cc1ccc(cc1)O 1458a_100000198540_100011217306 [1,1,0,0,0,0|1,0,1]=4 1686 B13R1.19 O=C(CCO)Cc1ccc(cc1)Br 1458a_100000198978_100000211926 [1,1,0,0,0,0|1,0,1]=4 1687 B13R1.19 O=C(CCO)Cc1ccc(cc1)Br 1458a_100011216618_100000189115 [1,1,0,0,0,0|1,0,1]=4 1688 B13R1.19 O=C(CCO)Cc1ccc(cc1)Cl 1458a_100000211027_100000211926 [1,1,0,0,0,0|1,0,1]=4 1689 B13R1.19 O=C(CCO)Cc1ccc(cc1)Cl 1458a_100011216618_100000694040 [1,1,0,0,0,0|1,0,1]=4 1690 B13R1.19 O=C(CCO)Cc1ccc(cc1)F 1458a_100000210951_100000211926 [1,1,0,0,0,0|1,0,1]=4 1691 B13R1.19 O=C(CCO)Cc1ccc(cc1)F 1458a_100011216618_100000198546 [1,1,0,0,0,0|1,0,1]=4 1692 B13R1.19 O=C(CCO)Cc1ccc(cc1)I 1458a_100000688869_100000211926 [1,1,0,0,0,0|1,0,1]=4 1693 B13R1.19 O=C(CCO)Cc1ccc(cc1)I 1458a_100011216618_100000189116 [1,1,0,0,0,0|1,0,1]=4 1694 B13R1.19 O=C(CCO)Cc1ccc(cc1)O 1458a_100000198540_100000211926 [1,1,0,0,0,0|0,0,1]=3 1695 B13R1.19 O=C(CCO)Nc1ccc(cc1)O 22a_100000185829_100011216618 [1,1,0,0,0,0|1,0,1]=4 1696 B13R1.21 C=CC(=O)C(C)c1ccc(cc1)Br 1458a_100000185746_100000755118 [1,1,0,0,0,0|2,0,0]=4 1697 B13R1.21 C=CC(=O)C(C)c1ccc(cc1)C 1458a_100000185746_100011261388 [1,1,0,0,0,0|2,0,0]=4 1698 B13R1.21 C=CC(=O)C(C)c1ccc(cc1)Cl 1458a_100000185746_100000684792 [1,1,0,0,0,0|2,0,0]=4 1699 B13R1.21 C=CC(=O)C(C)c1ccc(cc1)F 1458a_100000185746_100000743420 [1,1,0,0,0,0|2,0,0]=4 1700 B13R1.21 C=CC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000185746 [1,1,0,0,0,0|2,0,0]=4 1701 B13R1.21 CC(C(=O)CF)c1ccc(cc1)O 1458a_100000031422_100015361967 [1,1,0,0,0,0|1,0,1]=4 1702 B13R1.21 CC(C(=O)CO)c1ccc(cc1)Br 1458a_100000210174_100000755118 [1,1,0,0,0,0|1,0,1]=4 1703 B13R1.21 CC(C(=O)CO)c1ccc(cc1)Cl 1458a_100000210174_100000684792 [1,1,0,0,0,0|1,0,1]=4 1704 B13R1.21 CC(C(=O)CO)c1ccc(cc1)F 1458a_100000210174_100000743420 [1,1,0,0,0,0|1,0,1]=4 1705 B13R1.21 CCC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_100000210202 [1,1,0,0,0,0|1,0,1]=4 1706 B13R1.21 CCC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000210202 [1,1,0,0,0,0|1,0,1]=4 1707 B13R1.21 CN(C(=O)CO)c1ccc(cc1)O 22a_100000182112_100000210174 [1,1,0,0,0,0|1,0,1]=4 1708 B13R1.21 CN(C(=O)CO)c1ccc(cc1)O 527a_100000182112_100000210174 [1,1,0,0,0,0|1,0,1]=4 1709 B13R1.21 CNC(=O)C(C)c1ccc(cc1)O 240690a_100102657272_100000031422 [1,1,0,0,0,0|2,0,0]=4 1710 B13R1.21 CNC(=O)C(O)c1ccc(cc1)O 240690a_100102657272_100011215213 [1,1,0,0,0,0|2,0,0]=4 1711 B13R1.21 COC(=O)C(N)c1ccc(cc1)O 271570a_203496583355_100000747369 [1,1,0,0,0,0|2,0,0]=4 1712 B13R1.21 Cc1ccc(cc1)C(C)C(=O)CO 1458a_100000210174_100011261388 [1,1,0,0,0,0|1,0,1]=4 1713 B13R1.21 O=C(CF)C(O)c1ccc(cc1)O 1458a_100011215213_100015361967 [1,1,0,0,0,0|1,0,1]=4 1714 B13R1.145 O=CC(C=O)Nc1ccc(cc1)O 34a_100000185829_100000736813 [1,1,0,0,0,0|1,0,1]=4 1715 B13R1.145 O=CC(C=O)Sc1ccc(cc1)O 62a_100000736813_100000185759 [1,1,0,0,0,0|1,0,1]=4 1716 B13R1.2679 C=CC(=O)Cc1ccc(cc1Br)Br 1458a_100000185746_200012351560 [1,1,0,0,0,0|2,0,0]=4 1717 B13R1.2679 C=CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000185746_100000755608 [1,1,0,0,0,0|2,0,0]=4 1718 B13R1.2679 C=CC(=O)Cc1ccc(cc1Br)F 1458a_100000185746_100000243222 [1,1,0,0,0,0|2,0,0]=4 1719 B13R1.2679 C=CC(=O)Cc1ccc(cc1Br)I 1458a_100000185746_100010146610 [1,1,0,0,0,0|2,0,0]=4 1720 B13R1.2679 C=CC(=O)Cc1ccc(cc1C)Br 1458a_100000185746_100000708836 [1,1,0,0,0,0|2,0,0]=4 1721 B13R1.2679 C=CC(=O)Cc1ccc(cc1C)C 1458a_100000185746_100011219618 [1,1,0,0,0,0|2,0,0]=4 1722 B13R1.2679 C=CC(=O)Cc1ccc(cc1C)Cl 1458a_100000185746_100012361307 [1,1,0,0,0,0|2,0,0]=4 1723 B13R1.2679 C=CC(=O)Cc1ccc(cc1C)F 1458a_100000185746_100000700533 [1,1,0,0,0,0|2,0,0]=4 1724 B13R1.2679 C=CC(=O)Cc1ccc(cc1Cl)Br 1458a_100000185746_100011740631 [1,1,0,0,0,0|2,0,0]=4 1725 B13R1.2679 C=CC(=O)Cc1ccc(cc1Cl)C 1458a_100000185746_100012349684 [1,1,0,0,0,0|2,0,0]=4 1726 B13R1.2679 C=CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000185746_100000188473 [1,1,0,0,0,0|2,0,0]=4 1727 B13R1.2679 C=CC(=O)Cc1ccc(cc1Cl)F 1458a_100000185746_100011216360 [1,1,0,0,0,0|2,0,0]=4 1728 B13R1.2679 C=CC(=O)Cc1ccc(cc1F)Br 1458a_100000185746_100000211606 [1,1,0,0,0,0|2,0,0]=4 1729 B13R1.2679 C=CC(=O)Cc1ccc(cc1F)C 1458a_100000185746_100012002367 [1,1,0,0,0,0|2,0,0]=4 1730 B13R1.2679 C=CC(=O)Cc1ccc(cc1F)Cl 1458a_100000185746_100000709361 [1,1,0,0,0,0|2,0,0]=4 1731 B13R1.2679 C=CC(=O)Cc1ccc(cc1F)F 1458a_100000185746_100000748237 [1,1,0,0,0,0|2,0,0]=4 1732 B13R1.2679 C=CC(=O)Cc1ccc(cc1F)I 1458a_100000185746_100010244991 [1,1,0,0,0,0|2,0,0]=4 1733 B13R1.2679 C=CC(=O)Cc1ccc(cc1I)Br 1458a_100000185746_100010146615 [1,1,0,0,0,0|2,0,0]=4 1734 B13R1.2679 C=CC(=O)Cc1ccc(cc1I)Cl 1458a_100000185746_100010254388 [1,1,0,0,0,0|2,0,0]=4 1735 B13R1.2679 C=CC(=O)Cc1ccc(cc1I)F 1458a_100000185746_100012354799 [1,1,0,0,0,0|2,0,0]=4 1736 B13R1.2679 C=CC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000185746 [1,1,0,0,0,0|2,0,0]=4 1737 B13R1.2679 C=CC(=O)Nc1ccc(cc1C)O 22a_100000756630_100000185746 [1,1,0,0,0,0|2,0,0]=4 1738 B13R1.2679 C=CC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000185746 [1,1,0,0,0,0|2,0,0]=4 1739 B13R1.2679 C=CC(=O)Nc1ccc(cc1F)O 22a_100000759473_100000185746 [1,1,0,0,0,0|2,0,0]=4 1740 B13R1.2679 C=CC(=O)Nc1ccc(cc1I)O 22a_100010084370_100000185746 [1,1,0,0,0,0|2,0,0]=4 1741 B13R1.2679 C=CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000185746 [1,1,0,0,0,0|2,0,0]=4 1742 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100000210202 [1,1,0,0,0,0|1,0,1]=4 1743 B13R1.2679 CCC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100000210202 [1,1,0,0,0,0|1,0,1]=4 1744 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)O 240690a_100102657272_100010176083 [1,1,0,0,0,0|2,0,0]=4 1745 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)O 527a_100102657272_100010176083 [1,1,0,0,0,0|2,0,0]=4 1746 B13R1.2679 CNC(=O)Cc1ccc(cc1F)O 240690a_100102657272_100000090534 [1,1,0,0,0,0|2,0,0]=4 1747 B13R1.2679 CNC(=O)Cc1ccc(cc1F)O 527a_100102657272_100000090534 [1,1,0,0,0,0|2,0,0]=4 1748 B13R1.2679 COC(=O)Cc1ccc(cc1F)O 271570a_203496583355_100013023952 [1,1,0,0,0,0|2,0,0]=4 1749 B13R1.2679 COC(=O)Cc1ccc(cc1O)O 271570a_203496583355_100010150832 [1,1,0,0,0,0|2,0,0]=4 1750 B13R1.2679 Cc1cc(ccc1CC(=O)CO)Br 1458a_100000210174_100000708836 [1,1,0,0,0,0|1,0,1]=4 1751 B13R1.2679 Cc1cc(ccc1CC(=O)CO)Cl 1458a_100000210174_100012361307 [1,1,0,0,0,0|1,0,1]=4 1752 B13R1.2679 Cc1cc(ccc1CC(=O)CO)F 1458a_100000210174_100000700533 [1,1,0,0,0,0|1,0,1]=4 1753 B13R1.2679 Cc1cc(ccc1NC(=O)CO)O 22a_100000756630_100000210174 [1,1,0,0,0,0|1,0,1]=4 1754 B13R1.2679 Cc1cc(ccc1NC(=O)CO)O 527a_100000756630_100000210174 [1,1,0,0,0,0|1,0,1]=4 1755 B13R1.2679 Cc1ccc(c(c1)C)CC(=O)CO 1458a_100000210174_100011219618 [1,1,0,0,0,0|1,0,1]=4 1756 B13R1.2679 Cc1ccc(c(c1)Cl)CC(=O)CO 1458a_100000210174_100012349684 [1,1,0,0,0,0|1,0,1]=4 1757 B13R1.2679 Cc1ccc(c(c1)F)CC(=O)CO 1458a_100000210174_100012002367 [1,1,0,0,0,0|1,0,1]=4 1758 B13R1.2679 O=C(CF)Cc1ccc(cc1Br)O 1458a_100010176083_100015361967 [1,1,0,0,0,0|1,0,1]=4 1759 B13R1.2679 O=C(CF)Cc1ccc(cc1F)O 1458a_100000090534_100015361967 [1,1,0,0,0,0|1,0,1]=4 1760 B13R1.2679 O=C(CO)Cc1ccc(cc1Br)Br 1458a_100000210174_200012351560 [1,1,0,0,0,0|1,0,1]=4 1761 B13R1.2679 O=C(CO)Cc1ccc(cc1Br)Cl 1458a_100000210174_100000755608 [1,1,0,0,0,0|1,0,1]=4 1762 B13R1.2679 O=C(CO)Cc1ccc(cc1Br)F 1458a_100000210174_100000243222 [1,1,0,0,0,0|1,0,1]=4 1763 B13R1.2679 O=C(CO)Cc1ccc(cc1Br)I 1458a_100000210174_100010146610 [1,1,0,0,0,0|1,0,1]=4 1764 B13R1.2679 O=C(CO)Cc1ccc(cc1Cl)Br 1458a_100000210174_100011740631 [1,1,0,0,0,0|1,0,1]=4 1765 B13R1.2679 O=C(CO)Cc1ccc(cc1Cl)Cl 1458a_100000210174_100000188473 [1,1,0,0,0,0|1,0,1]=4 1766 B13R1.2679 O=C(CO)Cc1ccc(cc1Cl)F 1458a_100000210174_100011216360 [1,1,0,0,0,0|1,0,1]=4 1767 B13R1.2679 O=C(CO)Cc1ccc(cc1F)Br 1458a_100000210174_100000211606 [1,1,0,0,0,0|1,0,1]=4 1768 B13R1.2679 O=C(CO)Cc1ccc(cc1F)Cl 1458a_100000210174_100000709361 [1,1,0,0,0,0|1,0,1]=4 1769 B13R1.2679 O=C(CO)Cc1ccc(cc1F)F 1458a_100000210174_100000748237 [1,1,0,0,0,0|1,0,1]=4 1770 B13R1.2679 O=C(CO)Cc1ccc(cc1F)I 1458a_100000210174_100010244991 [1,1,0,0,0,0|1,0,1]=4 1771 B13R1.2679 O=C(CO)Cc1ccc(cc1I)Br 1458a_100000210174_100010146615 [1,1,0,0,0,0|1,0,1]=4 1772 B13R1.2679 O=C(CO)Cc1ccc(cc1I)Cl 1458a_100000210174_100010254388 [1,1,0,0,0,0|1,0,1]=4 1773 B13R1.2679 O=C(CO)Cc1ccc(cc1I)F 1458a_100000210174_100012354799 [1,1,0,0,0,0|1,0,1]=4 1774 B13R1.2679 O=C(CO)Nc1ccc(cc1Br)O 22a_100012001276_100000210174 [1,1,0,0,0,0|1,0,1]=4 1775 B13R1.2679 O=C(CO)Nc1ccc(cc1Br)O 527a_100012001276_100000210174 [1,1,0,0,0,0|1,0,1]=4 1776 B13R1.2679 O=C(CO)Nc1ccc(cc1Cl)O 22a_100011215599_100000210174 [1,1,0,0,0,0|1,0,1]=4 1777 B13R1.2679 O=C(CO)Nc1ccc(cc1Cl)O 527a_100011215599_100000210174 [1,1,0,0,0,0|1,0,1]=4 1778 B13R1.2679 O=C(CO)Nc1ccc(cc1F)O 22a_100000759473_100000210174 [1,1,0,0,0,0|1,0,1]=4 1779 B13R1.2679 O=C(CO)Nc1ccc(cc1F)O 527a_100000759473_100000210174 [1,1,0,0,0,0|1,0,1]=4 1780 B13R1.2679 O=C(CO)Nc1ccc(cc1I)O 22a_100010084370_100000210174 [1,1,0,0,0,0|1,0,1]=4 1781 B13R1.2679 O=C(CO)Nc1ccc(cc1I)O 527a_100010084370_100000210174 [1,1,0,0,0,0|1,0,1]=4 1782 B13R1.2679 O=C(CO)Nc1ccc(cc1O)O 22a_100000106777_100000210174 [1,1,0,0,0,0|1,0,1]=4 1783 B13R1.2679 O=C(CO)Nc1ccc(cc1O)O 527a_100000106777_100000210174 [1,1,0,0,0,0|1,0,1]=4 1784 B13R1.2879 C=CC(=O)Cc1cc(=O)c(co1)O 1458a_100000185746_100000010605 [1,1,0,0,0,0|2,0,0]=4 1785 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000185746_100012353900 [1,1,0,0,0,0|2,0,0]=4 1786 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000185746_100012232412 [1,1,0,0,0,0|2,0,0]=4 1787 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000185746_100012353894 [1,1,0,0,0,0|2,0,0]=4 1788 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000185746_100011206884 [1,1,0,0,0,0|2,0,0]=4 1789 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)C)Br 1458a_100000185746_100000727479 [1,1,0,0,0,0|2,0,0]=4 1790 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)C)C 1458a_100000185746_100000742320 [1,1,0,0,0,0|2,0,0]=4 1791 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000185746_100012184735 [1,1,0,0,0,0|2,0,0]=4 1792 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)C)F 1458a_100000185746_100011216667 [1,1,0,0,0,0|2,0,0]=4 1793 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000185746_100012353895 [1,1,0,0,0,0|2,0,0]=4 1794 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000185746_100011823929 [1,1,0,0,0,0|2,0,0]=4 1795 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000185746_100000184707 [1,1,0,0,0,0|2,0,0]=4 1796 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000185746_100000717365 [1,1,0,0,0,0|2,0,0]=4 1797 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000185746_100012349665 [1,1,0,0,0,0|2,0,0]=4 1798 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000185746_100000767054 [1,1,0,0,0,0|2,0,0]=4 1799 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)F)C 1458a_100000185746_100011217369 [1,1,0,0,0,0|2,0,0]=4 1800 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000185746_100000716492 [1,1,0,0,0,0|2,0,0]=4 1801 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)F)F 1458a_100000185746_100000757363 [1,1,0,0,0,0|2,0,0]=4 1802 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)F)I 1458a_100000185746_100010149604 [1,1,0,0,0,0|2,0,0]=4 1803 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)I)Br 1458a_100000185746_100010146616 [1,1,0,0,0,0|2,0,0]=4 1804 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)I)C 1458a_100000185746_100010206137 [1,1,0,0,0,0|2,0,0]=4 1805 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)I)F 1458a_100000185746_100010188208 [1,1,0,0,0,0|2,0,0]=4 1806 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000185746 [1,1,0,0,0,0|2,0,0]=4 1807 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000185746 [1,1,0,0,0,0|2,0,0]=4 1808 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000185746 [1,1,0,0,0,0|2,0,0]=4 1809 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000185746 [1,1,0,0,0,0|2,0,0]=4 1810 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000185746 [1,1,0,0,0,0|2,0,0]=4 1811 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000210202 [1,1,0,0,0,0|1,0,1]=4 1812 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100000210202 [1,1,0,0,0,0|1,0,1]=4 1813 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000210202 [1,1,0,0,0,0|1,0,1]=4 1814 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100000210202 [1,1,0,0,0,0|1,0,1]=4 1815 B13R1.2879 CCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210202 [1,1,0,0,0,0|1,0,1]=4 1816 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)O 240690a_100102657272_100009990404 [1,1,0,0,0,0|2,0,0]=4 1817 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)O 527a_100102657272_100009990404 [1,1,0,0,0,0|2,0,0]=4 1818 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)O 240690a_100102657272_100000083968 [1,1,0,0,0,0|2,0,0]=4 1819 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)O 527a_100102657272_100000083968 [1,1,0,0,0,0|2,0,0]=4 1820 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)O 240690a_100102657272_100000035197 [1,1,0,0,0,0|2,0,0]=4 1821 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)O 527a_100102657272_100000035197 [1,1,0,0,0,0|2,0,0]=4 1822 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)O 240690a_100102657272_100000039761 [1,1,0,0,0,0|2,0,0]=4 1823 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)O 527a_100102657272_100000039761 [1,1,0,0,0,0|2,0,0]=4 1824 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)O 527a_100102657272_100000031429 [1,1,0,0,0,0|2,0,0]=4 1825 B13R1.2879 COC(=O)Cc1ccc(c(c1)F)O 271570a_203496583355_100010371902 [1,1,0,0,0,0|2,0,0]=4 1826 B13R1.2879 COC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010222482 [1,1,0,0,0,0|2,0,0]=4 1827 B13R1.2879 Cc1cc(ccc1Br)CC(=O)CO 1458a_100000210174_100000727479 [1,1,0,0,0,0|1,0,1]=4 1828 B13R1.2879 Cc1cc(ccc1Cl)CC(=O)CO 1458a_100000210174_100012184735 [1,1,0,0,0,0|1,0,1]=4 1829 B13R1.2879 Cc1cc(ccc1F)CC(=O)CO 1458a_100000210174_100011216667 [1,1,0,0,0,0|1,0,1]=4 1830 B13R1.2879 Cc1cc(ccc1O)CC(=O)CF 1458a_100000083968_100015361967 [1,1,0,0,0,0|1,0,1]=4 1831 B13R1.2879 Cc1cc(ccc1O)NC(=O)CO 22a_100011218179_100000210174 [1,1,0,0,0,0|1,0,1]=4 1832 B13R1.2879 Cc1cc(ccc1O)NC(=O)CO 527a_100011218179_100000210174 [1,1,0,0,0,0|1,0,1]=4 1833 B13R1.2879 Cc1ccc(cc1Br)CC(=O)CO 1458a_100000210174_100012232412 [1,1,0,0,0,0|1,0,1]=4 1834 B13R1.2879 Cc1ccc(cc1C)CC(=O)CO 1458a_100000210174_100000742320 [1,1,0,0,0,0|1,0,1]=4 1835 B13R1.2879 Cc1ccc(cc1Cl)CC(=O)CO 1458a_100000210174_100011823929 [1,1,0,0,0,0|1,0,1]=4 1836 B13R1.2879 Cc1ccc(cc1F)CC(=O)CO 1458a_100000210174_100011217369 [1,1,0,0,0,0|1,0,1]=4 1837 B13R1.2879 Cc1ccc(cc1I)CC(=O)CO 1458a_100000210174_100010206137 [1,1,0,0,0,0|1,0,1]=4 1838 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Br)O 1458a_100009990404_100015361967 [1,1,0,0,0,0|1,0,1]=4 1839 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100015361967 [1,1,0,0,0,0|1,0,1]=4 1840 B13R1.2879 O=C(CF)Cc1ccc(c(c1)F)O 1458a_100000039761_100015361967 [1,1,0,0,0,0|1,0,1]=4 1841 B13R1.2879 O=C(CF)Cc1ccc(c(c1)O)O 1458a_100000031429_100015361967 [1,1,0,0,0,0|1,0,1]=4 1842 B13R1.2879 O=C(CO)Cc1cc(=O)c(co1)O 1458a_100000210174_100000010605 [1,1,0,0,0,0|1,0,1]=4 1843 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Br)Br 1458a_100000210174_100012353900 [1,1,0,0,0,0|1,0,1]=4 1844 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Br)Cl 1458a_100000210174_100012353894 [1,1,0,0,0,0|1,0,1]=4 1845 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Br)F 1458a_100000210174_100011206884 [1,1,0,0,0,0|1,0,1]=4 1846 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Cl)Br 1458a_100000210174_100012353895 [1,1,0,0,0,0|1,0,1]=4 1847 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Cl)Cl 1458a_100000210174_100000184707 [1,1,0,0,0,0|1,0,1]=4 1848 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Cl)F 1458a_100000210174_100000717365 [1,1,0,0,0,0|1,0,1]=4 1849 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Cl)I 1458a_100000210174_100012349665 [1,1,0,0,0,0|1,0,1]=4 1850 B13R1.2879 O=C(CO)Cc1ccc(c(c1)F)Br 1458a_100000210174_100000767054 [1,1,0,0,0,0|1,0,1]=4 1851 B13R1.2879 O=C(CO)Cc1ccc(c(c1)F)Cl 1458a_100000210174_100000716492 [1,1,0,0,0,0|1,0,1]=4 1852 B13R1.2879 O=C(CO)Cc1ccc(c(c1)F)F 1458a_100000210174_100000757363 [1,1,0,0,0,0|1,0,1]=4 1853 B13R1.2879 O=C(CO)Cc1ccc(c(c1)F)I 1458a_100000210174_100010149604 [1,1,0,0,0,0|1,0,1]=4 1854 B13R1.2879 O=C(CO)Cc1ccc(c(c1)I)Br 1458a_100000210174_100010146616 [1,1,0,0,0,0|1,0,1]=4 1855 B13R1.2879 O=C(CO)Cc1ccc(c(c1)I)F 1458a_100000210174_100010188208 [1,1,0,0,0,0|1,0,1]=4 1856 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Br)O 22a_100011534360_100000210174 [1,1,0,0,0,0|1,0,1]=4 1857 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Br)O 527a_100011534360_100000210174 [1,1,0,0,0,0|1,0,1]=4 1858 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000210174 [1,1,0,0,0,0|1,0,1]=4 1859 B13R1.2879 O=C(CO)Nc1ccc(c(c1)F)O 22a_100011220035_100000210174 [1,1,0,0,0,0|1,0,1]=4 1860 B13R1.2879 O=C(CO)Nc1ccc(c(c1)F)O 527a_100011220035_100000210174 [1,1,0,0,0,0|1,0,1]=4 1861 B13R1.2879 O=C(CO)Nc1ccc(c(c1)O)O 22a_100102946323_100000210174 [1,1,0,0,0,0|1,0,1]=4 1862 B13R1.2879 O=C(CO)Nc1ccc(c(c1)O)O 527a_100102946323_100000210174 [1,1,0,0,0,0|1,0,1]=4 1863 B13R1.36 C=Cc1ccc(cc1)C(=O)C(=O)N 271570a_100011290941_200009822167 [0,1,0,0,1,0|2,0,0]=4 1864 B13R1.36 CSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_200000210301 [0,1,0,0,1,0|1,1,0]=4 1865 B13R1.36 [13CH3]Sc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_200025704644 [0,1,0,0,1,0|1,1,0]=4 1866 B15R1.205 C#Cc1ccc(cc1)CNC(=O)C(=O)N 240690a_100015199678_100011215815 [0,1,0,0,0,1|2,0,0]=4 1867 B15R1.205 C#Cc1ccc(cc1)NCC(=O)C(=O)C 34a_100011215031_100011261029 [0,1,0,0,0,1|2,0,0]=4 1868 B15R1.205 C=C(Br)C(=O)NCc1ccc(cc1)OC 11a_100000185587_100009813364 [0,1,0,0,0,1|2,0,0]=4 1869 B15R1.205 C=C(Br)C(=O)NCc1ccc(cc1)OC 1626a_100000185587_100009813364 [0,1,0,0,0,1|2,0,0]=4 1870 B15R1.205 C=C(C)C(=O)CCc1ccc(cc1)OC 1458a_100000185857_100000184700 [0,1,0,0,0,1|2,0,0]=4 1871 B15R1.205 C=C(C)C(=O)NCc1ccc(cc1)OC 11a_100000185587_100000185857 [0,1,0,0,0,1|2,0,0]=4 1872 B15R1.205 C=C(C)C(=O)NCc1ccc(cc1)OC 1626a_100000185587_100000185857 [0,1,0,0,0,1|2,0,0]=4 1873 B15R1.205 C=C(Cl)C(=O)NCc1ccc(cc1)OC 11a_100000185587_100000039160 [0,1,0,0,0,1|2,0,0]=4 1874 B15R1.205 C=C(Cl)C(=O)NCc1ccc(cc1)OC 1626a_100000185587_100000039160 [0,1,0,0,0,1|2,0,0]=4 1875 B15R1.205 C=C(F)C(=O)NCc1ccc(cc1)OC 11a_100000185587_100000036797 [0,1,0,0,0,1|2,0,0]=4 1876 B15R1.205 C=C(F)C(=O)NCc1ccc(cc1)OC 1626a_100000185587_100000036797 [0,1,0,0,0,1|2,0,0]=4 1877 B15R1.205 C=Cc1ccc(cc1)CNC(=O)C(=O)N 240690a_200011934891_100011215815 [0,1,0,0,0,1|2,0,0]=4 1878 B15R1.205 C=Cc1ccc(cc1)NCC(=O)C(=O)C 34a_100011218248_100011261029 [0,1,0,0,0,1|2,0,0]=4 1879 B15R1.205 C=Cc1ccc(cc1)OCC(=O)C(=O)C 34a_100000189437_100011261029 [0,1,0,0,0,1|2,0,0]=4 1880 B15R1.205 C=Cc1ccc(cc1)SCC(=O)C(=O)C 62a_100000748128_100011261029 [0,1,0,0,0,1|2,0,0]=4 1881 B15R1.205 C=Cc1ccc(cc1)SCC(=O)C(=O)C 62a_100011261029_100000748128 [0,1,0,0,0,1|2,0,0]=4 1882 B15R1.205 CC(=O)C(=O)CNc1ccc(cc1)C#N 34a_100000185469_100011261029 [0,1,0,0,0,1|2,0,0]=4 1883 B15R1.205 CC(=O)C(=O)CNc1ccc(cc1)CO 34a_100011215238_100011261029 [0,1,0,0,0,1|1,0,0]=3 1884 B15R1.205 CC(=O)C(=O)COc1ccc(cc1)C#N 34a_100000210344_100011261029 [0,1,0,0,0,1|2,0,0]=4 1885 B15R1.205 CC(=O)C(=O)COc1ccc(cc1)CN 34a_100000185549_100011261029 [0,1,0,0,0,1|2,0,0]=4 1886 B15R1.205 CC(=O)C(=O)COc1ccc(cc1)CO 34a_100000211755_100011261029 [0,1,0,0,0,1|1,0,0]=3 1887 B15R1.205 CC(=O)C(=O)COc1ccc(nc1)CO 34a_103436540053_100011261029 [0,1,0,0,0,1|2,0,0]=4 1888 B15R1.205 CC(=O)C(=O)CSc1ccc(cc1)C#N 62a_100011261029_100000184291 [0,1,0,0,0,1|2,0,0]=4 1889 B15R1.205 CC(=O)C(=O)CSc1ccc(cc1)C=O 62a_100000188517_100011261029 [0,1,0,0,0,1|1,0,1]=4 1890 B15R1.205 CC(=O)C(=O)CSc1ccc(cc1)C=O 62a_100011261029_100000188517 [0,1,0,0,0,1|1,0,1]=4 1891 B15R1.205 CC(=O)C(=O)CSc1ccc(cc1)CF 62a_100010268989_100011261029 [0,1,0,0,0,1|2,0,0]=4 1892 B15R1.205 CC(=O)C(=O)CSc1ccc(cc1)CF 62a_100011261029_100010268989 [0,1,0,0,0,1|2,0,0]=4 1893 B15R1.205 CC(=O)C(=O)CSc1ccc(cc1)CN 62a_100011261029_100016989417 [0,1,0,0,0,1|2,0,0]=4 1894 B15R1.205 CC(=O)C(=O)CSc1ccc(cc1)CN 62a_100016989417_100011261029 [0,1,0,0,0,1|2,0,0]=4 1895 B15R1.205 CC(=O)C(=O)CSc1ccc(cc1)CO 62a_100000690907_100011261029 [0,1,0,0,0,1|1,0,0]=3 1896 B15R1.205 CC(=O)C(=O)CSc1ccc(cc1)CO 62a_100011261029_100000690907 [0,1,0,0,0,1|1,0,0]=3 1897 B15R1.205 CC(=O)C(=O)CSc1ccc(cc1)NN 62a_100011261029_100016988836 [0,1,0,0,0,1|2,0,0]=4 1898 B15R1.205 CC(=O)C(=O)CSc1ccc(cc1)NN 62a_100016988836_100011261029 [0,1,0,0,0,1|2,0,0]=4 1899 B15R1.205 CC(=O)C(=O)CSc1ccc(cn1)CO 62a_100009816760_100011261029 [0,1,0,0,0,1|2,0,0]=4 1900 B15R1.205 CC(=O)C(=O)CSc1ccc(cn1)CO 62a_100011261029_100009816760 [0,1,0,0,0,1|2,0,0]=4 1901 B15R1.205 CC(=O)C(=O)CSc1ccc(nc1)CO 62a_100000754261_100011261029 [0,1,0,0,0,1|2,0,0]=4 1902 B15R1.205 CC(=O)C(=O)CSc1ccc(nc1)CO 62a_100011261029_100000754261 [0,1,0,0,0,1|2,0,0]=4 1903 B15R1.205 CCc1ccc(cc1)CNC(=O)C(=O)N 240690a_100000721222_100011215815 [0,1,0,0,0,1|2,0,0]=4 1904 B15R1.205 CCc1ccc(cc1)NCC(=O)C(=O)C 34a_100000211069_100011261029 [0,1,0,0,0,1|2,0,0]=4 1905 B15R1.205 CCc1ccc(cc1)OCC(=O)C(=O)C 34a_100000211359_100011261029 [0,1,0,0,0,1|2,0,0]=4 1906 B15R1.205 CCc1ccc(cc1)SCC(=O)C(=O)C 62a_100011215824_100011261029 [0,1,0,0,0,1|2,0,0]=4 1907 B15R1.205 CCc1ccc(cc1)SCC(=O)C(=O)C 62a_100011261029_100011215824 [0,1,0,0,0,1|2,0,0]=4 1908 B15R1.205 CNc1ccc(cc1)OCC(=O)C(=O)C 34a_100000182112_100011261029 [0,1,0,0,0,1|2,0,0]=4 1909 B15R1.205 CNc1ccc(cc1)SCC(=O)C(=O)C 62a_100000743151_100011261029 [0,1,0,0,0,1|2,0,0]=4 1910 B15R1.205 CNc1ccc(cc1)SCC(=O)C(=O)C 62a_100011261029_100000743151 [0,1,0,0,0,1|2,0,0]=4 1911 B15R1.205 COc1ccc(cc1)CCC(=O)C(O)O 1458a_100000233687_100000184700 [0,1,0,0,0,1|0,0,2]=4 1912 B15R1.205 COc1ccc(cc1)CCC(=O)[C@@H](C)O 1458a_100000717761_100000184700 [0,1,0,0,0,1|1,0,1]=4 1913 B15R1.205 COc1ccc(cc1)CCC(=O)[C@H](C)O 1458a_217856618621_100000184700 [0,1,0,0,0,1|1,0,1]=4 1914 B15R1.205 COc1ccc(cc1)CNC(=O)C(=O)N 240690a_100000185587_100011215815 [0,1,0,0,0,1|1,0,0]=3 1915 B15R1.205 COc1ccc(cc1)CNC(=O)C(O)O 240690a_100000185587_100000233687 [0,1,0,0,0,1|0,0,2]=4 1916 B15R1.205 COc1ccc(cc1)CNC(=O)[C@@H](C)O 240690a_100000185587_100000717761 [0,1,0,0,0,1|1,0,1]=4 1917 B15R1.205 COc1ccc(cc1)CNC(=O)[C@H](C)O 1626a_100000185587_217856618621 [0,1,0,0,0,1|1,0,1]=4 1918 B15R1.205 COc1ccc(cc1)CNC(=O)[C@H](C)O 240690a_100000185587_217856618621 [0,1,0,0,0,1|1,0,1]=4 1919 B15R1.205 COc1ccc(cc1)CN[C@@H](C)C(=O)O 269956a_100000743915_100000742318 [0,1,0,0,0,1|1,0,1]=4 1920 B15R1.205 COc1ccc(cc1)NCC(=O)C(=O)C 34a_100000184247_100011261029 [0,1,0,0,0,1|1,0,0]=3 1921 B15R1.205 COc1ccc(cc1)NNC(=O)C(=O)N 22a_100000005221_100011215815 [0,1,0,0,0,1|2,0,0]=4 1922 B15R1.205 COc1ccc(cc1)OCC(=O)C(=O)C 34a_100000210503_100011261029 [0,1,0,0,0,1|1,0,0]=3 1923 B15R1.205 COc1ccc(cc1)SCC(=O)C(=O)C 62a_100011261029_100000171711 [0,1,0,0,0,1|1,0,0]=3 1924 B15R1.205 COc1ccc(cn1)CNC(=O)C(=O)N 240690a_100000241975_100011215815 [0,1,0,0,0,1|2,0,0]=4 1925 B15R1.205 COc1ccc(cn1)OCC(=O)C(=O)C 34a_100011934560_100011261029 [0,1,0,0,0,1|2,0,0]=4 1926 B15R1.205 COc1ccc(cn1)SCC(=O)C(=O)C 62a_100000047065_100011261029 [0,1,0,0,0,1|2,0,0]=4 1927 B15R1.205 COc1ccc(cn1)SCC(=O)C(=O)C 62a_100011261029_100000047065 [0,1,0,0,0,1|2,0,0]=4 1928 B15R1.205 COc1ccc(nc1)CNC(=O)C(=O)N 240690a_100000703904_100011215815 [0,1,0,0,0,1|2,0,0]=4 1929 B15R1.205 COc1ccc(nc1)OCC(=O)C(=O)C 34a_100012002028_100011261029 [0,1,0,0,0,1|2,0,0]=4 1930 B15R1.205 COc1ccc(nc1)SCC(=O)C(=O)C 62a_100000755202_100011261029 [0,1,0,0,0,1|2,0,0]=4 1931 B15R1.205 COc1ccc(nc1)SCC(=O)C(=O)C 62a_100011261029_100000744180 [0,1,0,0,0,1|2,0,0]=4 1932 B15R1.205 CSc1ccc(cc1)CNC(=O)C(=O)N 240690a_100000174980_100011215815 [0,1,0,0,0,1|1,1,0]=4 1933 B15R1.205 CSc1ccc(cc1)NCC(=O)C(=O)C 34a_100000212337_100011261029 [0,1,0,0,0,1|1,1,0]=4 1934 B15R1.205 CSc1ccc(cc1)OCC(=O)C(=O)C 34a_100000211864_100011261029 [0,1,0,0,0,1|1,1,0]=4 1935 B15R1.205 CSc1ccc(cc1)SCC(=O)C(=O)C 62a_100011261029_100011263217 [0,1,0,0,0,1|1,1,0]=4 1936 B15R1.205 CSc1ccc(cc1)SCC(=O)C(=O)C 62a_100011263217_100011261029 [0,1,0,0,0,1|1,1,0]=4 1937 B15R1.205 C[C@@H](O)C(=O)NCc1ccc(cc1)CO 240690a_100015189231_100000717761 [0,1,0,0,0,1|1,0,1]=4 1938 B15R1.205 C[C@H](NCc1ccc(cc1)CO)C(=O)O 269956a_100000743915_100000067286 [0,1,0,0,0,1|1,0,1]=4 1939 B15R1.205 C[C@H](O)C(=O)NCc1ccc(cc1)CO 240690a_100015189231_217856618621 [0,1,0,0,0,1|1,0,1]=4 1940 B15R1.205 N#Cc1ccc(cc1)CNC(=O)C(=O)N 240690a_100015207190_100011215815 [0,1,0,0,0,1|2,0,0]=4 1941 B15R1.205 NC(=O)C(=O)NCc1ccc(cc1)CO 240690a_100015189231_100011215815 [0,1,0,0,0,1|1,0,0]=3 1942 B15R1.205 NC(=O)C(=O)NN=C1C=CC(=NO)C=C1 4a_100000211141_200000095120 [0,1,0,0,0,1|2,0,0]=4 1943 B15R1.205 O=C(NCc1ccc(cc1)CO)C(O)O 240690a_100015189231_100000233687 [0,1,0,0,0,1|0,0,2]=4 1944 B15R1.881 C=C(C)C(=O)CC(=O)c1ccc(cc1)O 1458a_100000185857_100009814261 [0,1,0,0,0,1|2,0,0]=4 1945 B15R1.881 CC(=O)C(=O)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100011261029 [0,1,0,0,0,1|2,0,0]=4 1946 B15R1.881 CC(=O)C(=O)CC(=O)c1ccc(cc1)C 1458a_100000188618_100011261029 [0,1,0,0,0,1|2,0,0]=4 1947 B15R1.881 CC(=O)C(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011261029 [0,1,0,0,0,1|2,0,0]=4 1948 B15R1.881 CC(=O)C(=O)CC(=O)c1ccc(cc1)F 1458a_100000187176_100011261029 [0,1,0,0,0,1|2,0,0]=4 1949 B15R1.881 CC(=O)C(=O)CC(=O)c1ccc(cc1)I 1458a_100000187904_100011261029 [0,1,0,0,0,1|2,0,0]=4 1950 B15R1.881 CC(=O)C(=O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100011261029 [0,1,0,0,0,1|1,0,0]=3 1951 B15R1.881 CC(=O)C(=O)CN(C)c1ccc(cc1)Br 269982a_100000219623_100011261029 [0,1,0,0,0,1|2,0,0]=4 1952 B15R1.881 CC(=O)C(=O)CN(C)c1ccc(cc1)Br 34a_100000219623_100011261029 [0,1,0,0,0,1|2,0,0]=4 1953 B15R1.881 CC(=O)C(=O)CN(C)c1ccc(cc1)C 269982a_100000219977_100011261029 [0,1,0,0,0,1|2,0,0]=4 1954 B15R1.881 CC(=O)C(=O)CN(C)c1ccc(cc1)C 34a_100000219977_100011261029 [0,1,0,0,0,1|2,0,0]=4 1955 B15R1.881 CC(=O)C(=O)CN(C)c1ccc(cc1)Cl 269982a_100020629279_100011261029 [0,1,0,0,0,1|2,0,0]=4 1956 B15R1.881 CC(=O)C(=O)CN(C)c1ccc(cc1)Cl 34a_100020629279_100011261029 [0,1,0,0,0,1|2,0,0]=4 1957 B15R1.881 CC(=O)C(=O)CN(C)c1ccc(cc1)F 269982a_100000219829_100011261029 [0,1,0,0,0,1|2,0,0]=4 1958 B15R1.881 CC(=O)C(=O)CN(C)c1ccc(cc1)F 34a_100000219829_100011261029 [0,1,0,0,0,1|2,0,0]=4 1959 B15R1.881 CC(=O)C(=O)CN(C)c1ccc(cc1)I 269982a_100000743151_100011261029 [0,1,0,0,0,1|2,0,0]=4 1960 B15R1.881 CC(=O)C(=O)CN(C)c1ccc(cc1)I 34a_100000743151_100011261029 [0,1,0,0,0,1|2,0,0]=4 1961 B15R1.881 CC(=O)C(=O)CN(C)c1ccc(cc1)O 269982a_100000182112_100011261029 [0,1,0,0,0,1|1,0,0]=3 1962 B15R1.881 CC(=O)C(=O)CN(C)c1ccc(cc1)O 34a_100000182112_100011261029 [0,1,0,0,0,1|1,0,0]=3 1963 B15R1.881 C[C@@H](NC(=O)C(=O)N)c1ccc(cc1)Br 240690a_100000720352_100011215815 [0,1,0,0,0,1|2,0,0]=4 1964 B15R1.881 C[C@@H](NC(=O)C(=O)N)c1ccc(cc1)Cl 240690a_100015205461_100011215815 [0,1,0,0,0,1|2,0,0]=4 1965 B15R1.881 C[C@@H](O)C(=O)CC(=O)c1ccc(cc1)O 1458a_100000717761_100009814261 [0,1,0,0,0,1|1,0,1]=4 1966 B15R1.881 C[C@H](NC(=O)C(=O)N)c1ccc(cc1)F 240690a_100025705893_100011215815 [0,1,0,0,0,1|2,0,0]=4 1967 B15R1.881 C[C@H](NC(=O)C(=O)N)c1ccc(cc1)I 240690a_100000753911_100011215815 [0,1,0,0,0,1|2,0,0]=4 1968 B15R1.881 C[C@H](NC(=O)C(=O)N)c1ccc(cc1)O 240690a_100161106496_100011215815 [0,1,0,0,0,1|1,0,0]=3 1969 B15R1.881 C[C@H](NC(=O)C(O)O)c1ccc(cc1)O 240690a_100161106496_100000233687 [0,1,0,0,0,1|0,0,2]=4 1970 B15R1.881 C[C@H](NC(=O)[C@@H](C)O)c1ccc(cc1)O 240690a_100161106496_100000717761 [0,1,0,0,0,1|1,0,1]=4 1971 B15R1.881 C[C@H](O)C(=O)CC(=O)c1ccc(cc1)O 1458a_217856618621_100009814261 [0,1,0,0,0,1|1,0,1]=4 1972 B15R1.881 C[C@H](O)C(=O)N[C@@H](C)c1ccc(cc1)O 240690a_100161106496_217856618621 [0,1,0,0,0,1|1,0,1]=4 1973 B15R1.881 Cc1ccc(cc1)[C@@H](C)NC(=O)C(=O)N 240690a_100016988085_100011215815 [0,1,0,0,0,1|2,0,0]=4 1974 B15R1.881 O=C(CC(=O)C(O)O)c1ccc(cc1)O 1458a_100000233687_100009814261 [0,1,0,0,0,1|0,0,2]=4 1975 B15R1.884 C=C(C)C(=O)CCc1ccc(c(c1)O)O 1458a_100000185857_200010393615 [0,1,0,0,0,1|2,0,0]=4 1976 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)Br)Br 34a_100011306057_100011261029 [0,1,0,0,0,1|2,0,0]=4 1977 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)Br)C 34a_100000736455_100011261029 [0,1,0,0,0,1|2,0,0]=4 1978 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)Br)Cl 34a_100000686031_100011261029 [0,1,0,0,0,1|2,0,0]=4 1979 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)Br)F 34a_100000760356_100011261029 [0,1,0,0,0,1|2,0,0]=4 1980 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)Br)I 34a_100000750458_100011261029 [0,1,0,0,0,1|2,0,0]=4 1981 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)Br)O 34a_100011534360_100011261029 [0,1,0,0,0,1|1,0,0]=3 1982 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)C)Br 34a_100000210723_100011261029 [0,1,0,0,0,1|2,0,0]=4 1983 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)C)C 34a_100000724040_100011261029 [0,1,0,0,0,1|2,0,0]=4 1984 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)C)Cl 34a_100000187808_100011261029 [0,1,0,0,0,1|2,0,0]=4 1985 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)C)F 34a_100000750164_100011261029 [0,1,0,0,0,1|2,0,0]=4 1986 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)C)I 34a_100000198070_100011261029 [0,1,0,0,0,1|2,0,0]=4 1987 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)C)O 34a_100011218179_100011261029 [0,1,0,0,0,1|1,0,0]=3 1988 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)Cl)Br 34a_100000687081_100011261029 [0,1,0,0,0,1|2,0,0]=4 1989 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)Cl)C 34a_100000188892_100011261029 [0,1,0,0,0,1|2,0,0]=4 1990 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)Cl)Cl 34a_100000184108_100011261029 [0,1,0,0,0,1|2,0,0]=4 1991 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)Cl)F 34a_100000211060_100011261029 [0,1,0,0,0,1|2,0,0]=4 1992 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)Cl)I 34a_100000761885_100011261029 [0,1,0,0,0,1|2,0,0]=4 1993 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)Cl)O 34a_100000744943_100011261029 [0,1,0,0,0,1|1,0,0]=3 1994 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)F)Br 34a_100000759894_100011261029 [0,1,0,0,0,1|2,0,0]=4 1995 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)F)C 34a_100000210958_100011261029 [0,1,0,0,0,1|2,0,0]=4 1996 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)F)Cl 34a_100000739366_100011261029 [0,1,0,0,0,1|2,0,0]=4 1997 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)F)F 34a_100000210724_100011261029 [0,1,0,0,0,1|2,0,0]=4 1998 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)F)I 34a_100011356925_100011261029 [0,1,0,0,0,1|2,0,0]=4 1999 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)F)O 34a_100011220035_100011261029 [0,1,0,0,0,1|1,0,0]=3 2000 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)I)Br 34a_100000750459_100011261029 [0,1,0,0,0,1|2,0,0]=4 2001 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)I)C 34a_100000184131_100011261029 [0,1,0,0,0,1|2,0,0]=4 2002 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)I)Cl 34a_100012360549_100011261029 [0,1,0,0,0,1|2,0,0]=4 2003 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)I)F 34a_114828291077_100011261029 [0,1,0,0,0,1|2,0,0]=4 2004 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)O)C 34a_100000759471_100011261029 [0,1,0,0,0,1|2,0,0]=4 2005 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)O)Cl 34a_100011934209_100011261029 [0,1,0,0,0,1|2,0,0]=4 2006 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)O)F 34a_100012017398_100011261029 [0,1,0,0,0,1|2,0,0]=4 2007 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100011261029 [0,1,0,0,0,1|1,0,0]=3 2008 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)Br)C 34a_100011380479_100011261029 [0,1,0,0,0,1|2,0,0]=4 2009 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)Br)Cl 34a_100011933957_100011261029 [0,1,0,0,0,1|2,0,0]=4 2010 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)Br)F 34a_100000693481_100011261029 [0,1,0,0,0,1|2,0,0]=4 2011 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)Br)I 34a_100000701344_100011261029 [0,1,0,0,0,1|2,0,0]=4 2012 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)Br)N 34a_100012001276_100011261029 [0,1,0,0,0,1|2,0,0]=4 2013 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)C)Br 34a_100000690111_100011261029 [0,1,0,0,0,1|2,0,0]=4 2014 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)C)C 34a_100000210932_100011261029 [0,1,0,0,0,1|2,0,0]=4 2015 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)C)Cl 34a_100000211092_100011261029 [0,1,0,0,0,1|2,0,0]=4 2016 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)C)F 34a_100000751312_100011261029 [0,1,0,0,0,1|2,0,0]=4 2017 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)C)I 34a_100000729255_100011261029 [0,1,0,0,0,1|2,0,0]=4 2018 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)C)N 34a_100000756630_100011261029 [0,1,0,0,0,1|2,0,0]=4 2019 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)Cl)Br 34a_100011215161_100011261029 [0,1,0,0,0,1|2,0,0]=4 2020 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)Cl)C 34a_100011265682_100011261029 [0,1,0,0,0,1|2,0,0]=4 2021 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)Cl)Cl 34a_100000211054_100011261029 [0,1,0,0,0,1|2,0,0]=4 2022 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)Cl)F 34a_100000211030_100011261029 [0,1,0,0,0,1|2,0,0]=4 2023 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)Cl)I 34a_100000047559_100011261029 [0,1,0,0,0,1|2,0,0]=4 2024 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)Cl)N 34a_100011215599_100011261029 [0,1,0,0,0,1|2,0,0]=4 2025 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)F)Br 34a_100000755031_100011261029 [0,1,0,0,0,1|2,0,0]=4 2026 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)F)C 34a_100000722560_100011261029 [0,1,0,0,0,1|2,0,0]=4 2027 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)F)Cl 34a_100000691581_100011261029 [0,1,0,0,0,1|2,0,0]=4 2028 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)F)F 34a_100000181275_100011261029 [0,1,0,0,0,1|2,0,0]=4 2029 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)F)I 34a_100009990212_100011261029 [0,1,0,0,0,1|2,0,0]=4 2030 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)F)N 34a_100000759473_100011261029 [0,1,0,0,0,1|2,0,0]=4 2031 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)I)Br 34a_100012339312_100011261029 [0,1,0,0,0,1|2,0,0]=4 2032 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)I)Cl 34a_100000049588_100011261029 [0,1,0,0,0,1|2,0,0]=4 2033 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)I)N 34a_100010084370_100011261029 [0,1,0,0,0,1|2,0,0]=4 2034 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)N)Br 34a_100011999798_100011261029 [0,1,0,0,0,1|2,0,0]=4 2035 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)N)C 34a_100011216113_100011261029 [0,1,0,0,0,1|2,0,0]=4 2036 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)N)Cl 34a_100011934297_100011261029 [0,1,0,0,0,1|2,0,0]=4 2037 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)N)F 34a_100012017239_100011261029 [0,1,0,0,0,1|2,0,0]=4 2038 B15R1.884 CC(=O)C(=O)COc1ccc(c(c1)N)N 34a_100025771000_100011261029 [0,1,0,0,0,1|2,0,0]=4 2039 B15R1.884 CC(=O)C(=O)CSc1cc(c(cn1)O)C 62a_100011261029_100000692680 [0,1,0,0,0,1|2,0,0]=4 2040 B15R1.884 CC(=O)C(=O)CSc1cc(c(cn1)O)N 62a_100009819941_100011261029 [0,1,0,0,0,1|2,0,0]=4 2041 B15R1.884 CC(=O)C(=O)CSc1cc(c(cn1)O)N 62a_100011261029_100009819941 [0,1,0,0,0,1|2,0,0]=4 2042 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Br)Br 62a_100011261029_100012356285 [0,1,0,0,0,1|2,0,0]=4 2043 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Br)Br 62a_100012356285_100011261029 [0,1,0,0,0,1|2,0,0]=4 2044 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Br)C 62a_100011261029_100011847877 [0,1,0,0,0,1|2,0,0]=4 2045 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Br)C 62a_100011847877_100011261029 [0,1,0,0,0,1|2,0,0]=4 2046 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Br)Cl 62a_100011261029_100012353702 [0,1,0,0,0,1|2,0,0]=4 2047 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Br)Cl 62a_100012353702_100011261029 [0,1,0,0,0,1|2,0,0]=4 2048 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Br)F 62a_100011261029_100012047266 [0,1,0,0,0,1|2,0,0]=4 2049 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Br)F 62a_100012047266_100011261029 [0,1,0,0,0,1|2,0,0]=4 2050 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Br)N 62a_100000750455_100011261029 [0,1,0,0,0,1|2,0,0]=4 2051 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Br)N 62a_100011261029_100000750455 [0,1,0,0,0,1|2,0,0]=4 2052 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Br)O 62a_100011261029_100012361655 [0,1,0,0,0,1|1,0,0]=3 2053 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Br)O 62a_100012361655_100011261029 [0,1,0,0,0,1|1,0,0]=3 2054 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)C)Br 62a_100009813585_100011261029 [0,1,0,0,0,1|2,0,0]=4 2055 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)C)Br 62a_100011261029_100009813585 [0,1,0,0,0,1|2,0,0]=4 2056 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)C)C 62a_100011215607_100011261029 [0,1,0,0,0,1|2,0,0]=4 2057 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)C)C 62a_100011261029_100011215607 [0,1,0,0,0,1|2,0,0]=4 2058 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)C)Cl 62a_100000049509_100011261029 [0,1,0,0,0,1|2,0,0]=4 2059 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)C)Cl 62a_100011261029_100000049509 [0,1,0,0,0,1|2,0,0]=4 2060 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)C)F 62a_100011218330_100011261029 [0,1,0,0,0,1|2,0,0]=4 2061 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)C)F 62a_100011261029_100011218330 [0,1,0,0,0,1|2,0,0]=4 2062 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)C)N 62a_100000211769_100011261029 [0,1,0,0,0,1|2,0,0]=4 2063 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)C)N 62a_100011261029_100000211769 [0,1,0,0,0,1|2,0,0]=4 2064 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)C)O 62a_100011261029_100000186361 [0,1,0,0,0,1|1,0,0]=3 2065 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Cl)Br 62a_100011261029_100012047281 [0,1,0,0,0,1|2,0,0]=4 2066 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Cl)Br 62a_100012047281_100011261029 [0,1,0,0,0,1|2,0,0]=4 2067 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Cl)C 62a_100011216363_100011261029 [0,1,0,0,0,1|2,0,0]=4 2068 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Cl)C 62a_100011261029_100011216363 [0,1,0,0,0,1|2,0,0]=4 2069 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Cl)Cl 62a_100011214914_100011261029 [0,1,0,0,0,1|2,0,0]=4 2070 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Cl)Cl 62a_100011261029_100011214914 [0,1,0,0,0,1|2,0,0]=4 2071 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Cl)F 62a_100011215976_100011261029 [0,1,0,0,0,1|2,0,0]=4 2072 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Cl)F 62a_100011261029_100011215976 [0,1,0,0,0,1|2,0,0]=4 2073 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Cl)N 62a_100011218065_100011261029 [0,1,0,0,0,1|2,0,0]=4 2074 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Cl)N 62a_100011261029_100011218065 [0,1,0,0,0,1|2,0,0]=4 2075 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Cl)O 62a_100011261029_100012360047 [0,1,0,0,0,1|1,0,0]=3 2076 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100011261029 [0,1,0,0,0,1|1,0,0]=3 2077 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)F)Br 62a_100000685389_100011261029 [0,1,0,0,0,1|2,0,0]=4 2078 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)F)Br 62a_100011261029_100000685389 [0,1,0,0,0,1|2,0,0]=4 2079 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)F)C 62a_100000720648_100011261029 [0,1,0,0,0,1|2,0,0]=4 2080 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)F)C 62a_100011261029_100000720648 [0,1,0,0,0,1|2,0,0]=4 2081 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)F)Cl 62a_100011216805_100011261029 [0,1,0,0,0,1|2,0,0]=4 2082 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)F)Cl 62a_100011261029_100011216805 [0,1,0,0,0,1|2,0,0]=4 2083 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)F)F 62a_100000703953_100011261029 [0,1,0,0,0,1|2,0,0]=4 2084 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)F)F 62a_100011261029_100000703953 [0,1,0,0,0,1|2,0,0]=4 2085 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)F)N 62a_100011215594_100011261029 [0,1,0,0,0,1|2,0,0]=4 2086 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)F)N 62a_100011261029_100011215594 [0,1,0,0,0,1|2,0,0]=4 2087 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)F)O 62a_100000185481_100011261029 [0,1,0,0,0,1|1,0,0]=3 2088 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)F)O 62a_100011261029_100000185481 [0,1,0,0,0,1|1,0,0]=3 2089 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)N)Br 62a_100000750456_100011261029 [0,1,0,0,0,1|2,0,0]=4 2090 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)N)Br 62a_100011261029_100000750456 [0,1,0,0,0,1|2,0,0]=4 2091 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)N)C 62a_100000761890_100011261029 [0,1,0,0,0,1|2,0,0]=4 2092 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)N)C 62a_100011261029_100000761890 [0,1,0,0,0,1|2,0,0]=4 2093 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)N)Cl 62a_100011261029_200000761891 [0,1,0,0,0,1|2,0,0]=4 2094 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)N)Cl 62a_200000761891_100011261029 [0,1,0,0,0,1|2,0,0]=4 2095 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)N)F 62a_100000740924_100011261029 [0,1,0,0,0,1|2,0,0]=4 2096 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)N)F 62a_100011261029_100000740924 [0,1,0,0,0,1|2,0,0]=4 2097 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)N)N 62a_100000741789_100011261029 [0,1,0,0,0,1|2,0,0]=4 2098 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)N)N 62a_100011261029_100011534411 [0,1,0,0,0,1|2,0,0]=4 2099 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)N)O 62a_100000752626_100011261029 [0,1,0,0,0,1|1,0,0]=3 2100 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)N)O 62a_100011261029_100000752626 [0,1,0,0,0,1|1,0,0]=3 2101 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)O)Br 62a_100011261029_100012356990 [0,1,0,0,0,1|2,0,0]=4 2102 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)O)Br 62a_100012356990_100011261029 [0,1,0,0,0,1|2,0,0]=4 2103 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)O)C 62a_100000685420_100011261029 [0,1,0,0,0,1|2,0,0]=4 2104 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)O)C 62a_100011261029_100000685420 [0,1,0,0,0,1|2,0,0]=4 2105 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)O)Cl 62a_100011261029_100011356854 [0,1,0,0,0,1|2,0,0]=4 2106 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100011261029 [0,1,0,0,0,1|2,0,0]=4 2107 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)O)F 62a_100000686035_100011261029 [0,1,0,0,0,1|2,0,0]=4 2108 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)O)F 62a_100011261029_100000686035 [0,1,0,0,0,1|2,0,0]=4 2109 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)O)N 62a_100000739049_100011261029 [0,1,0,0,0,1|2,0,0]=4 2110 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)O)N 62a_100011261029_100000739049 [0,1,0,0,0,1|2,0,0]=4 2111 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)O)O 62a_100011261029_100009813601 [0,1,0,0,0,1|1,0,0]=3 2112 B15R1.884 CC(=O)C(=O)CSc1ccc(c(n1)Br)O 62a_100000725334_100011261029 [0,1,0,0,0,1|2,0,0]=4 2113 B15R1.884 CC(=O)C(=O)CSc1ccc(c(n1)Br)O 62a_100011261029_100000725334 [0,1,0,0,0,1|2,0,0]=4 2114 B15R1.884 CC(=O)C(=O)CSc1ccc(c(n1)C)O 62a_100010233687_100011261029 [0,1,0,0,0,1|2,0,0]=4 2115 B15R1.884 CC(=O)C(=O)CSc1ccc(c(n1)C)O 62a_100011261029_100010233687 [0,1,0,0,0,1|2,0,0]=4 2116 B15R1.884 CC(=O)C(=O)CSc1ccc(c(n1)Cl)O 62a_100011261029_100000721234 [0,1,0,0,0,1|2,0,0]=4 2117 B15R1.884 CC(=O)C(=O)CSc1ccc(c(n1)F)O 62a_100009819667_100011261029 [0,1,0,0,0,1|2,0,0]=4 2118 B15R1.884 CC(=O)C(=O)CSc1ccc(c(n1)F)O 62a_100011261029_100009819667 [0,1,0,0,0,1|2,0,0]=4 2119 B15R1.884 CC(=O)C(=O)CSc1ccc(c(n1)N)O 62a_100000685527_100011261029 [0,1,0,0,0,1|2,0,0]=4 2120 B15R1.884 CC(=O)C(=O)CSc1ccc(c(n1)N)O 62a_100011261029_100000685527 [0,1,0,0,0,1|2,0,0]=4 2121 B15R1.884 CC(=O)C(=O)CSc1cnc(c(c1)C)O 62a_100000685391_100011261029 [0,1,0,0,0,1|2,0,0]=4 2122 B15R1.884 CC(=O)C(=O)CSc1cnc(c(c1)C)O 62a_100011261029_100000685391 [0,1,0,0,0,1|2,0,0]=4 2123 B15R1.884 CC(=O)C(=O)CSc1cnc(c(c1)Cl)O 62a_100010238531_100011261029 [0,1,0,0,0,1|2,0,0]=4 2124 B15R1.884 CC(=O)C(=O)CSc1cnc(c(c1)Cl)O 62a_100011261029_100010238531 [0,1,0,0,0,1|2,0,0]=4 2125 B15R1.884 CC(=O)C(=O)CSc1cnc(c(c1)N)O 62a_100000743729_100011261029 [0,1,0,0,0,1|2,0,0]=4 2126 B15R1.884 CC(=O)C(=O)CSc1cnc(c(c1)N)O 62a_100011261029_100000743729 [0,1,0,0,0,1|2,0,0]=4 2127 B15R1.884 C[C@@H](O)C(=O)CCc1ccc(c(c1)O)O 1458a_100000717761_200010393615 [0,1,0,0,0,1|1,0,1]=4 2128 B15R1.884 C[C@@H](O)C(=O)NCc1ccc(c(c1)F)O 240690a_100000758358_100000717761 [0,1,0,0,0,1|1,0,1]=4 2129 B15R1.884 C[C@@H](O)C(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100000717761 [0,1,0,0,0,1|1,0,1]=4 2130 B15R1.884 C[C@H](O)C(=O)CCc1ccc(c(c1)O)O 1458a_217856618621_200010393615 [0,1,0,0,0,1|1,0,1]=4 2131 B15R1.884 C[C@H](O)C(=O)NCc1ccc(c(c1)F)O 240690a_100000758358_217856618621 [0,1,0,0,0,1|1,0,1]=4 2132 B15R1.884 C[C@H](O)C(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_217856618621 [0,1,0,0,0,1|1,0,1]=4 2133 B15R1.884 Cc1cc(ccc1Br)CNC(=O)C(=O)N 240690a_100015205234_100011215815 [0,1,0,0,0,1|2,0,0]=4 2134 B15R1.884 Cc1cc(ccc1F)CNC(=O)C(=O)N 240690a_100000239911_100011215815 [0,1,0,0,0,1|2,0,0]=4 2135 B15R1.884 Cc1ccc(cc1C)CNC(=O)C(=O)N 240690a_100025706692_100011215815 [0,1,0,0,0,1|2,0,0]=4 2136 B15R1.884 Cc1ccc(cc1Cl)CNC(=O)C(=O)N 240690a_102495364989_100011215815 [0,1,0,0,0,1|2,0,0]=4 2137 B15R1.884 Cc1ccc(cc1F)CNC(=O)C(=O)N 240690a_100102708794_100011215815 [0,1,0,0,0,1|2,0,0]=4 2138 B15R1.884 NC(=O)C(=O)NCc1ccc(c(c1)Br)Br 240690a_100012351559_100011215815 [0,1,0,0,0,1|2,0,0]=4 2139 B15R1.884 NC(=O)C(=O)NCc1ccc(c(c1)Br)Cl 240690a_100012349490_100011215815 [0,1,0,0,0,1|2,0,0]=4 2140 B15R1.884 NC(=O)C(=O)NCc1ccc(c(c1)Br)F 240690a_100015193890_100011215815 [0,1,0,0,0,1|2,0,0]=4 2141 B15R1.884 NC(=O)C(=O)NCc1ccc(c(c1)Cl)Br 240690a_100012362553_100011215815 [0,1,0,0,0,1|2,0,0]=4 2142 B15R1.884 NC(=O)C(=O)NCc1ccc(c(c1)Cl)Cl 240690a_100000174881_100011215815 [0,1,0,0,0,1|2,0,0]=4 2143 B15R1.884 NC(=O)C(=O)NCc1ccc(c(c1)Cl)F 240690a_100000749334_100011215815 [0,1,0,0,0,1|2,0,0]=4 2144 B15R1.884 NC(=O)C(=O)NCc1ccc(c(c1)F)Br 240690a_100000755036_100011215815 [0,1,0,0,0,1|2,0,0]=4 2145 B15R1.884 NC(=O)C(=O)NCc1ccc(c(c1)F)Cl 240690a_100011219866_100011215815 [0,1,0,0,0,1|2,0,0]=4 2146 B15R1.884 NC(=O)C(=O)NCc1ccc(c(c1)F)F 240690a_100000737897_100011215815 [0,1,0,0,0,1|2,0,0]=4 2147 B15R1.884 NC(=O)C(=O)NCc1ccc(c(c1)F)O 240690a_100000758358_100011215815 [0,1,0,0,0,1|1,0,0]=3 2148 B15R1.884 NC(=O)C(=O)NCc1ccc(c(c1)O)Cl 240690a_100020636435_100011215815 [0,1,0,0,0,1|2,0,0]=4 2149 B15R1.884 NC(=O)C(=O)NCc1ccc(c(c1)O)F 240690a_100160469508_100011215815 [0,1,0,0,0,1|2,0,0]=4 2150 B15R1.884 NC(=O)C(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100011215815 [0,1,0,0,0,1|1,0,0]=3 2151 B15R1.884 O=C(CCc1ccc(c(c1)O)O)C(O)O 1458a_100000233687_200010393615 [0,1,0,0,0,1|0,0,2]=4 2152 B15R1.884 O=C(NCc1ccc(c(c1)F)O)C(O)O 240690a_100000758358_100000233687 [0,1,0,0,0,1|0,0,2]=4 2153 B15R1.894 CC(C)(O)C(=O)CCc1ccc(cc1)O 1458a_100000242741_100009816426 [0,1,0,0,0,1|1,0,1]=4 2154 B15R1.894 CC(C)(O)C(=O)NCc1ccc(cc1)O 240690a_100000185549_100000242741 [0,1,0,0,0,1|1,0,1]=4 2155 B15R1.910 CN(Cc1ccc(cc1)Br)C(=O)C(=O)N 240690a_100000180866_100011215815 [0,1,0,0,0,1|2,0,0]=4 2156 B15R1.910 CN(Cc1ccc(cc1)Cl)C(=O)C(=O)N 240690a_100000184517_100011215815 [0,1,0,0,0,1|2,0,0]=4 2157 B15R1.910 CN(Cc1ccc(cc1)F)C(=O)C(=O)N 240690a_100000184576_100011215815 [0,1,0,0,0,1|2,0,0]=4 2158 B15R1.910 CN(Cc1ccc(cc1)O)C(=O)C(=O)N 240690a_100000207500_100011215815 [0,1,0,0,0,1|1,0,0]=3 2159 B15R1.910 CN(Cc1ccc(cc1)O)C(=O)C(O)O 240690a_100000207500_100000233687 [0,1,0,0,0,1|0,0,2]=4 2160 B15R1.910 C[C@@H](O)C(=O)N(C)Cc1ccc(cc1)O 240690a_100000207500_100000717761 [0,1,0,0,0,1|1,0,1]=4 2161 B15R1.910 C[C@H](O)C(=O)N(C)Cc1ccc(cc1)O 240690a_100000207500_217856618621 [0,1,0,0,0,1|1,0,1]=4 2162 B15R1.910 Cc1ccc(cc1)CN(C)C(=O)C(=O)N 240690a_100000744650_100011215815 [0,1,0,0,0,1|2,0,0]=4 2163 B15R1.1001 C/C=C(\C)/C(=O)CCc1ccc(cc1)O 1458a_100020587367_100009816426 [0,1,0,0,0,1|2,0,0]=4 2164 B15R1.1001 C=C(CNc1ccc(cc1)Br)C(=O)OC 34a_100000210018_100009813391 [0,1,0,0,0,1|2,0,0]=4 2165 B15R1.1001 C=C(CNc1ccc(cc1)C)C(=O)OC 34a_100000124888_100009813391 [0,1,0,0,0,1|2,0,0]=4 2166 B15R1.1001 C=C(CNc1ccc(cc1)Cl)C(=O)OC 34a_100000210052_100009813391 [0,1,0,0,0,1|2,0,0]=4 2167 B15R1.1001 C=C(CNc1ccc(cc1)F)C(=O)OC 34a_100000185862_100009813391 [0,1,0,0,0,1|2,0,0]=4 2168 B15R1.1001 C=C(CNc1ccc(cc1)I)C(=O)OC 34a_100000185761_100009813391 [0,1,0,0,0,1|2,0,0]=4 2169 B15R1.1001 C=C(CNc1ccc(cc1)O)C(=O)OC 34a_100000185829_100009813391 [0,1,0,0,0,1|1,0,0]=3 2170 B15R1.1001 C=C(COc1ccc(cc1)Br)C(=O)OC 34a_100000185759_100009813391 [0,1,0,0,0,1|2,0,0]=4 2171 B15R1.1001 C=C(COc1ccc(cc1)C)C(=O)OC 34a_100000210336_100009813391 [0,1,0,0,0,1|2,0,0]=4 2172 B15R1.1001 C=C(COc1ccc(cc1)Cl)C(=O)OC 34a_100000210216_100009813391 [0,1,0,0,0,1|2,0,0]=4 2173 B15R1.1001 C=C(COc1ccc(cc1)F)C(=O)OC 34a_100000210339_100009813391 [0,1,0,0,0,1|2,0,0]=4 2174 B15R1.1001 C=C(COc1ccc(cc1)I)C(=O)OC 34a_100000212066_100009813391 [0,1,0,0,0,1|2,0,0]=4 2175 B15R1.1001 C=C(COc1ccc(cc1)N)C(=O)OC 34a_100000185829_100009813391 [0,1,0,0,0,1|2,0,0]=4 2176 B15R1.1001 C=C(CSc1ccc(cc1)Br)C(=O)OC 62a_100000752885_100009813391 [0,1,0,0,0,1|2,0,0]=4 2177 B15R1.1001 C=C(CSc1ccc(cc1)Br)C(=O)OC 62a_100009813391_100000752885 [0,1,0,0,0,1|2,0,0]=4 2178 B15R1.1001 C=C(CSc1ccc(cc1)C)C(=O)OC 62a_100000186775_100009813391 [0,1,0,0,0,1|2,0,0]=4 2179 B15R1.1001 C=C(CSc1ccc(cc1)C)C(=O)OC 62a_100009813391_100000186775 [0,1,0,0,0,1|2,0,0]=4 2180 B15R1.1001 C=C(CSc1ccc(cc1)Cl)C(=O)OC 62a_100000755918_100009813391 [0,1,0,0,0,1|2,0,0]=4 2181 B15R1.1001 C=C(CSc1ccc(cc1)Cl)C(=O)OC 62a_100009813391_100000755918 [0,1,0,0,0,1|2,0,0]=4 2182 B15R1.1001 C=C(CSc1ccc(cc1)F)C(=O)OC 62a_100000211213_100009813391 [0,1,0,0,0,1|2,0,0]=4 2183 B15R1.1001 C=C(CSc1ccc(cc1)F)C(=O)OC 62a_100009813391_100000211213 [0,1,0,0,0,1|2,0,0]=4 2184 B15R1.1001 C=C(CSc1ccc(cc1)N)C(=O)OC 62a_100000185761_100009813391 [0,1,0,0,0,1|2,0,0]=4 2185 B15R1.1001 C=C(CSc1ccc(cc1)N)C(=O)OC 62a_100009813391_100000185761 [0,1,0,0,0,1|2,0,0]=4 2186 B15R1.1001 C=C(CSc1ccc(cc1)O)C(=O)OC 62a_100009813391_100000185759 [0,1,0,0,0,1|1,0,0]=3 2187 B15R1.1001 C=C(CSc1ccc(cn1)O)C(=O)OC 62a_100000685995_100009813391 [0,1,0,0,0,1|2,0,0]=4 2188 B15R1.1001 C=C(CSc1ccc(cn1)O)C(=O)OC 62a_100009813391_100000744096 [0,1,0,0,0,1|2,0,0]=4 2189 B15R1.1001 CCC(O)C(=O)CCc1ccc(cc1)O 1458a_100011196387_100009816426 [0,1,0,0,0,1|1,0,1]=4 2190 B15R1.1001 CCC(O)C(=O)NCc1ccc(cc1)O 240690a_100000185549_100011196387 [0,1,0,0,0,1|1,0,1]=4 2191 B15R1.1001 CN(CCc1ccc(cc1)O)C(=O)CO 240690a_100016989440_100000210174 [0,1,0,0,0,1|2,0,0]=4 2192 B15R1.1001 CNC(=O)C(=O)CCc1ccc(cc1)Br 1458a_100011218921_100011740612 [0,1,0,0,0,1|2,0,0]=4 2193 B15R1.1001 CNC(=O)C(=O)CCc1ccc(cc1)C 1458a_100011218921_100011713686 [0,1,0,0,0,1|2,0,0]=4 2194 B15R1.1001 CNC(=O)C(=O)CCc1ccc(cc1)Cl 1458a_100011218921_100011713675 [0,1,0,0,0,1|2,0,0]=4 2195 B15R1.1001 CNC(=O)C(=O)CCc1ccc(cc1)F 1458a_100011218921_100011217392 [0,1,0,0,0,1|2,0,0]=4 2196 B15R1.1001 CNC(=O)C(=O)CCc1ccc(cc1)O 1458a_100011218921_100009816426 [0,1,0,0,0,1|1,0,0]=3 2197 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)Br 1626a_100000174875_100011218921 [0,1,0,0,0,1|2,0,0]=4 2198 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)Br 240690a_100000174875_100011218921 [0,1,0,0,0,1|2,0,0]=4 2199 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)Br 527a_100000174875_100011218921 [0,1,0,0,0,1|2,0,0]=4 2200 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)C 1626a_100000174908_100011218921 [0,1,0,0,0,1|2,0,0]=4 2201 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)C 240690a_100000174908_100011218921 [0,1,0,0,0,1|2,0,0]=4 2202 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)C 527a_100000174908_100011218921 [0,1,0,0,0,1|2,0,0]=4 2203 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100011218921 [0,1,0,0,0,1|2,0,0]=4 2204 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100011218921 [0,1,0,0,0,1|2,0,0]=4 2205 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)Cl 527a_100000174871_100011218921 [0,1,0,0,0,1|2,0,0]=4 2206 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)F 1626a_100000174882_100011218921 [0,1,0,0,0,1|2,0,0]=4 2207 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)F 240690a_100000174882_100011218921 [0,1,0,0,0,1|2,0,0]=4 2208 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)F 527a_100000174882_100011218921 [0,1,0,0,0,1|2,0,0]=4 2209 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)I 1626a_100016989417_100011218921 [0,1,0,0,0,1|2,0,0]=4 2210 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)I 240690a_100016989417_100011218921 [0,1,0,0,0,1|2,0,0]=4 2211 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)I 527a_100016989417_100011218921 [0,1,0,0,0,1|2,0,0]=4 2212 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)O 240690a_100000185549_100011218921 [0,1,0,0,0,1|1,0,0]=3 2213 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cc1)O 527a_100000185549_100011218921 [0,1,0,0,0,1|1,0,0]=3 2214 B15R1.1001 CNC(=O)C(=O)NCc1ccc(cn1)O 240690a_100020605196_100011218921 [0,1,0,0,0,1|2,0,0]=4 2215 B15R1.1001 CNC(=O)C(=O)NCc1ccc(nc1)O 240690a_100000757128_100011218921 [0,1,0,0,0,1|2,0,0]=4 2216 B15R1.1001 COC(=O)C(=O)/C=C/c1ccc(cc1)O 271570a_203496583355_200016988637 [0,1,0,0,0,1|0,0,1]=3 2217 B15R1.1001 COC(=O)C(=O)CNc1ccc(cc1)Br 34a_100000210018_100011610305 [0,1,0,0,0,1|1,0,0]=3 2218 B15R1.1001 COC(=O)C(=O)CNc1ccc(cc1)C 34a_100000124888_100011610305 [0,1,0,0,0,1|1,0,0]=3 2219 B15R1.1001 COC(=O)C(=O)CNc1ccc(cc1)Cl 34a_100000210052_100011610305 [0,1,0,0,0,1|1,0,0]=3 2220 B15R1.1001 COC(=O)C(=O)CNc1ccc(cc1)F 34a_100000185862_100011610305 [0,1,0,0,0,1|1,0,0]=3 2221 B15R1.1001 COC(=O)C(=O)CNc1ccc(cc1)I 34a_100000185761_100011610305 [0,1,0,0,0,1|1,0,0]=3 2222 B15R1.1001 COC(=O)C(=O)CNc1ccc(cc1)O 34a_100000185829_100011610305 [0,1,0,0,0,1|0,0,0]=2 2223 B15R1.1001 COC(=O)C(=O)COc1ccc(=O)[nH]c1 34a_100000075641_100011610305 [0,1,0,0,0,1|1,0,1]=4 2224 B15R1.1001 COC(=O)C(=O)COc1ccc(cc1)Br 34a_100000185759_100011610305 [0,1,0,0,0,1|1,0,0]=3 2225 B15R1.1001 COC(=O)C(=O)COc1ccc(cc1)C 34a_100000210336_100011610305 [0,1,0,0,0,1|1,0,0]=3 2226 B15R1.1001 COC(=O)C(=O)COc1ccc(cc1)Cl 34a_100000210216_100011610305 [0,1,0,0,0,1|1,0,0]=3 2227 B15R1.1001 COC(=O)C(=O)COc1ccc(cc1)F 34a_100000210339_100011610305 [0,1,0,0,0,1|1,0,0]=3 2228 B15R1.1001 COC(=O)C(=O)COc1ccc(cc1)I 34a_100000212066_100011610305 [0,1,0,0,0,1|1,0,0]=3 2229 B15R1.1001 COC(=O)C(=O)COc1ccc(cc1)N 34a_100000185829_100011610305 [0,1,0,0,0,1|1,0,0]=3 2230 B15R1.1001 COC(=O)C(=O)COc1ccc(cn1)C 34a_100000759353_100011610305 [0,1,0,0,0,1|2,0,0]=4 2231 B15R1.1001 COC(=O)C(=O)COc1ccc(cn1)Cl 34a_100011215309_100011610305 [0,1,0,0,0,1|2,0,0]=4 2232 B15R1.1001 COC(=O)C(=O)COc1ccc(cn1)F 34a_100000742473_100011610305 [0,1,0,0,0,1|2,0,0]=4 2233 B15R1.1001 COC(=O)C(=O)COc1ccc(cn1)N 34a_100000729260_100011610305 [0,1,0,0,0,1|2,0,0]=4 2234 B15R1.1001 COC(=O)C(=O)COc1ccc(nc1)Br 34a_100000685995_100011610305 [0,1,0,0,0,1|2,0,0]=4 2235 B15R1.1001 COC(=O)C(=O)COc1ccc(nc1)C 34a_100000745506_100011610305 [0,1,0,0,0,1|2,0,0]=4 2236 B15R1.1001 COC(=O)C(=O)COc1ccc(nc1)Cl 34a_100000744096_100011610305 [0,1,0,0,0,1|2,0,0]=4 2237 B15R1.1001 COC(=O)C(=O)COc1ccc(nc1)F 34a_100000688820_100011610305 [0,1,0,0,0,1|2,0,0]=4 2238 B15R1.1001 COC(=O)C(=O)COc1ccc(nc1)I 34a_100000687607_100011610305 [0,1,0,0,0,1|2,0,0]=4 2239 B15R1.1001 COC(=O)C(=O)COc1ccc(nc1)N 34a_100015188713_100011610305 [0,1,0,0,0,1|2,0,0]=4 2240 B15R1.1001 COC(=O)C(=O)CSc1cc[n+](cc1)[O-] 62a_100011610305_100000039755 [0,1,0,0,0,1|1,0,1]=4 2241 B15R1.1001 COC(=O)C(=O)CSc1ccc(=O)[nH]c1 62a_100000212171_100011610305 [0,1,0,0,0,1|1,0,1]=4 2242 B15R1.1001 COC(=O)C(=O)CSc1ccc(=O)[nH]c1 62a_100011610305_100000212171 [0,1,0,0,0,1|1,0,1]=4 2243 B15R1.1001 COC(=O)C(=O)CSc1ccc(cc1)Br 62a_100000752885_100011610305 [0,1,0,0,0,1|1,0,0]=3 2244 B15R1.1001 COC(=O)C(=O)CSc1ccc(cc1)Br 62a_100011610305_100000752885 [0,1,0,0,0,1|1,0,0]=3 2245 B15R1.1001 COC(=O)C(=O)CSc1ccc(cc1)C 62a_100000186775_100011610305 [0,1,0,0,0,1|1,0,0]=3 2246 B15R1.1001 COC(=O)C(=O)CSc1ccc(cc1)C 62a_100011610305_100000186775 [0,1,0,0,0,1|1,0,0]=3 2247 B15R1.1001 COC(=O)C(=O)CSc1ccc(cc1)Cl 62a_100000755918_100011610305 [0,1,0,0,0,1|1,0,0]=3 2248 B15R1.1001 COC(=O)C(=O)CSc1ccc(cc1)Cl 62a_100011610305_100000755918 [0,1,0,0,0,1|1,0,0]=3 2249 B15R1.1001 COC(=O)C(=O)CSc1ccc(cc1)F 62a_100000211213_100011610305 [0,1,0,0,0,1|1,0,0]=3 2250 B15R1.1001 COC(=O)C(=O)CSc1ccc(cc1)F 62a_100011610305_100000211213 [0,1,0,0,0,1|1,0,0]=3 2251 B15R1.1001 COC(=O)C(=O)CSc1ccc(cc1)N 62a_100000185761_100011610305 [0,1,0,0,0,1|1,0,0]=3 2252 B15R1.1001 COC(=O)C(=O)CSc1ccc(cc1)N 62a_100011610305_100000185761 [0,1,0,0,0,1|1,0,0]=3 2253 B15R1.1001 COC(=O)C(=O)CSc1ccc(cc1)O 62a_100011610305_100000185759 [0,1,0,0,0,1|0,0,0]=2 2254 B15R1.1001 COC(=O)C(=O)CSc1ccc(cn1)Br 62a_100000686858_100011610305 [0,1,0,0,0,1|2,0,0]=4 2255 B15R1.1001 COC(=O)C(=O)CSc1ccc(cn1)Br 62a_100011610305_100000686858 [0,1,0,0,0,1|2,0,0]=4 2256 B15R1.1001 COC(=O)C(=O)CSc1ccc(cn1)C 62a_100011192072_100011610305 [0,1,0,0,0,1|2,0,0]=4 2257 B15R1.1001 COC(=O)C(=O)CSc1ccc(cn1)C 62a_100011610305_100000754016 [0,1,0,0,0,1|2,0,0]=4 2258 B15R1.1001 COC(=O)C(=O)CSc1ccc(cn1)Cl 62a_100011356976_100011610305 [0,1,0,0,0,1|2,0,0]=4 2259 B15R1.1001 COC(=O)C(=O)CSc1ccc(cn1)Cl 62a_100011610305_100011356976 [0,1,0,0,0,1|2,0,0]=4 2260 B15R1.1001 COC(=O)C(=O)CSc1ccc(cn1)F 62a_100000744514_100011610305 [0,1,0,0,0,1|2,0,0]=4 2261 B15R1.1001 COC(=O)C(=O)CSc1ccc(cn1)F 62a_100011610305_100000744514 [0,1,0,0,0,1|2,0,0]=4 2262 B15R1.1001 COC(=O)C(=O)CSc1ccc(cn1)N 62a_100000737798_100011610305 [0,1,0,0,0,1|2,0,0]=4 2263 B15R1.1001 COC(=O)C(=O)CSc1ccc(cn1)N 62a_100011610305_100000737798 [0,1,0,0,0,1|2,0,0]=4 2264 B15R1.1001 COC(=O)C(=O)CSc1ccc(cn1)O 62a_100000685995_100011610305 [0,1,0,0,0,1|1,0,0]=3 2265 B15R1.1001 COC(=O)C(=O)CSc1ccc(cn1)O 62a_100011610305_100000744096 [0,1,0,0,0,1|1,0,0]=3 2266 B15R1.1001 COC(=O)C(=O)CSc1ccc(nc1)Br 62a_100009814638_100011610305 [0,1,0,0,0,1|2,0,0]=4 2267 B15R1.1001 COC(=O)C(=O)CSc1ccc(nc1)Br 62a_100011610305_100009814638 [0,1,0,0,0,1|2,0,0]=4 2268 B15R1.1001 COC(=O)C(=O)CSc1ccc(nc1)C 62a_100000751577_100011610305 [0,1,0,0,0,1|2,0,0]=4 2269 B15R1.1001 COC(=O)C(=O)CSc1ccc(nc1)C 62a_100011610305_100000751577 [0,1,0,0,0,1|2,0,0]=4 2270 B15R1.1001 COC(=O)C(=O)CSc1ccc(nc1)Cl 62a_100000034144_100011610305 [0,1,0,0,0,1|2,0,0]=4 2271 B15R1.1001 COC(=O)C(=O)CSc1ccc(nc1)Cl 62a_100011610305_100000034144 [0,1,0,0,0,1|2,0,0]=4 2272 B15R1.1001 COC(=O)C(=O)CSc1ccc(nc1)F 62a_100000042367_100011610305 [0,1,0,0,0,1|2,0,0]=4 2273 B15R1.1001 COC(=O)C(=O)CSc1ccc(nc1)F 62a_100011610305_100000042367 [0,1,0,0,0,1|2,0,0]=4 2274 B15R1.1001 COC(=O)C(=O)CSc1ccc(nc1)N 62a_100000187370_100011610305 [0,1,0,0,0,1|2,0,0]=4 2275 B15R1.1001 COC(=O)C(=O)CSc1ccc(nc1)N 62a_100011610305_100000187370 [0,1,0,0,0,1|2,0,0]=4 2276 B15R1.1001 COC(=O)C(=O)CSc1cnc(cn1)O 62a_100011610305_100015839800 [0,1,0,0,0,1|2,0,0]=4 2277 B15R1.1001 COC(=O)C(=O)CSc1cnc(cn1)O 62a_100011934580_100011610305 [0,1,0,0,0,1|2,0,0]=4 2278 B15R1.1001 COC(=O)C(=O)CSc1ncc(cn1)O 62a_100000730009_100011610305 [0,1,0,0,0,1|2,0,0]=4 2279 B15R1.1001 COC(=O)C(=O)CSc1ncc(cn1)O 62a_100011610305_100000092845 [0,1,0,0,0,1|2,0,0]=4 2280 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)Br 11a_100000174875_100000024059 [0,1,0,0,0,1|1,0,0]=3 2281 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000024059 [0,1,0,0,0,1|1,0,0]=3 2282 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000024059 [0,1,0,0,0,1|1,0,0]=3 2283 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)Br 527a_100000174875_100000024059 [0,1,0,0,0,1|1,0,0]=3 2284 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)C 11a_100000174908_100000024059 [0,1,0,0,0,1|1,0,0]=3 2285 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)C 1626a_100000174908_100000024059 [0,1,0,0,0,1|1,0,0]=3 2286 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)C 240690a_100000174908_100000024059 [0,1,0,0,0,1|1,0,0]=3 2287 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)C 527a_100000174908_100000024059 [0,1,0,0,0,1|1,0,0]=3 2288 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000024059 [0,1,0,0,0,1|1,0,0]=3 2289 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000024059 [0,1,0,0,0,1|1,0,0]=3 2290 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000024059 [0,1,0,0,0,1|1,0,0]=3 2291 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)Cl 527a_100000174871_100000024059 [0,1,0,0,0,1|1,0,0]=3 2292 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)F 11a_100000174882_100000024059 [0,1,0,0,0,1|1,0,0]=3 2293 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)F 1626a_100000174882_100000024059 [0,1,0,0,0,1|1,0,0]=3 2294 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)F 240690a_100000174882_100000024059 [0,1,0,0,0,1|1,0,0]=3 2295 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)F 527a_100000174882_100000024059 [0,1,0,0,0,1|1,0,0]=3 2296 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)I 11a_100016989417_100000024059 [0,1,0,0,0,1|1,0,0]=3 2297 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)I 1626a_100016989417_100000024059 [0,1,0,0,0,1|1,0,0]=3 2298 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)I 240690a_100016989417_100000024059 [0,1,0,0,0,1|1,0,0]=3 2299 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)I 527a_100016989417_100000024059 [0,1,0,0,0,1|1,0,0]=3 2300 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)O 240690a_100000185549_100000024059 [0,1,0,0,0,1|0,0,0]=2 2301 B15R1.1001 COC(=O)C(=O)NCc1ccc(cc1)O 527a_100000185549_100000024059 [0,1,0,0,0,1|0,0,0]=2 2302 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)Br 11a_100015188789_100000024059 [0,1,0,0,0,1|2,0,0]=4 2303 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)Br 1626a_100015188789_100000024059 [0,1,0,0,0,1|2,0,0]=4 2304 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)Br 240690a_100015188789_100000024059 [0,1,0,0,0,1|2,0,0]=4 2305 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)Br 527a_100015188789_100000024059 [0,1,0,0,0,1|2,0,0]=4 2306 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)C 11a_100015187455_100000024059 [0,1,0,0,0,1|2,0,0]=4 2307 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)C 1626a_100015187455_100000024059 [0,1,0,0,0,1|2,0,0]=4 2308 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)C 240690a_100015187455_100000024059 [0,1,0,0,0,1|2,0,0]=4 2309 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)C 527a_100015187455_100000024059 [0,1,0,0,0,1|2,0,0]=4 2310 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)Cl 11a_100000697193_100000024059 [0,1,0,0,0,1|2,0,0]=4 2311 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)Cl 1626a_100000697193_100000024059 [0,1,0,0,0,1|2,0,0]=4 2312 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)Cl 240690a_100000697193_100000024059 [0,1,0,0,0,1|2,0,0]=4 2313 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)Cl 527a_100000697193_100000024059 [0,1,0,0,0,1|2,0,0]=4 2314 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)F 11a_100020620131_100000024059 [0,1,0,0,0,1|2,0,0]=4 2315 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)F 1626a_100020620131_100000024059 [0,1,0,0,0,1|2,0,0]=4 2316 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)F 240690a_100020620131_100000024059 [0,1,0,0,0,1|2,0,0]=4 2317 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)F 527a_100020620131_100000024059 [0,1,0,0,0,1|2,0,0]=4 2318 B15R1.1001 COC(=O)C(=O)NCc1ccc(cn1)O 240690a_100020605196_100000024059 [0,1,0,0,0,1|1,0,0]=3 2319 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)Br 11a_100009817727_100000024059 [0,1,0,0,0,1|2,0,0]=4 2320 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)Br 240690a_100009817727_100000024059 [0,1,0,0,0,1|2,0,0]=4 2321 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)Br 527a_100009817727_100000024059 [0,1,0,0,0,1|2,0,0]=4 2322 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)C 11a_100000740942_100000024059 [0,1,0,0,0,1|2,0,0]=4 2323 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)C 1626a_100000740942_100000024059 [0,1,0,0,0,1|2,0,0]=4 2324 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)C 240690a_100000740942_100000024059 [0,1,0,0,0,1|2,0,0]=4 2325 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)C 527a_100000740942_100000024059 [0,1,0,0,0,1|2,0,0]=4 2326 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)Cl 11a_100000735879_100000024059 [0,1,0,0,0,1|2,0,0]=4 2327 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)Cl 1626a_100000735879_100000024059 [0,1,0,0,0,1|2,0,0]=4 2328 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)Cl 240690a_100000735879_100000024059 [0,1,0,0,0,1|2,0,0]=4 2329 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)Cl 527a_100000735879_100000024059 [0,1,0,0,0,1|2,0,0]=4 2330 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)F 11a_100000101913_100000024059 [0,1,0,0,0,1|2,0,0]=4 2331 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)F 1626a_100000101913_100000024059 [0,1,0,0,0,1|2,0,0]=4 2332 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)F 240690a_100000101913_100000024059 [0,1,0,0,0,1|2,0,0]=4 2333 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)F 527a_100000101913_100000024059 [0,1,0,0,0,1|2,0,0]=4 2334 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)O 11a_100000757128_100000024059 [0,1,0,0,0,1|1,0,0]=3 2335 B15R1.1001 COC(=O)C(=O)NCc1ccc(nc1)O 240690a_100000757128_100000024059 [0,1,0,0,0,1|1,0,0]=3 2336 B15R1.1001 COC(=O)C(C)CNc1ccc(cc1)O 34a_100000185829_100000698445 [0,1,0,0,0,1|1,0,1]=4 2337 B15R1.1001 COC(=O)C(C)CSc1ccc(cc1)O 62a_100000698445_100000185759 [0,1,0,0,0,1|1,0,1]=4 2338 B15R1.1001 COC(=O)C(C)NCc1ccc(cc1)O 34a_100000185549_100000211248 [0,1,0,0,0,1|1,0,1]=4 2339 B15R1.1001 COC(C)C(=O)CCc1ccc(cc1)O 1458a_100000743197_100009816426 [0,1,0,0,0,1|1,0,1]=4 2340 B15R1.1001 COC(C)C(=O)NCc1ccc(cc1)O 240690a_100000185549_100000743197 [0,1,0,0,0,1|1,0,1]=4 2341 B15R1.1001 COC(C)C(=O)NCc1ccc(cc1)O 527a_100000185549_100000743197 [0,1,0,0,0,1|1,0,1]=4 2342 B15R1.1001 CON(C)C(=O)CSc1ccc(cc1)O 62a_100000764215_100000185759 [0,1,0,0,0,1|2,0,0]=4 2343 B15R1.1001 O=C(CCc1ccc(cc1)O)C(O)CO 1458a_100011215603_100009816426 [0,1,0,0,0,1|0,0,2]=4 2344 B15R1.1001 O=C(NCc1ccc(cc1)O)C(O)CO 240690a_100000185549_100011215603 [0,1,0,0,0,1|0,0,2]=4 2345 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1Br)Br 34a_100000211012_100011261029 [0,1,0,0,0,1|2,0,0]=4 2346 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1Br)C 34a_100000210942_100011261029 [0,1,0,0,0,1|2,0,0]=4 2347 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1Br)Cl 34a_100000752454_100011261029 [0,1,0,0,0,1|2,0,0]=4 2348 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1Br)F 34a_100000738039_100011261029 [0,1,0,0,0,1|2,0,0]=4 2349 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1Br)O 34a_100012001276_100011261029 [0,1,0,0,0,1|1,0,0]=3 2350 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1C)Br 34a_100000211769_100011261029 [0,1,0,0,0,1|2,0,0]=4 2351 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1C)C 34a_100000736561_100011261029 [0,1,0,0,0,1|2,0,0]=4 2352 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1C)Cl 34a_100000210418_100011261029 [0,1,0,0,0,1|2,0,0]=4 2353 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1C)F 34a_100000211637_100011261029 [0,1,0,0,0,1|2,0,0]=4 2354 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1C)I 34a_100000184554_100011261029 [0,1,0,0,0,1|2,0,0]=4 2355 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1C)O 34a_100000756630_100011261029 [0,1,0,0,0,1|1,0,0]=3 2356 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1Cl)Br 34a_100000211467_100011261029 [0,1,0,0,0,1|2,0,0]=4 2357 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1Cl)C 34a_100000210522_100011261029 [0,1,0,0,0,1|2,0,0]=4 2358 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1Cl)Cl 34a_100000185861_100011261029 [0,1,0,0,0,1|2,0,0]=4 2359 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1Cl)F 34a_100000212003_100011261029 [0,1,0,0,0,1|2,0,0]=4 2360 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1Cl)I 34a_100011218065_100011261029 [0,1,0,0,0,1|2,0,0]=4 2361 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1Cl)O 34a_100011215599_100011261029 [0,1,0,0,0,1|1,0,0]=3 2362 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1F)Br 34a_100000210722_100011261029 [0,1,0,0,0,1|2,0,0]=4 2363 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1F)C 34a_100000211023_100011261029 [0,1,0,0,0,1|2,0,0]=4 2364 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1F)Cl 34a_100000211020_100011261029 [0,1,0,0,0,1|2,0,0]=4 2365 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1F)F 34a_100000210720_100011261029 [0,1,0,0,0,1|2,0,0]=4 2366 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1F)I 34a_100011215594_100011261029 [0,1,0,0,0,1|2,0,0]=4 2367 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1F)O 34a_100000759473_100011261029 [0,1,0,0,0,1|1,0,0]=3 2368 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1I)Br 34a_100000187925_100011261029 [0,1,0,0,0,1|2,0,0]=4 2369 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1I)C 34a_100011356834_100011261029 [0,1,0,0,0,1|2,0,0]=4 2370 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1I)Cl 34a_100000761889_100011261029 [0,1,0,0,0,1|2,0,0]=4 2371 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1I)F 34a_100000760547_100011261029 [0,1,0,0,0,1|2,0,0]=4 2372 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1I)O 34a_100010084370_100011261029 [0,1,0,0,0,1|1,0,0]=3 2373 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1O)Br 34a_100000739049_100011261029 [0,1,0,0,0,1|2,0,0]=4 2374 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1O)C 34a_100000211527_100011261029 [0,1,0,0,0,1|2,0,0]=4 2375 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1O)Cl 34a_100000185728_100011261029 [0,1,0,0,0,1|2,0,0]=4 2376 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1O)F 34a_100000753323_100011261029 [0,1,0,0,0,1|2,0,0]=4 2377 B15R1.5823 CC(=O)C(=O)CNc1ccc(cc1O)O 34a_100000106777_100011261029 [0,1,0,0,0,1|1,0,0]=3 2378 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1Br)Br 34a_100000188717_100011261029 [0,1,0,0,0,1|2,0,0]=4 2379 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1Br)C 34a_100000210800_100011261029 [0,1,0,0,0,1|2,0,0]=4 2380 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1Br)Cl 34a_100000211998_100011261029 [0,1,0,0,0,1|2,0,0]=4 2381 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1Br)F 34a_100000211999_100011261029 [0,1,0,0,0,1|2,0,0]=4 2382 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1Br)I 34a_100012361655_100011261029 [0,1,0,0,0,1|2,0,0]=4 2383 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1Br)N 34a_100011534360_100011261029 [0,1,0,0,0,1|2,0,0]=4 2384 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1C)Br 34a_100000186361_100011261029 [0,1,0,0,0,1|2,0,0]=4 2385 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1C)C 34a_100000211776_100011261029 [0,1,0,0,0,1|2,0,0]=4 2386 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1C)Cl 34a_100000211091_100011261029 [0,1,0,0,0,1|2,0,0]=4 2387 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1C)F 34a_100000764316_100011261029 [0,1,0,0,0,1|2,0,0]=4 2388 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1C)I 34a_100011218673_100011261029 [0,1,0,0,0,1|2,0,0]=4 2389 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1C)N 34a_100011218179_100011261029 [0,1,0,0,0,1|2,0,0]=4 2390 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1Cl)Br 34a_100000186472_100011261029 [0,1,0,0,0,1|2,0,0]=4 2391 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1Cl)C 34a_100000749699_100011261029 [0,1,0,0,0,1|2,0,0]=4 2392 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1Cl)Cl 34a_100015191787_100011261029 [0,1,0,0,0,1|2,0,0]=4 2393 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1Cl)F 34a_100000212004_100011261029 [0,1,0,0,0,1|2,0,0]=4 2394 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1Cl)I 34a_100012360047_100011261029 [0,1,0,0,0,1|2,0,0]=4 2395 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1Cl)N 34a_100000744943_100011261029 [0,1,0,0,0,1|2,0,0]=4 2396 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1F)Br 34a_100000185481_100011261029 [0,1,0,0,0,1|2,0,0]=4 2397 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1F)C 34a_100011216688_100011261029 [0,1,0,0,0,1|2,0,0]=4 2398 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1F)Cl 34a_100000230166_100011261029 [0,1,0,0,0,1|2,0,0]=4 2399 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1F)F 34a_100000230127_100011261029 [0,1,0,0,0,1|2,0,0]=4 2400 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1F)I 34a_100011356965_100011261029 [0,1,0,0,0,1|2,0,0]=4 2401 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1F)N 34a_100011220035_100011261029 [0,1,0,0,0,1|2,0,0]=4 2402 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1I)Br 34a_100012355227_100011261029 [0,1,0,0,0,1|2,0,0]=4 2403 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1I)C 34a_100000765521_100011261029 [0,1,0,0,0,1|2,0,0]=4 2404 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1I)Cl 34a_100011356953_100011261029 [0,1,0,0,0,1|2,0,0]=4 2405 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1I)F 34a_100012355409_100011261029 [0,1,0,0,0,1|2,0,0]=4 2406 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1N)Br 34a_100000752626_100011261029 [0,1,0,0,0,1|2,0,0]=4 2407 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1N)C 34a_100011215204_100011261029 [0,1,0,0,0,1|2,0,0]=4 2408 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1N)Cl 34a_100000210500_100011261029 [0,1,0,0,0,1|2,0,0]=4 2409 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1N)F 34a_100000759472_100011261029 [0,1,0,0,0,1|2,0,0]=4 2410 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1N)I 34a_100000753495_100011261029 [0,1,0,0,0,1|2,0,0]=4 2411 B15R1.5823 CC(=O)C(=O)COc1ccc(cc1N)N 34a_100000725306_100011261029 [0,1,0,0,0,1|2,0,0]=4 2412 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Br)Br 62a_100011261029_100011484698 [0,1,0,0,0,1|2,0,0]=4 2413 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Br)Br 62a_100011484698_100011261029 [0,1,0,0,0,1|2,0,0]=4 2414 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Br)C 62a_100009813563_100011261029 [0,1,0,0,0,1|2,0,0]=4 2415 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Br)C 62a_100011261029_100009813563 [0,1,0,0,0,1|2,0,0]=4 2416 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Br)Cl 62a_100011219703_100011261029 [0,1,0,0,0,1|2,0,0]=4 2417 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Br)Cl 62a_100011261029_100011219703 [0,1,0,0,0,1|2,0,0]=4 2418 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Br)F 62a_100011217111_100011261029 [0,1,0,0,0,1|2,0,0]=4 2419 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Br)F 62a_100011261029_100011217111 [0,1,0,0,0,1|2,0,0]=4 2420 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Br)N 62a_100000750458_100011261029 [0,1,0,0,0,1|2,0,0]=4 2421 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Br)N 62a_100011261029_100000750458 [0,1,0,0,0,1|2,0,0]=4 2422 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Br)O 62a_100000701344_100011261029 [0,1,0,0,0,1|1,0,0]=3 2423 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Br)O 62a_100011261029_100000701344 [0,1,0,0,0,1|1,0,0]=3 2424 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1C)Br 62a_100000701812_100011261029 [0,1,0,0,0,1|2,0,0]=4 2425 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1C)Br 62a_100011261029_100000701812 [0,1,0,0,0,1|2,0,0]=4 2426 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1C)C 62a_100011217332_100011261029 [0,1,0,0,0,1|2,0,0]=4 2427 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1C)C 62a_100011261029_100011217332 [0,1,0,0,0,1|2,0,0]=4 2428 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1C)Cl 62a_100011219607_100011261029 [0,1,0,0,0,1|2,0,0]=4 2429 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1C)Cl 62a_100011261029_100011219607 [0,1,0,0,0,1|2,0,0]=4 2430 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1C)F 62a_100011205405_100011261029 [0,1,0,0,0,1|2,0,0]=4 2431 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1C)F 62a_100011261029_100011205405 [0,1,0,0,0,1|2,0,0]=4 2432 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1C)N 62a_100000210723_100011261029 [0,1,0,0,0,1|2,0,0]=4 2433 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1C)N 62a_100011261029_100000210723 [0,1,0,0,0,1|2,0,0]=4 2434 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1C)O 62a_100011261029_100000690111 [0,1,0,0,0,1|1,0,0]=3 2435 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Cl)Br 62a_100011216062_100011261029 [0,1,0,0,0,1|2,0,0]=4 2436 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Cl)Br 62a_100011261029_100011216062 [0,1,0,0,0,1|2,0,0]=4 2437 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Cl)C 62a_100011261029_100011263221 [0,1,0,0,0,1|2,0,0]=4 2438 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Cl)C 62a_100011263221_100011261029 [0,1,0,0,0,1|2,0,0]=4 2439 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Cl)Cl 62a_100000699841_100011261029 [0,1,0,0,0,1|2,0,0]=4 2440 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Cl)Cl 62a_100011261029_100000699841 [0,1,0,0,0,1|2,0,0]=4 2441 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Cl)F 62a_100000733362_100011261029 [0,1,0,0,0,1|2,0,0]=4 2442 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Cl)F 62a_100011261029_100000733362 [0,1,0,0,0,1|2,0,0]=4 2443 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Cl)N 62a_100000761885_100011261029 [0,1,0,0,0,1|2,0,0]=4 2444 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Cl)N 62a_100011261029_100000761885 [0,1,0,0,0,1|2,0,0]=4 2445 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Cl)O 62a_100000047559_100011261029 [0,1,0,0,0,1|1,0,0]=3 2446 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1Cl)O 62a_100011261029_100000047559 [0,1,0,0,0,1|1,0,0]=3 2447 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1F)Br 62a_100009814013_100011261029 [0,1,0,0,0,1|2,0,0]=4 2448 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1F)Br 62a_100011261029_100009814013 [0,1,0,0,0,1|2,0,0]=4 2449 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1F)C 62a_100011216119_100011261029 [0,1,0,0,0,1|2,0,0]=4 2450 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1F)C 62a_100011261029_100011216119 [0,1,0,0,0,1|2,0,0]=4 2451 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1F)Cl 62a_100011216042_100011261029 [0,1,0,0,0,1|2,0,0]=4 2452 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1F)Cl 62a_100011261029_100011216042 [0,1,0,0,0,1|2,0,0]=4 2453 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1F)F 62a_100000750030_100011261029 [0,1,0,0,0,1|2,0,0]=4 2454 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1F)F 62a_100011261029_100000750030 [0,1,0,0,0,1|2,0,0]=4 2455 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1F)N 62a_100011261029_100011356925 [0,1,0,0,0,1|2,0,0]=4 2456 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1F)N 62a_100011356925_100011261029 [0,1,0,0,0,1|2,0,0]=4 2457 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1F)O 62a_100000755031_100011261029 [0,1,0,0,0,1|1,0,0]=3 2458 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1F)O 62a_100011261029_100000755031 [0,1,0,0,0,1|1,0,0]=3 2459 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1N)Br 62a_100000743836_100011261029 [0,1,0,0,0,1|2,0,0]=4 2460 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1N)Br 62a_100011261029_100000743836 [0,1,0,0,0,1|2,0,0]=4 2461 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1N)C 62a_100011216686_100011261029 [0,1,0,0,0,1|2,0,0]=4 2462 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1N)C 62a_100011261029_100011216686 [0,1,0,0,0,1|2,0,0]=4 2463 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1N)Cl 62a_100000761886_100011261029 [0,1,0,0,0,1|2,0,0]=4 2464 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1N)Cl 62a_100011261029_100000761886 [0,1,0,0,0,1|2,0,0]=4 2465 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1N)F 62a_100000687223_100011261029 [0,1,0,0,0,1|2,0,0]=4 2466 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1N)F 62a_100011261029_100000687223 [0,1,0,0,0,1|2,0,0]=4 2467 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1N)N 62a_100011261029_200012175722 [0,1,0,0,0,1|2,0,0]=4 2468 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1N)N 62a_200012175722_100011261029 [0,1,0,0,0,1|2,0,0]=4 2469 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1N)O 62a_100011261029_100011999798 [0,1,0,0,0,1|1,0,0]=3 2470 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1N)O 62a_100011999798_100011261029 [0,1,0,0,0,1|1,0,0]=3 2471 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1O)Br 62a_100011261029_100012344904 [0,1,0,0,0,1|2,0,0]=4 2472 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1O)Br 62a_100012344904_100011261029 [0,1,0,0,0,1|2,0,0]=4 2473 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1O)C 62a_100011261029_100012002257 [0,1,0,0,0,1|2,0,0]=4 2474 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1O)C 62a_100012002257_100011261029 [0,1,0,0,0,1|2,0,0]=4 2475 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1O)Cl 62a_100000050036_100011261029 [0,1,0,0,0,1|2,0,0]=4 2476 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1O)Cl 62a_100011261029_100000050036 [0,1,0,0,0,1|2,0,0]=4 2477 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1O)F 62a_100000690578_100011261029 [0,1,0,0,0,1|2,0,0]=4 2478 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1O)F 62a_100011261029_100000690578 [0,1,0,0,0,1|2,0,0]=4 2479 B15R1.5823 CC(=O)C(=O)CSc1ccc(cc1O)O 62a_100011261029_100009813921 [0,1,0,0,0,1|1,0,0]=3 2480 B15R1.5823 CC(=O)C(=O)CSc1ccc(nc1C)O 62a_100000691680_100011261029 [0,1,0,0,0,1|2,0,0]=4 2481 B15R1.5823 CC(=O)C(=O)CSc1ccc(nc1C)O 62a_100011261029_100000691680 [0,1,0,0,0,1|2,0,0]=4 2482 B15R1.5823 CC(=O)C(=O)CSc1ccc(nc1F)O 62a_100009879308_100011261029 [0,1,0,0,0,1|2,0,0]=4 2483 B15R1.5823 CC(=O)C(=O)CSc1ccc(nc1F)O 62a_100011261029_100009879308 [0,1,0,0,0,1|2,0,0]=4 2484 B15R1.5823 CC(=O)C(=O)CSc1cnc(cc1C)O 62a_100000766222_100011261029 [0,1,0,0,0,1|2,0,0]=4 2485 B15R1.5823 CC(=O)C(=O)CSc1cnc(cc1C)O 62a_100011261029_100000766222 [0,1,0,0,0,1|2,0,0]=4 2486 B15R1.5823 CC(=O)C(=O)CSc1ncc(cc1C)O 62a_100011261029_100012000486 [0,1,0,0,0,1|2,0,0]=4 2487 B15R1.5823 CC(=O)C(=O)CSc1ncc(cc1C)O 62a_100012000486_100011261029 [0,1,0,0,0,1|2,0,0]=4 2488 B15R1.5823 CC(=O)C(=O)CSc1ncc(cc1F)O 62a_100011261029_100000063512 [0,1,0,0,0,1|2,0,0]=4 2489 B15R1.5823 C[C@@H](O)C(=O)NCc1ccc(cc1Cl)O 240690a_200161156549_100000717761 [0,1,0,0,0,1|1,0,1]=4 2490 B15R1.5823 C[C@H](O)C(=O)NCc1ccc(cc1Cl)O 240690a_200161156549_217856618621 [0,1,0,0,0,1|1,0,1]=4 2491 B15R1.5823 Cc1cc(ccc1CNC(=O)C(=O)N)Br 240690a_100000753881_100011215815 [0,1,0,0,0,1|2,0,0]=4 2492 B15R1.5823 Cc1cc(ccc1CNC(=O)C(=O)N)Cl 240690a_103436540063_100011215815 [0,1,0,0,0,1|2,0,0]=4 2493 B15R1.5823 Cc1cc(ccc1CNC(=O)C(=O)N)F 240690a_100137329023_100011215815 [0,1,0,0,0,1|2,0,0]=4 2494 B15R1.5823 Cc1ccc(c(c1)C)CNC(=O)C(=O)N 240690a_100000737523_100011215815 [0,1,0,0,0,1|2,0,0]=4 2495 B15R1.5823 Cc1ccc(c(c1)Cl)CNC(=O)C(=O)N 240690a_100011997539_100011215815 [0,1,0,0,0,1|2,0,0]=4 2496 B15R1.5823 Cc1ccc(c(c1)F)CNC(=O)C(=O)N 240690a_100102887089_100011215815 [0,1,0,0,0,1|2,0,0]=4 2497 B15R1.5823 NC(=O)C(=O)NCc1ccc(cc1Br)Cl 240690a_100102692131_100011215815 [0,1,0,0,0,1|2,0,0]=4 2498 B15R1.5823 NC(=O)C(=O)NCc1ccc(cc1Br)F 240690a_100000708791_100011215815 [0,1,0,0,0,1|2,0,0]=4 2499 B15R1.5823 NC(=O)C(=O)NCc1ccc(cc1Cl)Br 240690a_100020628970_100011215815 [0,1,0,0,0,1|2,0,0]=4 2500 B15R1.5823 NC(=O)C(=O)NCc1ccc(cc1Cl)Cl 240690a_100000174880_100011215815 [0,1,0,0,0,1|2,0,0]=4 2501 B15R1.5823 NC(=O)C(=O)NCc1ccc(cc1Cl)F 240690a_100000174946_100011215815 [0,1,0,0,0,1|2,0,0]=4 2502 B15R1.5823 NC(=O)C(=O)NCc1ccc(cc1Cl)O 240690a_200161156549_100011215815 [0,1,0,0,0,1|1,0,0]=3 2503 B15R1.5823 NC(=O)C(=O)NCc1ccc(cc1F)Br 240690a_100000754580_100011215815 [0,1,0,0,0,1|2,0,0]=4 2504 B15R1.5823 NC(=O)C(=O)NCc1ccc(cc1F)Cl 240690a_100000708496_100011215815 [0,1,0,0,0,1|2,0,0]=4 2505 B15R1.5823 NC(=O)C(=O)NCc1ccc(cc1F)F 240690a_100000737868_100011215815 [0,1,0,0,0,1|2,0,0]=4 2506 B15R1.5823 O=C(NCc1ccc(cc1Cl)O)C(O)O 240690a_200161156549_100000233687 [0,1,0,0,0,1|0,0,2]=4 2507 B15R1.204 C#Cc1ccc(cc1)CC(=O)CC(=O)N 1458a_100134613110_100000140223 [0,1,0,0,0,1|2,0,0]=4 2508 B15R1.204 C#Cc1ccc(cc1)CC(=O)CC(=O)N 1458a_200009884166_100000187820 [0,1,0,0,0,1|2,0,0]=4 2509 B15R1.204 C#Cc1ccc(cc1)CC(=O)CC(=O)[O-] 1458a_200009884166_100020667443 [0,1,0,0,0,1|1,0,1]=4 2510 B15R1.204 C=C(C)CC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100000748629 [0,1,0,0,0,1|2,0,0]=4 2511 B15R1.204 C=C(C)CC(=O)Cc1ccc(cc1)OC 1458a_100000210706_100000748629 [0,1,0,0,0,1|2,0,0]=4 2512 B15R1.204 C=C(F)CC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100009893438 [0,1,0,0,0,1|2,0,0]=4 2513 B15R1.204 C=C(F)CC(=O)Cc1ccc(cc1)OC 1458a_100000210706_100009893438 [0,1,0,0,0,1|2,0,0]=4 2514 B15R1.204 C=Cc1ccc(cc1)CC(=O)CC(=O)N 1458a_100134613110_100000034074 [0,1,0,0,0,1|2,0,0]=4 2515 B15R1.204 CC(=CC(=O)Cc1ccc(cc1)CO)C 1458a_100000211388_100000067286 [0,1,0,0,0,1|2,0,0]=4 2516 B15R1.204 CC(=CC(=O)Cc1ccc(cc1)CO)Cl 1458a_200042562850_100000067286 [0,1,0,0,0,1|2,0,0]=4 2517 B15R1.204 CC(=CC(=O)Cc1ccc(cc1)CO)I 1458a_100025716642_100000067286 [0,1,0,0,0,1|2,0,0]=4 2518 B15R1.204 CC(O)CC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100011218427 [0,1,0,0,0,1|1,0,1]=4 2519 B15R1.204 CCc1ccc(cc1)CC(=O)CC(=O)N 1458a_100134613110_100000747183 [0,1,0,0,0,1|2,0,0]=4 2520 B15R1.204 CCc1ccc(cc1)CC(=O)CC(=O)N 1458a_200000759805_100000187820 [0,1,0,0,0,1|2,0,0]=4 2521 B15R1.204 CCc1ccc(cc1)CC(=O)CC(=O)[O-] 1458a_200000759805_100020667443 [0,1,0,0,0,1|1,0,1]=4 2522 B15R1.204 CN(CC(=O)O)Cc1ccc(cc1)CO 269956a_100000746989_100000067286 [0,1,0,0,0,1|2,0,0]=4 2523 B15R1.204 COc1ccc(cc1)CC(=O)CC(=O)N 1458a_100000210706_100000187820 [0,1,0,0,0,1|1,0,0]=3 2524 B15R1.204 COc1ccc(cc1)CC(=O)CC(=O)[O-] 1458a_100000210706_100020667443 [0,1,0,0,0,1|0,0,1]=3 2525 B15R1.204 COc1ccc(cc1)CC(=O)CC(C)O 1458a_100000210706_100011218427 [0,1,0,0,0,1|1,0,1]=4 2526 B15R1.204 COc1ccc(cc1)CC(=O)C[N+](=O)[O-] 1458a_100000210706_100000761209 [0,1,0,0,0,1|1,0,1]=4 2527 B15R1.204 COc1ccc(cc1)CN(C)CC(=O)O 269956a_100000238703_200000210301 [0,1,0,0,0,1|2,0,0]=4 2528 B15R1.204 COc1ccc(cc1)CN(C)CC(=O)O 269956a_100000746989_100000742318 [0,1,0,0,0,1|2,0,0]=4 2529 B15R1.204 COc1ccc(cc1)CN([13CH3])CC(=O)O 269956a_100000238703_200025704644 [0,1,0,0,0,1|2,0,0]=4 2530 B15R1.204 COc1ccc(cc1)NC(=O)CC(=O)C 1458a_100000070787_100000182860 [0,1,0,0,0,1|2,0,0]=4 2531 B15R1.204 COc1ccc(cc1)NC(=O)CC(=O)C 1458a_100011623781_200000210301 [0,1,0,0,0,1|2,0,0]=4 2532 B15R1.204 COc1ccc(cc1)NC(=O)CC(=O)N 22a_100000184247_100134613110 [0,1,0,0,0,1|2,0,0]=4 2533 B15R1.204 COc1ccc(cc1)NC(=O)CC(=O)N 527a_100000184247_100134613110 [0,1,0,0,0,1|2,0,0]=4 2534 B15R1.204 COc1ccc(cc1)NC(=O)CC(=O)[13CH3] 1458a_100011623781_200025704644 [0,1,0,0,0,1|2,0,0]=4 2535 B15R1.204 COc1ccc(cc1)OC(=O)CC(=O)C 1458a_100000070787_100010004613 [0,1,0,0,0,1|2,0,0]=4 2536 B15R1.204 COc1ccc(cn1)CC(=O)CC(=O)N 1458a_100012001117_100000187820 [0,1,0,0,0,1|2,0,0]=4 2537 B15R1.204 COc1ccc(cn1)CC(=O)CC(=O)N 1458a_100134613110_100020631284 [0,1,0,0,0,1|2,0,0]=4 2538 B15R1.204 COc1ccc(cn1)CC(=O)CC(=O)[O-] 1458a_100012001117_100020667443 [0,1,0,0,0,1|1,0,1]=4 2539 B15R1.204 COc1ccc(nc1)CC(=O)CC(=O)N 1458a_100000722272_100000187820 [0,1,0,0,0,1|2,0,0]=4 2540 B15R1.204 COc1ccc(nc1)CC(=O)CC(=O)N 1458a_100134613110_200000757186 [0,1,0,0,0,1|2,0,0]=4 2541 B15R1.204 COc1ccc(nc1)CC(=O)CC(=O)[O-] 1458a_100000722272_100020667443 [0,1,0,0,0,1|1,0,1]=4 2542 B15R1.204 CSc1ccc(cc1)CC(=O)CC(=O)N 1458a_100000756958_100000187820 [0,1,0,0,0,1|1,1,0]=4 2543 B15R1.204 CSc1ccc(cc1)CC(=O)CC(=O)N 1458a_100134613110_100000181263 [0,1,0,0,0,1|1,1,0]=4 2544 B15R1.204 CSc1ccc(cc1)CC(=O)CC(=O)[O-] 1458a_100000756958_100020667443 [0,1,0,0,0,1|0,1,1]=4 2545 B15R1.204 C[C@@H](O)CC(=O)Cc1ccc(cc1)CO 1458a_100011933948_100000067286 [0,1,0,0,0,1|1,0,1]=4 2546 B15R1.204 N#Cc1ccc(cc1)CC(=O)CC(=O)N 1458a_100000748677_100000187820 [0,1,0,0,0,1|2,0,0]=4 2547 B15R1.204 N#Cc1ccc(cc1)CC(=O)CC(=O)N 1458a_100134613110_100000184898 [0,1,0,0,0,1|2,0,0]=4 2548 B15R1.204 N#Cc1ccc(cc1)CC(=O)CC(=O)[O-] 1458a_100000748677_100020667443 [0,1,0,0,0,1|1,0,1]=4 2549 B15R1.204 NC(=O)CC(=O)Cc1ccc(cc1)C=O 1458a_100134613110_100000075337 [0,1,0,0,0,1|1,0,1]=4 2550 B15R1.204 NC(=O)CC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100000187820 [0,1,0,0,0,1|1,0,0]=3 2551 B15R1.204 NC(=O)CC(=O)Cc1ccc(cc1)CO 1458a_100134613110_100000067286 [0,1,0,0,0,1|1,0,0]=3 2552 B15R1.204 NC(=O)CC(=O)Nc1ccc(cc1)CO 22a_100011215238_100134613110 [0,1,0,0,0,1|2,0,0]=4 2553 B15R1.204 O=C(C=C(Cl)Cl)Cc1ccc(cc1)CO 1458a_100000137448_100000067286 [0,1,0,0,0,1|2,0,0]=4 2554 B15R1.204 O=C(Cc1ccc(cc1)CO)C[N+](=O)[O-] 1458a_100011356463_100000761209 [0,1,0,0,0,1|1,0,1]=4 2555 B15R1.204 O=C([O-])CC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100020667443 [0,1,0,0,0,1|0,0,1]=3 2556 B15R1.880 C=C(C)CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_100000748629 [0,1,0,0,0,1|2,0,0]=4 2557 B15R1.880 C=C(C)CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000748629 [0,1,0,0,0,1|2,0,0]=4 2558 B15R1.880 C=C(F)CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_100009893438 [0,1,0,0,0,1|2,0,0]=4 2559 B15R1.880 C=C(F)CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100009893438 [0,1,0,0,0,1|2,0,0]=4 2560 B15R1.880 CC(C(=O)CC(=O)N)c1ccc(cc1)Br 1458a_100134613110_100000755118 [0,1,0,0,0,1|2,0,0]=4 2561 B15R1.880 CC(C(=O)CC(=O)N)c1ccc(cc1)Cl 1458a_100011216001_100000187820 [0,1,0,0,0,1|2,0,0]=4 2562 B15R1.880 CC(C(=O)CC(=O)N)c1ccc(cc1)Cl 1458a_100134613110_100000684792 [0,1,0,0,0,1|2,0,0]=4 2563 B15R1.880 CC(C(=O)CC(=O)N)c1ccc(cc1)F 1458a_100011435297_100000187820 [0,1,0,0,0,1|2,0,0]=4 2564 B15R1.880 CC(C(=O)CC(=O)N)c1ccc(cc1)F 1458a_100134613110_100000743420 [0,1,0,0,0,1|2,0,0]=4 2565 B15R1.880 CC(C(=O)CC(=O)N)c1ccc(cc1)O 1458a_100000031422_100000187820 [0,1,0,0,0,1|1,0,0]=3 2566 B15R1.880 CC(C(=O)CC(=O)[O-])c1ccc(cc1)Cl 1458a_100011216001_100020667443 [0,1,0,0,0,1|1,0,1]=4 2567 B15R1.880 CC(C(=O)CC(=O)[O-])c1ccc(cc1)F 1458a_100011435297_100020667443 [0,1,0,0,0,1|1,0,1]=4 2568 B15R1.880 CC(C(=O)CC(=O)[O-])c1ccc(cc1)O 1458a_100000031422_100020667443 [0,1,0,0,0,1|0,0,1]=3 2569 B15R1.880 CC(C(=O)C[N+](=O)[O-])c1ccc(cc1)O 1458a_100000031422_100000761209 [0,1,0,0,0,1|1,0,1]=4 2570 B15R1.880 CC(O)CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_100011218427 [0,1,0,0,0,1|1,0,1]=4 2571 B15R1.880 CC(O)CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100011218427 [0,1,0,0,0,1|1,0,1]=4 2572 B15R1.880 CN(C(=O)CC(=O)N)c1ccc(cc1)O 22a_100000182112_100134613110 [0,1,0,0,0,1|2,0,0]=4 2573 B15R1.880 CN(C(=O)CC(=O)N)c1ccc(cc1)O 527a_100000182112_100134613110 [0,1,0,0,0,1|2,0,0]=4 2574 B15R1.880 Cc1ccc(cc1)C(C)C(=O)CC(=O)N 1458a_100000751627_100000187820 [0,1,0,0,0,1|2,0,0]=4 2575 B15R1.880 Cc1ccc(cc1)C(C)C(=O)CC(=O)N 1458a_100134613110_100011261388 [0,1,0,0,0,1|2,0,0]=4 2576 B15R1.880 Cc1ccc(cc1)C(C)C(=O)CC(=O)[O-] 1458a_100000751627_100020667443 [0,1,0,0,0,1|1,0,1]=4 2577 B15R1.880 Cc1ccc(cc1)[C@@H](O)C(=O)CC(=O)N 1458a_100009815954_100000187820 [0,1,0,0,0,1|2,0,0]=4 2578 B15R1.880 Cc1ccc(cc1)[C@@H](O)C(=O)CC(=O)[O-] 1458a_100009815954_100020667443 [0,1,0,0,0,1|1,0,1]=4 2579 B15R1.880 NC(=O)CC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_100000187820 [0,1,0,0,0,1|2,0,0]=4 2580 B15R1.880 NC(=O)CC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_100000187820 [0,1,0,0,0,1|2,0,0]=4 2581 B15R1.880 NC(=O)CC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_100000187820 [0,1,0,0,0,1|2,0,0]=4 2582 B15R1.880 NC(=O)CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000187820 [0,1,0,0,0,1|1,0,0]=3 2583 B15R1.880 NC(=O)CC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100000187820 [0,1,0,0,0,1|2,0,0]=4 2584 B15R1.880 O=C(C[N+](=O)[O-])C(O)c1ccc(cc1)O 1458a_100011215213_100000761209 [0,1,0,0,0,1|1,0,1]=4 2585 B15R1.880 O=C([O-])CC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_100020667443 [0,1,0,0,0,1|1,0,1]=4 2586 B15R1.880 O=C([O-])CC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_100020667443 [0,1,0,0,0,1|1,0,1]=4 2587 B15R1.880 O=C([O-])CC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_100020667443 [0,1,0,0,0,1|1,0,1]=4 2588 B15R1.880 O=C([O-])CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100020667443 [0,1,0,0,0,1|0,0,1]=3 2589 B15R1.880 O=C([O-])CC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100020667443 [0,1,0,0,0,1|1,0,1]=4 2590 B15R1.883 C=C(C)CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000748629 [0,1,0,0,0,1|2,0,0]=4 2591 B15R1.883 C=C(C)CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100000748629 [0,1,0,0,0,1|2,0,0]=4 2592 B15R1.883 C=C(C)CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000748629 [0,1,0,0,0,1|2,0,0]=4 2593 B15R1.883 C=C(C)CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100000748629 [0,1,0,0,0,1|2,0,0]=4 2594 B15R1.883 C=C(C)CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000748629 [0,1,0,0,0,1|2,0,0]=4 2595 B15R1.883 C=C(F)CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100009893438 [0,1,0,0,0,1|2,0,0]=4 2596 B15R1.883 C=C(F)CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100009893438 [0,1,0,0,0,1|2,0,0]=4 2597 B15R1.883 C=C(F)CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100009893438 [0,1,0,0,0,1|2,0,0]=4 2598 B15R1.883 C=C(F)CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100009893438 [0,1,0,0,0,1|2,0,0]=4 2599 B15R1.883 C=C(F)CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100009893438 [0,1,0,0,0,1|2,0,0]=4 2600 B15R1.883 CC(O)CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100011218427 [0,1,0,0,0,1|1,0,1]=4 2601 B15R1.883 CC(O)CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100011218427 [0,1,0,0,0,1|1,0,1]=4 2602 B15R1.883 CC(O)CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100011218427 [0,1,0,0,0,1|1,0,1]=4 2603 B15R1.883 CC(O)CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100011218427 [0,1,0,0,0,1|1,0,1]=4 2604 B15R1.883 Cc1cc(ccc1Br)CC(=O)CC(=O)N 1458a_100012340274_100000187820 [0,1,0,0,0,1|2,0,0]=4 2605 B15R1.883 Cc1cc(ccc1Br)CC(=O)CC(=O)N 1458a_100134613110_100000727479 [0,1,0,0,0,1|2,0,0]=4 2606 B15R1.883 Cc1cc(ccc1Br)CC(=O)CC(=O)[O-] 1458a_100012340274_100020667443 [0,1,0,0,0,1|1,0,1]=4 2607 B15R1.883 Cc1cc(ccc1Cl)CC(=O)CC(=O)N 1458a_100134613110_100012184735 [0,1,0,0,0,1|2,0,0]=4 2608 B15R1.883 Cc1cc(ccc1F)CC(=O)CC(=O)N 1458a_100011667458_100000187820 [0,1,0,0,0,1|2,0,0]=4 2609 B15R1.883 Cc1cc(ccc1F)CC(=O)CC(=O)N 1458a_100134613110_100011216667 [0,1,0,0,0,1|2,0,0]=4 2610 B15R1.883 Cc1cc(ccc1F)CC(=O)CC(=O)[O-] 1458a_100011667458_100020667443 [0,1,0,0,0,1|1,0,1]=4 2611 B15R1.883 Cc1cc(ccc1O)CC(=O)CC(=O)N 1458a_100000083968_100000187820 [0,1,0,0,0,1|1,0,0]=3 2612 B15R1.883 Cc1cc(ccc1O)CC(=O)CC(=O)[O-] 1458a_100000083968_100020667443 [0,1,0,0,0,1|0,0,1]=3 2613 B15R1.883 Cc1cc(ccc1O)CC(=O)CC(C)O 1458a_100000083968_100011218427 [0,1,0,0,0,1|1,0,1]=4 2614 B15R1.883 Cc1cc(ccc1O)CC(=O)C[N+](=O)[O-] 1458a_100000083968_100000761209 [0,1,0,0,0,1|1,0,1]=4 2615 B15R1.883 Cc1cc(ccc1O)NC(=O)CC(=O)N 22a_100011218179_100134613110 [0,1,0,0,0,1|2,0,0]=4 2616 B15R1.883 Cc1cc(ccc1O)NC(=O)CC(=O)N 527a_100011218179_100134613110 [0,1,0,0,0,1|2,0,0]=4 2617 B15R1.883 Cc1ccc(cc1Br)CC(=O)CC(=O)N 1458a_100000709925_100000187820 [0,1,0,0,0,1|2,0,0]=4 2618 B15R1.883 Cc1ccc(cc1Br)CC(=O)CC(=O)N 1458a_100134613110_100012232412 [0,1,0,0,0,1|2,0,0]=4 2619 B15R1.883 Cc1ccc(cc1Br)CC(=O)CC(=O)[O-] 1458a_100000709925_100020667443 [0,1,0,0,0,1|1,0,1]=4 2620 B15R1.883 Cc1ccc(cc1C)CC(=O)CC(=O)N 1458a_100000184070_100000187820 [0,1,0,0,0,1|2,0,0]=4 2621 B15R1.883 Cc1ccc(cc1C)CC(=O)CC(=O)N 1458a_100134613110_100000742320 [0,1,0,0,0,1|2,0,0]=4 2622 B15R1.883 Cc1ccc(cc1C)CC(=O)CC(=O)[O-] 1458a_100000184070_100020667443 [0,1,0,0,0,1|1,0,1]=4 2623 B15R1.883 Cc1ccc(cc1Cl)CC(=O)CC(=O)N 1458a_100134613110_100011823929 [0,1,0,0,0,1|2,0,0]=4 2624 B15R1.883 Cc1ccc(cc1F)CC(=O)CC(=O)N 1458a_100011217375_100000187820 [0,1,0,0,0,1|2,0,0]=4 2625 B15R1.883 Cc1ccc(cc1F)CC(=O)CC(=O)N 1458a_100134613110_100011217369 [0,1,0,0,0,1|2,0,0]=4 2626 B15R1.883 Cc1ccc(cc1F)CC(=O)CC(=O)[O-] 1458a_100011217375_100020667443 [0,1,0,0,0,1|1,0,1]=4 2627 B15R1.883 Cc1ccc(cc1I)CC(=O)CC(=O)N 1458a_100134613110_100010206137 [0,1,0,0,0,1|2,0,0]=4 2628 B15R1.883 Cc1ccc(cc1O)CC(=O)CC(=O)N 1458a_100000082272_100000187820 [0,1,0,0,0,1|2,0,0]=4 2629 B15R1.883 Cc1ccc(cc1O)CC(=O)CC(=O)[O-] 1458a_100000082272_100020667443 [0,1,0,0,0,1|1,0,1]=4 2630 B15R1.883 NC(=O)CC(=O)Cc1cc(=O)c(co1)O 1458a_100134613110_100000010605 [0,1,0,0,0,1|2,0,0]=4 2631 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)Br)Br 1458a_100134613110_100012353900 [0,1,0,0,0,1|2,0,0]=4 2632 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100000187820 [0,1,0,0,0,1|2,0,0]=4 2633 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100134613110_100012353894 [0,1,0,0,0,1|2,0,0]=4 2634 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_100000187820 [0,1,0,0,0,1|2,0,0]=4 2635 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)Br)F 1458a_100134613110_100011206884 [0,1,0,0,0,1|2,0,0]=4 2636 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000187820 [0,1,0,0,0,1|1,0,0]=3 2637 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100000187820 [0,1,0,0,0,1|2,0,0]=4 2638 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100134613110_100012353895 [0,1,0,0,0,1|2,0,0]=4 2639 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100000187820 [0,1,0,0,0,1|2,0,0]=4 2640 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100134613110_100000184707 [0,1,0,0,0,1|2,0,0]=4 2641 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100000187820 [0,1,0,0,0,1|2,0,0]=4 2642 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100134613110_100000717365 [0,1,0,0,0,1|2,0,0]=4 2643 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)Cl)I 1458a_100134613110_100012349665 [0,1,0,0,0,1|2,0,0]=4 2644 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000187820 [0,1,0,0,0,1|1,0,0]=3 2645 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_100000187820 [0,1,0,0,0,1|2,0,0]=4 2646 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)F)Br 1458a_100134613110_100000767054 [0,1,0,0,0,1|2,0,0]=4 2647 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100000187820 [0,1,0,0,0,1|2,0,0]=4 2648 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100134613110_100000716492 [0,1,0,0,0,1|2,0,0]=4 2649 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_100000187820 [0,1,0,0,0,1|2,0,0]=4 2650 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)F)F 1458a_100134613110_100000757363 [0,1,0,0,0,1|2,0,0]=4 2651 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_100000187820 [0,1,0,0,0,1|2,0,0]=4 2652 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)F)I 1458a_100134613110_100010149604 [0,1,0,0,0,1|2,0,0]=4 2653 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100000187820 [0,1,0,0,0,1|1,0,0]=3 2654 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)I)Br 1458a_100134613110_100010146616 [0,1,0,0,0,1|2,0,0]=4 2655 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)I)F 1458a_100134613110_100010188208 [0,1,0,0,0,1|2,0,0]=4 2656 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000187820 [0,1,0,0,0,1|1,0,0]=3 2657 B15R1.883 NC(=O)CC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100134613110 [0,1,0,0,0,1|2,0,0]=4 2658 B15R1.883 NC(=O)CC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100134613110 [0,1,0,0,0,1|2,0,0]=4 2659 B15R1.883 NC(=O)CC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100134613110 [0,1,0,0,0,1|2,0,0]=4 2660 B15R1.883 NC(=O)CC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100134613110 [0,1,0,0,0,1|2,0,0]=4 2661 B15R1.883 NC(=O)CC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100134613110 [0,1,0,0,0,1|2,0,0]=4 2662 B15R1.883 NC(=O)CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100134613110 [0,1,0,0,0,1|2,0,0]=4 2663 B15R1.883 NC(=O)CC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100134613110 [0,1,0,0,0,1|2,0,0]=4 2664 B15R1.883 O=C(Cc1ccc(c(c1)Br)O)C[N+](=O)[O-] 1458a_100009990404_100000761209 [0,1,0,0,0,1|1,0,1]=4 2665 B15R1.883 O=C(Cc1ccc(c(c1)Cl)O)C[N+](=O)[O-] 1458a_100000035197_100000761209 [0,1,0,0,0,1|1,0,1]=4 2666 B15R1.883 O=C(Cc1ccc(c(c1)F)O)C[N+](=O)[O-] 1458a_100000039761_100000761209 [0,1,0,0,0,1|1,0,1]=4 2667 B15R1.883 O=C(Cc1ccc(c(c1)O)O)C[N+](=O)[O-] 1458a_100000031429_100000761209 [0,1,0,0,0,1|1,0,1]=4 2668 B15R1.883 O=C([O-])CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100020667443 [0,1,0,0,0,1|1,0,1]=4 2669 B15R1.883 O=C([O-])CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_100020667443 [0,1,0,0,0,1|1,0,1]=4 2670 B15R1.883 O=C([O-])CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100020667443 [0,1,0,0,0,1|0,0,1]=3 2671 B15R1.883 O=C([O-])CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100020667443 [0,1,0,0,0,1|1,0,1]=4 2672 B15R1.883 O=C([O-])CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100020667443 [0,1,0,0,0,1|1,0,1]=4 2673 B15R1.883 O=C([O-])CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100020667443 [0,1,0,0,0,1|1,0,1]=4 2674 B15R1.883 O=C([O-])CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100020667443 [0,1,0,0,0,1|0,0,1]=3 2675 B15R1.883 O=C([O-])CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_100020667443 [0,1,0,0,0,1|1,0,1]=4 2676 B15R1.883 O=C([O-])CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100020667443 [0,1,0,0,0,1|1,0,1]=4 2677 B15R1.883 O=C([O-])CC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_100020667443 [0,1,0,0,0,1|1,0,1]=4 2678 B15R1.883 O=C([O-])CC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_100020667443 [0,1,0,0,0,1|1,0,1]=4 2679 B15R1.883 O=C([O-])CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100020667443 [0,1,0,0,0,1|0,0,1]=3 2680 B15R1.883 O=C([O-])CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100020667443 [0,1,0,0,0,1|0,0,1]=3 2681 B15R1.913 CS(=O)(=O)NC(=O)Cc1ccc(cc1)O 2740a_100000171171_100000198540 [0,1,0,0,0,1|1,0,1]=4 2682 B15R1.913 NS(=O)(=O)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000741382 [0,1,0,0,0,1|1,0,1]=4 2683 B15R1.913 O=C(Cc1ccc(cc1)O)CS(=O)(=O)[O-] 1458a_100000198540_100009817235 [0,1,0,0,0,1|1,0,1]=4 2684 B15R1.981 C#CC(=O)CC(=O)Nc1ccc(cc1)O 1458a_100000211873_100000233757 [0,1,0,0,0,1|2,0,0]=4 2685 B15R1.981 C=C(C#N)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000694840 [0,1,0,0,0,1|2,0,0]=4 2686 B15R1.981 C=CC(=O)CC(=O)Nc1ccc(cc1)O 1458a_100000185746_100000233757 [0,1,0,0,0,1|2,0,0]=4 2687 B15R1.981 CC(Cc1ccc(cc1)O)NC(=O)CO 240690a_100102634573_100000210174 [0,1,0,0,0,1|1,0,1]=4 2688 B15R1.981 CC(Cc1ccc(cc1)O)NC(=O)CO 527a_100102634573_100000210174 [0,1,0,0,0,1|1,0,1]=4 2689 B15R1.981 CCC(=O)CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000747405 [0,1,0,0,0,1|2,0,0]=4 2690 B15R1.981 CCC(=O)CC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000747405 [0,1,0,0,0,1|2,0,0]=4 2691 B15R1.981 CCC(=O)CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000747405 [0,1,0,0,0,1|2,0,0]=4 2692 B15R1.981 CCC(=O)CC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000747405 [0,1,0,0,0,1|2,0,0]=4 2693 B15R1.981 CCC(=O)CC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000747405 [0,1,0,0,0,1|2,0,0]=4 2694 B15R1.981 CCC(=O)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000747405 [0,1,0,0,0,1|1,0,0]=3 2695 B15R1.981 CCC(=O)CC(=O)Nc1ccc(cc1)O 1458a_100000210414_100000233757 [0,1,0,0,0,1|2,0,0]=4 2696 B15R1.981 CCC(O)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100011218378 [0,1,0,0,0,1|1,0,1]=4 2697 B15R1.981 CNC(=O)CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000183359 [0,1,0,0,0,1|2,0,0]=4 2698 B15R1.981 CNC(=O)CC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000183359 [0,1,0,0,0,1|2,0,0]=4 2699 B15R1.981 CNC(=O)CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000183359 [0,1,0,0,0,1|2,0,0]=4 2700 B15R1.981 CNC(=O)CC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000183359 [0,1,0,0,0,1|2,0,0]=4 2701 B15R1.981 CNC(=O)CC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000183359 [0,1,0,0,0,1|2,0,0]=4 2702 B15R1.981 CNC(=O)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000183359 [0,1,0,0,0,1|1,0,0]=3 2703 B15R1.981 COC(=O)CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000747449 [0,1,0,0,0,1|1,0,0]=3 2704 B15R1.981 COC(=O)CC(=O)Cc1ccc(cc1)Br 1458a_100000211351_100000189115 [0,1,0,0,0,1|1,0,0]=3 2705 B15R1.981 COC(=O)CC(=O)Cc1ccc(cc1)C 1458a_100000211351_100000210814 [0,1,0,0,0,1|1,0,0]=3 2706 B15R1.981 COC(=O)CC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000747449 [0,1,0,0,0,1|1,0,0]=3 2707 B15R1.981 COC(=O)CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000747449 [0,1,0,0,0,1|1,0,0]=3 2708 B15R1.981 COC(=O)CC(=O)Cc1ccc(cc1)Cl 1458a_100000211351_100000694040 [0,1,0,0,0,1|1,0,0]=3 2709 B15R1.981 COC(=O)CC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000747449 [0,1,0,0,0,1|1,0,0]=3 2710 B15R1.981 COC(=O)CC(=O)Cc1ccc(cc1)F 1458a_100000211351_100000198546 [0,1,0,0,0,1|1,0,0]=3 2711 B15R1.981 COC(=O)CC(=O)Cc1ccc(cc1)I 1458a_100000211351_100000189116 [0,1,0,0,0,1|1,0,0]=3 2712 B15R1.981 COC(=O)CC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000747449 [0,1,0,0,0,1|1,0,0]=3 2713 B15R1.981 COC(=O)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000747449 [0,1,0,0,0,1|0,0,0]=2 2714 B15R1.981 COC(=O)CC(=O)Cc1ccc(cn1)Br 1458a_100000211351_100000702658 [0,1,0,0,0,1|2,0,0]=4 2715 B15R1.981 COC(=O)CC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000747449 [0,1,0,0,0,1|2,0,0]=4 2716 B15R1.981 COC(=O)CC(=O)Cc1ccc(cn1)C 1458a_100000211351_100000691093 [0,1,0,0,0,1|2,0,0]=4 2717 B15R1.981 COC(=O)CC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000747449 [0,1,0,0,0,1|2,0,0]=4 2718 B15R1.981 COC(=O)CC(=O)Cc1ccc(cn1)Cl 1458a_100000211351_100012066911 [0,1,0,0,0,1|2,0,0]=4 2719 B15R1.981 COC(=O)CC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000747449 [0,1,0,0,0,1|2,0,0]=4 2720 B15R1.981 COC(=O)CC(=O)Cc1ccc(cn1)F 1458a_100000211351_100000703193 [0,1,0,0,0,1|2,0,0]=4 2721 B15R1.981 COC(=O)CC(=O)Cc1ccc(nc1)Br 1458a_100000211351_100009831999 [0,1,0,0,0,1|2,0,0]=4 2722 B15R1.981 COC(=O)CC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000747449 [0,1,0,0,0,1|2,0,0]=4 2723 B15R1.981 COC(=O)CC(=O)Cc1ccc(nc1)C 1458a_100000211351_100016987292 [0,1,0,0,0,1|2,0,0]=4 2724 B15R1.981 COC(=O)CC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000747449 [0,1,0,0,0,1|2,0,0]=4 2725 B15R1.981 COC(=O)CC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000747449 [0,1,0,0,0,1|2,0,0]=4 2726 B15R1.981 COC(=O)CC(=O)Cc1ccc(nc1)Cl 1458a_100000211351_100000735431 [0,1,0,0,0,1|2,0,0]=4 2727 B15R1.981 COC(=O)CC(=O)Cc1ccc(nc1)F 1458a_100000211351_100009820150 [0,1,0,0,0,1|2,0,0]=4 2728 B15R1.981 COC(=O)CC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000747449 [0,1,0,0,0,1|1,0,1]=4 2729 B15R1.981 COC(=O)CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000211351 [0,1,0,0,0,1|2,0,0]=4 2730 B15R1.981 COC(=O)CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000211351 [0,1,0,0,0,1|2,0,0]=4 2731 B15R1.981 COC(=O)CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000211351 [0,1,0,0,0,1|2,0,0]=4 2732 B15R1.981 COC(=O)CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000211351 [0,1,0,0,0,1|2,0,0]=4 2733 B15R1.981 COC(=O)CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000211351 [0,1,0,0,0,1|2,0,0]=4 2734 B15R1.981 COC(=O)CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000211351 [0,1,0,0,0,1|1,0,0]=3 2735 B15R1.981 COC(=O)CN(C)Cc1ccc(cc1)O 2230a_100000207500_100000747449 [0,1,0,0,0,1|2,0,0]=4 2736 B15R1.981 COC(=O)CN(C)Cc1ccc(cc1)O 269982a_100000207500_100000747449 [0,1,0,0,0,1|2,0,0]=4 2737 B15R1.981 C[C@@H](CO)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000059175 [0,1,0,0,0,1|1,0,1]=4 2738 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cc1)O 240690a_100000737577_100000198540 [0,1,0,0,0,1|1,0,1]=4 2739 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cc1)O 527a_100000737577_100000198540 [0,1,0,0,0,1|1,0,1]=4 2740 B15R1.981 Cc1ccc(cc1)NC(=O)CC(=O)CO 1458a_100000210174_100000182914 [0,1,0,0,0,1|2,0,0]=4 2741 B15R1.981 O=C(CO)CC(=O)Nc1ccc(cc1)Br 1458a_100000210174_100000183692 [0,1,0,0,0,1|2,0,0]=4 2742 B15R1.981 O=C(CO)CC(=O)Nc1ccc(cc1)Cl 1458a_100000210174_100000182960 [0,1,0,0,0,1|2,0,0]=4 2743 B15R1.981 O=C(CO)CC(=O)Nc1ccc(cc1)F 1458a_100000210174_100000181725 [0,1,0,0,0,1|2,0,0]=4 2744 B15R1.981 O=C(CO)CC(=O)Nc1ccc(cc1)I 1458a_100000210174_100000183000 [0,1,0,0,0,1|2,0,0]=4 2745 B15R1.981 O=C(CO)CC(=O)Nc1ccc(cc1)O 1458a_100000210174_100000233757 [0,1,0,0,0,1|1,0,0]=3 2746 B15R1.981 O=C(CO)CC(=O)Oc1ccc(cc1)Br 1458a_100000210174_200010760497 [0,1,0,0,0,1|2,0,0]=4 2747 B15R1.8426 C=C(C)CC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100000748629 [0,1,0,0,0,1|2,0,0]=4 2748 B15R1.8426 C=C(C)CC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100000748629 [0,1,0,0,0,1|2,0,0]=4 2749 B15R1.8426 C=C(F)CC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100009893438 [0,1,0,0,0,1|2,0,0]=4 2750 B15R1.8426 C=C(F)CC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100009893438 [0,1,0,0,0,1|2,0,0]=4 2751 B15R1.8426 CC(O)CC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100011218427 [0,1,0,0,0,1|1,0,1]=4 2752 B15R1.8426 CC(O)CC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100011218427 [0,1,0,0,0,1|1,0,1]=4 2753 B15R1.8426 Cc1cc(ccc1CC(=O)CC(=O)N)Br 1458a_100000697930_100000187820 [0,1,0,0,0,1|2,0,0]=4 2754 B15R1.8426 Cc1cc(ccc1CC(=O)CC(=O)N)Br 1458a_100134613110_100000708836 [0,1,0,0,0,1|2,0,0]=4 2755 B15R1.8426 Cc1cc(ccc1CC(=O)CC(=O)N)Cl 1458a_100134613110_100012361307 [0,1,0,0,0,1|2,0,0]=4 2756 B15R1.8426 Cc1cc(ccc1CC(=O)CC(=O)N)F 1458a_100011667441_100000187820 [0,1,0,0,0,1|2,0,0]=4 2757 B15R1.8426 Cc1cc(ccc1CC(=O)CC(=O)N)F 1458a_100134613110_100000700533 [0,1,0,0,0,1|2,0,0]=4 2758 B15R1.8426 Cc1cc(ccc1CC(=O)CC(=O)[O-])Br 1458a_100000697930_100020667443 [0,1,0,0,0,1|1,0,1]=4 2759 B15R1.8426 Cc1cc(ccc1CC(=O)CC(=O)[O-])F 1458a_100011667441_100020667443 [0,1,0,0,0,1|1,0,1]=4 2760 B15R1.8426 Cc1cc(ccc1NC(=O)CC(=O)N)O 22a_100000756630_100134613110 [0,1,0,0,0,1|2,0,0]=4 2761 B15R1.8426 Cc1cc(ccc1NC(=O)CC(=O)N)O 527a_100000756630_100134613110 [0,1,0,0,0,1|2,0,0]=4 2762 B15R1.8426 Cc1ccc(c(c1)C)CC(=O)CC(=O)N 1458a_100011236500_100000187820 [0,1,0,0,0,1|2,0,0]=4 2763 B15R1.8426 Cc1ccc(c(c1)C)CC(=O)CC(=O)N 1458a_100134613110_100011219618 [0,1,0,0,0,1|2,0,0]=4 2764 B15R1.8426 Cc1ccc(c(c1)C)CC(=O)CC(=O)[O-] 1458a_100011236500_100020667443 [0,1,0,0,0,1|1,0,1]=4 2765 B15R1.8426 Cc1ccc(c(c1)Cl)CC(=O)CC(=O)N 1458a_100134613110_100012349684 [0,1,0,0,0,1|2,0,0]=4 2766 B15R1.8426 Cc1ccc(c(c1)F)CC(=O)CC(=O)N 1458a_100000042674_100000187820 [0,1,0,0,0,1|2,0,0]=4 2767 B15R1.8426 Cc1ccc(c(c1)F)CC(=O)CC(=O)N 1458a_100134613110_100012002367 [0,1,0,0,0,1|2,0,0]=4 2768 B15R1.8426 Cc1ccc(c(c1)F)CC(=O)CC(=O)[O-] 1458a_100000042674_100020667443 [0,1,0,0,0,1|1,0,1]=4 2769 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_100000187820 [0,1,0,0,0,1|2,0,0]=4 2770 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1Br)Br 1458a_100134613110_200012351560 [0,1,0,0,0,1|2,0,0]=4 2771 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_100000187820 [0,1,0,0,0,1|2,0,0]=4 2772 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1Br)Cl 1458a_100134613110_100000755608 [0,1,0,0,0,1|2,0,0]=4 2773 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_100000187820 [0,1,0,0,0,1|2,0,0]=4 2774 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1Br)F 1458a_100134613110_100000243222 [0,1,0,0,0,1|2,0,0]=4 2775 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1Br)I 1458a_100134613110_100010146610 [0,1,0,0,0,1|2,0,0]=4 2776 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100000187820 [0,1,0,0,0,1|1,0,0]=3 2777 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_100000187820 [0,1,0,0,0,1|2,0,0]=4 2778 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1Cl)Br 1458a_100134613110_100011740631 [0,1,0,0,0,1|2,0,0]=4 2779 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100000187820 [0,1,0,0,0,1|2,0,0]=4 2780 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100134613110_100000188473 [0,1,0,0,0,1|2,0,0]=4 2781 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_100000187820 [0,1,0,0,0,1|2,0,0]=4 2782 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1Cl)F 1458a_100134613110_100011216360 [0,1,0,0,0,1|2,0,0]=4 2783 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_100000187820 [0,1,0,0,0,1|2,0,0]=4 2784 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1F)Br 1458a_100134613110_100000211606 [0,1,0,0,0,1|2,0,0]=4 2785 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_100000187820 [0,1,0,0,0,1|2,0,0]=4 2786 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1F)Cl 1458a_100134613110_100000709361 [0,1,0,0,0,1|2,0,0]=4 2787 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1F)F 1458a_100000684719_100000187820 [0,1,0,0,0,1|2,0,0]=4 2788 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1F)F 1458a_100134613110_100000748237 [0,1,0,0,0,1|2,0,0]=4 2789 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1F)I 1458a_100010149628_100000187820 [0,1,0,0,0,1|2,0,0]=4 2790 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1F)I 1458a_100134613110_100010244991 [0,1,0,0,0,1|2,0,0]=4 2791 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100000187820 [0,1,0,0,0,1|1,0,0]=3 2792 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1I)Br 1458a_100134613110_100010146615 [0,1,0,0,0,1|2,0,0]=4 2793 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1I)Cl 1458a_100134613110_100010254388 [0,1,0,0,0,1|2,0,0]=4 2794 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1I)F 1458a_100134613110_100012354799 [0,1,0,0,0,1|2,0,0]=4 2795 B15R1.8426 NC(=O)CC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100000187820 [0,1,0,0,0,1|2,0,0]=4 2796 B15R1.8426 NC(=O)CC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100134613110 [0,1,0,0,0,1|2,0,0]=4 2797 B15R1.8426 NC(=O)CC(=O)Nc1ccc(cc1Br)O 527a_100012001276_100134613110 [0,1,0,0,0,1|2,0,0]=4 2798 B15R1.8426 NC(=O)CC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100134613110 [0,1,0,0,0,1|2,0,0]=4 2799 B15R1.8426 NC(=O)CC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100134613110 [0,1,0,0,0,1|2,0,0]=4 2800 B15R1.8426 NC(=O)CC(=O)Nc1ccc(cc1F)O 22a_100000759473_100134613110 [0,1,0,0,0,1|2,0,0]=4 2801 B15R1.8426 NC(=O)CC(=O)Nc1ccc(cc1F)O 527a_100000759473_100134613110 [0,1,0,0,0,1|2,0,0]=4 2802 B15R1.8426 NC(=O)CC(=O)Nc1ccc(cc1I)O 22a_100010084370_100134613110 [0,1,0,0,0,1|2,0,0]=4 2803 B15R1.8426 NC(=O)CC(=O)Nc1ccc(cc1I)O 527a_100010084370_100134613110 [0,1,0,0,0,1|2,0,0]=4 2804 B15R1.8426 NC(=O)CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100134613110 [0,1,0,0,0,1|2,0,0]=4 2805 B15R1.8426 NC(=O)CC(=O)Nc1ccc(cc1O)O 527a_100000106777_100134613110 [0,1,0,0,0,1|2,0,0]=4 2806 B15R1.8426 O=C(Cc1ccc(cc1Br)O)C[N+](=O)[O-] 1458a_100010176083_100000761209 [0,1,0,0,0,1|1,0,1]=4 2807 B15R1.8426 O=C(Cc1ccc(cc1F)O)C[N+](=O)[O-] 1458a_100000090534_100000761209 [0,1,0,0,0,1|1,0,1]=4 2808 B15R1.8426 O=C([O-])CC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_100020667443 [0,1,0,0,0,1|1,0,1]=4 2809 B15R1.8426 O=C([O-])CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_100020667443 [0,1,0,0,0,1|1,0,1]=4 2810 B15R1.8426 O=C([O-])CC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_100020667443 [0,1,0,0,0,1|1,0,1]=4 2811 B15R1.8426 O=C([O-])CC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100020667443 [0,1,0,0,0,1|0,0,1]=3 2812 B15R1.8426 O=C([O-])CC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_100020667443 [0,1,0,0,0,1|1,0,1]=4 2813 B15R1.8426 O=C([O-])CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100020667443 [0,1,0,0,0,1|1,0,1]=4 2814 B15R1.8426 O=C([O-])CC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_100020667443 [0,1,0,0,0,1|1,0,1]=4 2815 B15R1.8426 O=C([O-])CC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_100020667443 [0,1,0,0,0,1|1,0,1]=4 2816 B15R1.8426 O=C([O-])CC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_100020667443 [0,1,0,0,0,1|1,0,1]=4 2817 B15R1.8426 O=C([O-])CC(=O)Cc1ccc(cc1F)F 1458a_100000684719_100020667443 [0,1,0,0,0,1|1,0,1]=4 2818 B15R1.8426 O=C([O-])CC(=O)Cc1ccc(cc1F)I 1458a_100010149628_100020667443 [0,1,0,0,0,1|1,0,1]=4 2819 B15R1.8426 O=C([O-])CC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100020667443 [0,1,0,0,0,1|0,0,1]=3 2820 B15R1.8426 O=C([O-])CC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100020667443 [0,1,0,0,0,1|1,0,1]=4 2821 B15R1.3 C#Cc1ccc(cc1)CC(=O)C(=O)NC 1458a_100011218921_100000140223 [0,2,0,0,0,0|2,0,0]=4 2822 B15R1.3 C#Cc1ccc(cc1)NC(=O)C(=O)OC 11a_100011215031_100000024059 [0,2,0,0,0,0|2,0,0]=4 2823 B15R1.3 C#Cc1ccc(cc1)NC(=O)C(=O)OC 1626a_100011215031_100000024059 [0,2,0,0,0,0|2,0,0]=4 2824 B15R1.3 C#Cc1ccc(cc1)NC(=O)C(=O)OC 527a_100011215031_100000024059 [0,2,0,0,0,0|2,0,0]=4 2825 B15R1.3 C/C=C(\C)/C(=O)Cc1ccc(cc1)CO 1458a_100020587367_100000067286 [0,2,0,0,0,0|2,0,0]=4 2826 B15R1.3 C=C(CO)C(=O)Nc1ccc(cc1)CO 22a_100011215238_200000705526 [0,2,0,0,0,0|2,0,0]=4 2827 B15R1.3 C=C(CO)C(=O)Nc1ccc(cc1)OC 22a_100000184247_200000705526 [0,2,0,0,0,0|2,0,0]=4 2828 B15R1.3 C=Cc1ccc(cc1)CC(=O)C(=O)NC 1458a_100011218921_100000034074 [0,2,0,0,0,0|2,0,0]=4 2829 B15R1.3 C=Cc1ccc(cc1)NC(=O)C(=O)OC 11a_100011218248_100000024059 [0,2,0,0,0,0|2,0,0]=4 2830 B15R1.3 C=Cc1ccc(cc1)NC(=O)C(=O)OC 1626a_100011218248_100000024059 [0,2,0,0,0,0|2,0,0]=4 2831 B15R1.3 C=Cc1ccc(cc1)NC(=O)C(=O)OC 527a_100011218248_100000024059 [0,2,0,0,0,0|2,0,0]=4 2832 B15R1.3 CCC(O)C(=O)Cc1ccc(cc1)CO 1458a_100011196387_100000067286 [0,2,0,0,0,0|1,0,1]=4 2833 B15R1.3 CCc1ccc(cc1)CC(=O)C(=O)NC 1458a_100011218921_100000747183 [0,2,0,0,0,0|2,0,0]=4 2834 B15R1.3 CCc1ccc(cc1)NC(=O)C(=O)OC 11a_100000211069_100000024059 [0,2,0,0,0,0|2,0,0]=4 2835 B15R1.3 CCc1ccc(cc1)NC(=O)C(=O)OC 1626a_100000211069_100000024059 [0,2,0,0,0,0|2,0,0]=4 2836 B15R1.3 CCc1ccc(cc1)NC(=O)C(=O)OC 527a_100000211069_100000024059 [0,2,0,0,0,0|2,0,0]=4 2837 B15R1.3 CNC(=O)C(=O)Cc1ccc(cc1)C#N 1458a_100011218921_100000184898 [0,2,0,0,0,0|2,0,0]=4 2838 B15R1.3 CNC(=O)C(=O)Cc1ccc(cc1)C=O 1458a_100011218921_100000075337 [0,2,0,0,0,0|1,0,1]=4 2839 B15R1.3 CNC(=O)C(=O)Cc1ccc(cc1)CO 1458a_100011218921_100000067286 [0,2,0,0,0,0|1,0,0]=3 2840 B15R1.3 CNC(=O)C(=O)Cc1ccc(cc1)SC 1458a_100011218921_100000181263 [0,2,0,0,0,0|1,1,0]=4 2841 B15R1.3 CNC(=O)C(=O)Cc1ccc(cn1)OC 1458a_100011218921_200000757186 [0,2,0,0,0,0|2,0,0]=4 2842 B15R1.3 CNC(=O)C(=O)Cc1ccc(nc1)OC 1458a_100011218921_100020631284 [0,2,0,0,0,0|2,0,0]=4 2843 B15R1.3 CNC(=O)C(=O)Nc1ccc(cc1)CO 22a_100011215238_100011218921 [0,2,0,0,0,0|2,0,0]=4 2844 B15R1.3 CNC(=O)C(=O)Nc1ccc(cc1)OC 1626a_100000184247_100011218921 [0,2,0,0,0,0|2,0,0]=4 2845 B15R1.3 CNC(=O)C(=O)Nc1ccc(cc1)OC 22a_100000184247_100011218921 [0,2,0,0,0,0|2,0,0]=4 2846 B15R1.3 CNC(=O)C(=O)Nc1ccc(cc1)OC 240690a_100102657272_100000199040 [0,2,0,0,0,0|2,0,0]=4 2847 B15R1.3 CNC(=O)C(=O)Nc1ccc(cc1)OC 527a_100000184247_100011218921 [0,2,0,0,0,0|2,0,0]=4 2848 B15R1.3 COC(=O)C(=O)Nc1ccc(cc1)C#N 11a_100000185469_100000024059 [0,2,0,0,0,0|2,0,0]=4 2849 B15R1.3 COC(=O)C(=O)Nc1ccc(cc1)C#N 1626a_100000185469_100000024059 [0,2,0,0,0,0|2,0,0]=4 2850 B15R1.3 COC(=O)C(=O)Nc1ccc(cc1)OC 11a_100000184247_100000024059 [0,2,0,0,0,0|1,0,0]=3 2851 B15R1.3 COC(=O)C(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000024059 [0,2,0,0,0,0|1,0,0]=3 2852 B15R1.3 COC(=O)C(=O)Nc1ccc(cc1)OC 527a_100000184247_100000024059 [0,2,0,0,0,0|1,0,0]=3 2853 B15R1.3 COC(=O)C(=O)Nc1ccc(cc1)SC 11a_100000212337_100000024059 [0,2,0,0,0,0|1,1,0]=4 2854 B15R1.3 COC(=O)C(=O)Nc1ccc(cc1)SC 527a_100000212337_100000024059 [0,2,0,0,0,0|1,1,0]=4 2855 B15R1.3 COC(=O)[C@H](N)Cc1ccc(cc1)OC 34a_100012184189_200000210301 [0,2,0,0,0,0|1,0,1]=4 2856 B15R1.3 COC(=O)[C@H](N)Cc1ccc(cc1)O[13CH3] 34a_100012184189_200025704644 [0,2,0,0,0,0|1,0,1]=4 2857 B15R1.3 COC(C)C(=O)Cc1ccc(cc1)CO 1458a_100000743197_100000067286 [0,2,0,0,0,0|1,0,1]=4 2858 B15R1.3 COc1ccc(cc1)CN(C)C(=O)CO 240690a_100000184145_100000210174 [0,2,0,0,0,0|2,0,0]=4 2859 B15R1.3 COc1ccc(cc1)CN(C)C(=O)CO 527a_100000184145_100000210174 [0,2,0,0,0,0|2,0,0]=4 2860 B15R1.3 O=C(Cc1ccc(cc1)CO)C(O)CO 1458a_100011215603_100000067286 [0,2,0,0,0,0|0,0,2]=4 2861 B15R1.6 COc1ccc(cc1)N(C)C(=O)C(=O)N 22a_100000220023_100011215815 [0,2,0,0,0,0|2,0,0]=4 2862 B15R1.16 CCOc1ccc(cc1)NC(=O)C(=O)N 22a_100000739623_100011215815 [0,2,0,0,0,0|2,0,0]=4 2863 B15R1.16 COCc1ccc(cc1)NC(=O)C(=O)N 22a_100000694113_100011215815 [0,2,0,0,0,0|2,0,0]=4 2864 B15R1.16 NC(=O)C(=O)Nc1ccc(cc1)CCO 22a_100011204434_100011215815 [0,2,0,0,0,0|2,0,0]=4 2865 B15R1.219 CC(C)(O)C(=O)Cc1ccc(cc1)CO 1458a_100000242741_100000067286 [0,2,0,0,0,0|1,0,1]=4 2866 B15R1.495 C=C(C)C(=O)Cc1ccc(cc1)B(O)O 1458a_100000185857_100009813762 [0,2,0,0,0,0|2,0,0]=4 2867 B15R1.495 CC(O)c1ccc(cc1)NC(=O)C(=O)N 22a_100011216399_100011215815 [0,2,0,0,0,0|2,0,0]=4 2868 B15R1.495 C[C@@H](O)C(=O)Cc1ccc(cc1)B(O)O 1458a_100000717761_100009813762 [0,2,0,0,0,0|1,0,1]=4 2869 B15R1.495 C[C@H](O)C(=O)Cc1ccc(cc1)B(O)O 1458a_217856618621_100009813762 [0,2,0,0,0,0|1,0,1]=4 2870 B15R1.495 O=C(Cc1ccc(cc1)B(O)O)C(O)O 1458a_100000233687_100009813762 [0,2,0,0,0,0|0,0,2]=4 2871 B15R1.1855 C=C(C)C(=O)Cc1ccc(cc1Br)OC 1458a_100000185857_100011982828 [0,2,0,0,0,0|2,0,0]=4 2872 B15R1.1855 C=C(C)C(=O)Cc1ccc(cc1Cl)OC 1458a_100000185857_200011830453 [0,2,0,0,0,0|2,0,0]=4 2873 B15R1.1855 C=C(C)C(=O)Cc1ccc(cc1F)OC 1458a_100000185857_100011260761 [0,2,0,0,0,0|2,0,0]=4 2874 B15R1.1855 COc1ccc(c(c1)Br)CC(=O)C(O)O 1458a_100000233687_100011982828 [0,2,0,0,0,0|0,0,2]=4 2875 B15R1.1855 COc1ccc(c(c1)Br)CC(=O)[C@@H](C)O 1458a_100000717761_100011982828 [0,2,0,0,0,0|1,0,1]=4 2876 B15R1.1855 COc1ccc(c(c1)Br)CC(=O)[C@H](C)O 1458a_217856618621_100011982828 [0,2,0,0,0,0|1,0,1]=4 2877 B15R1.1855 COc1ccc(c(c1)Br)NC(=O)C(=O)N 22a_100015195136_100011215815 [0,2,0,0,0,0|2,0,0]=4 2878 B15R1.1855 COc1ccc(c(c1)C)NC(=O)C(=O)N 22a_100000750285_100011215815 [0,2,0,0,0,0|2,0,0]=4 2879 B15R1.1855 COc1ccc(c(c1)Cl)CC(=O)C(O)O 1458a_100000233687_200011830453 [0,2,0,0,0,0|0,0,2]=4 2880 B15R1.1855 COc1ccc(c(c1)Cl)CC(=O)[C@@H](C)O 1458a_100000717761_200011830453 [0,2,0,0,0,0|1,0,1]=4 2881 B15R1.1855 COc1ccc(c(c1)Cl)CC(=O)[C@H](C)O 1458a_217856618621_200011830453 [0,2,0,0,0,0|1,0,1]=4 2882 B15R1.1855 COc1ccc(c(c1)Cl)NC(=O)C(=O)N 22a_100000747055_100011215815 [0,2,0,0,0,0|2,0,0]=4 2883 B15R1.1855 COc1ccc(c(c1)F)CC(=O)C(O)O 1458a_100000233687_100011260761 [0,2,0,0,0,0|0,0,2]=4 2884 B15R1.1855 COc1ccc(c(c1)F)CC(=O)[C@@H](C)O 1458a_100000717761_100011260761 [0,2,0,0,0,0|1,0,1]=4 2885 B15R1.1855 COc1ccc(c(c1)F)CC(=O)[C@H](C)O 1458a_217856618621_100011260761 [0,2,0,0,0,0|1,0,1]=4 2886 B15R1.1855 COc1ccc(c(c1)F)NC(=O)C(=O)N 22a_100011299463_100011215815 [0,2,0,0,0,0|2,0,0]=4 2887 B15R1.1855 COc1ccc(c(c1)I)NC(=O)C(=O)N 22a_100000049804_100011215815 [0,2,0,0,0,0|2,0,0]=4 2888 B15R1.1855 COc1ccc(c(c1)O)NC(=O)C(=O)N 22a_100016989039_100011215815 [0,2,0,0,0,0|2,0,0]=4 2889 B15R1.1855 Cc1cc(ccc1NC(=O)C(=O)N)CO 22a_200011997030_100011215815 [0,2,0,0,0,0|2,0,0]=4 2890 B15R1.3777 C=C(C)C(=O)Cc1ccc(c(c1)Br)OC 1458a_100000185857_200011397701 [0,2,0,0,0,0|2,0,0]=4 2891 B15R1.3777 C=C(C)C(=O)Cc1ccc(c(c1)C)OC 1458a_100000185857_200011290836 [0,2,0,0,0,0|2,0,0]=4 2892 B15R1.3777 C=C(C)C(=O)Cc1ccc(c(c1)Cl)OC 1458a_100000185857_100000693707 [0,2,0,0,0,0|2,0,0]=4 2893 B15R1.3777 C=C(C)C(=O)Cc1ccc(c(c1)F)OC 1458a_100000185857_100000189595 [0,2,0,0,0,0|2,0,0]=4 2894 B15R1.3777 COc1ccc(cc1Br)CC(=O)C(O)O 1458a_100000233687_200011397701 [0,2,0,0,0,0|0,0,2]=4 2895 B15R1.3777 COc1ccc(cc1Br)CC(=O)[C@@H](C)O 1458a_100000717761_200011397701 [0,2,0,0,0,0|1,0,1]=4 2896 B15R1.3777 COc1ccc(cc1Br)CC(=O)[C@H](C)O 1458a_217856618621_200011397701 [0,2,0,0,0,0|1,0,1]=4 2897 B15R1.3777 COc1ccc(cc1Br)NC(=O)C(=O)N 22a_100000187427_100011215815 [0,2,0,0,0,0|2,0,0]=4 2898 B15R1.3777 COc1ccc(cc1C)CC(=O)C(O)O 1458a_100000233687_200011290836 [0,2,0,0,0,0|0,0,2]=4 2899 B15R1.3777 COc1ccc(cc1C)CC(=O)[C@@H](C)O 1458a_100000717761_200011290836 [0,2,0,0,0,0|1,0,1]=4 2900 B15R1.3777 COc1ccc(cc1C)CC(=O)[C@H](C)O 1458a_217856618621_200011290836 [0,2,0,0,0,0|1,0,1]=4 2901 B15R1.3777 COc1ccc(cc1C)NC(=O)C(=O)N 22a_100000743268_100011215815 [0,2,0,0,0,0|2,0,0]=4 2902 B15R1.3777 COc1ccc(cc1Cl)CC(=O)C(O)O 1458a_100000233687_100000693707 [0,2,0,0,0,0|0,0,2]=4 2903 B15R1.3777 COc1ccc(cc1Cl)CC(=O)[C@@H](C)O 1458a_100000717761_100000693707 [0,2,0,0,0,0|1,0,1]=4 2904 B15R1.3777 COc1ccc(cc1Cl)CC(=O)[C@H](C)O 1458a_217856618621_100000693707 [0,2,0,0,0,0|1,0,1]=4 2905 B15R1.3777 COc1ccc(cc1Cl)NC(=O)C(=O)N 22a_100000211044_100011215815 [0,2,0,0,0,0|2,0,0]=4 2906 B15R1.3777 COc1ccc(cc1F)CC(=O)C(O)O 1458a_100000233687_100000189595 [0,2,0,0,0,0|0,0,2]=4 2907 B15R1.3777 COc1ccc(cc1F)CC(=O)[C@@H](C)O 1458a_100000717761_100000189595 [0,2,0,0,0,0|1,0,1]=4 2908 B15R1.3777 COc1ccc(cc1F)CC(=O)[C@H](C)O 1458a_217856618621_100000189595 [0,2,0,0,0,0|1,0,1]=4 2909 B15R1.3777 COc1ccc(cc1F)NC(=O)C(=O)N 22a_100000740183_100011215815 [0,2,0,0,0,0|2,0,0]=4 2910 B15R1.3777 COc1ccc(cc1I)NC(=O)C(=O)N 22a_100011356947_100011215815 [0,2,0,0,0,0|2,0,0]=4 2911 B15R1.3777 COc1ccc(cc1O)NC(=O)C(=O)N 22a_100000211920_100011215815 [0,2,0,0,0,0|2,0,0]=4 2912 B15R1.3777 Cc1cc(ccc1CO)NC(=O)C(=O)N 22a_100000102464_100011215815 [0,2,0,0,0,0|2,0,0]=4 2913 B15R1.3777 NC(=O)C(=O)Nc1ccc(c(c1)Cl)CO 22a_100000689119_100011215815 [0,2,0,0,0,0|2,0,0]=4 2914 B15R1.75 C=C(CO)C(=O)N(C)c1ccc(cc1)O 22a_100000182112_200000705526 [0,2,0,0,0,0|2,0,0]=4 2915 B15R1.75 CNC(=O)C(=O)C(C)c1ccc(cc1)Br 1458a_100011218921_100000755118 [0,2,0,0,0,0|2,0,0]=4 2916 B15R1.75 CNC(=O)C(=O)C(C)c1ccc(cc1)C 1458a_100011218921_100011261388 [0,2,0,0,0,0|2,0,0]=4 2917 B15R1.75 CNC(=O)C(=O)C(C)c1ccc(cc1)Cl 1458a_100011218921_100000684792 [0,2,0,0,0,0|2,0,0]=4 2918 B15R1.75 CNC(=O)C(=O)C(C)c1ccc(cc1)F 1458a_100011218921_100000743420 [0,2,0,0,0,0|2,0,0]=4 2919 B15R1.75 CNC(=O)C(=O)N(C)c1ccc(cc1)O 22a_100000182112_100011218921 [0,2,0,0,0,0|2,0,0]=4 2920 B15R1.75 CNC(=O)C(=O)N(C)c1ccc(cc1)O 527a_100000182112_100011218921 [0,2,0,0,0,0|2,0,0]=4 2921 B15R1.75 COC(=O)C(=O)N(C)c1ccc(cc1)Br 11a_100000219623_100000024059 [0,2,0,0,0,0|2,0,0]=4 2922 B15R1.75 COC(=O)C(=O)N(C)c1ccc(cc1)Br 1626a_100000219623_100000024059 [0,2,0,0,0,0|2,0,0]=4 2923 B15R1.75 COC(=O)C(=O)N(C)c1ccc(cc1)C 11a_100000219977_100000024059 [0,2,0,0,0,0|2,0,0]=4 2924 B15R1.75 COC(=O)C(=O)N(C)c1ccc(cc1)C 1626a_100000219977_100000024059 [0,2,0,0,0,0|2,0,0]=4 2925 B15R1.75 COC(=O)C(=O)N(C)c1ccc(cc1)Cl 11a_100020629279_100000024059 [0,2,0,0,0,0|2,0,0]=4 2926 B15R1.75 COC(=O)C(=O)N(C)c1ccc(cc1)Cl 1626a_100020629279_100000024059 [0,2,0,0,0,0|2,0,0]=4 2927 B15R1.75 COC(=O)C(=O)N(C)c1ccc(cc1)F 11a_100000219829_100000024059 [0,2,0,0,0,0|2,0,0]=4 2928 B15R1.75 COC(=O)C(=O)N(C)c1ccc(cc1)F 1626a_100000219829_100000024059 [0,2,0,0,0,0|2,0,0]=4 2929 B15R1.75 COC(=O)C(=O)N(C)c1ccc(cc1)I 11a_100000743151_100000024059 [0,2,0,0,0,0|2,0,0]=4 2930 B15R1.75 COC(=O)C(=O)N(C)c1ccc(cc1)I 1626a_100000743151_100000024059 [0,2,0,0,0,0|2,0,0]=4 2931 B15R1.75 COC(=O)C(=O)N(C)c1ccc(cc1)O 527a_100000182112_100000024059 [0,2,0,0,0,0|1,0,0]=3 2932 B15R1.1353 CCN(C(=O)C(=O)N)c1ccc(cc1)O 22a_100011337800_100011215815 [0,2,0,0,0,0|2,0,0]=4 2933 B15R1.8411 Cc1cc(ccc1N(C)C(=O)C(=O)N)O 22a_100161107805_100011215815 [0,2,0,0,0,0|2,0,0]=4 2934 B15R1.48 CC(CCO)C(=O)Cc1ccc(cc1)O 1458a_100000198540_100009893172 [0,2,0,0,0,0|1,0,1]=4 2935 B15R1.48 CCNC(=O)C(=O)Cc1ccc(cc1)Br 1458a_200011297158_100000189115 [0,2,0,0,0,0|2,0,0]=4 2936 B15R1.48 CCNC(=O)C(=O)Cc1ccc(cc1)C 1458a_200011297158_100000210814 [0,2,0,0,0,0|2,0,0]=4 2937 B15R1.48 CCNC(=O)C(=O)Cc1ccc(cc1)Cl 1458a_200011297158_100000694040 [0,2,0,0,0,0|2,0,0]=4 2938 B15R1.48 CCNC(=O)C(=O)Cc1ccc(cc1)F 1458a_200011297158_100000198546 [0,2,0,0,0,0|2,0,0]=4 2939 B15R1.48 CCNC(=O)C(=O)Cc1ccc(cc1)I 1458a_200011297158_100000189116 [0,2,0,0,0,0|2,0,0]=4 2940 B15R1.48 CCNC(=O)C(=O)Nc1ccc(cc1)O 22a_100000185829_200011297158 [0,2,0,0,0,0|2,0,0]=4 2941 B15R1.48 CCOC(=O)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100014798877 [0,2,0,0,0,0|2,0,0]=4 2942 B15R1.48 CCOC(=O)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100014798877 [0,2,0,0,0,0|2,0,0]=4 2943 B15R1.48 CCOC(=O)C(=O)Nc1ccc(cc1)C 11a_100000124888_100014798877 [0,2,0,0,0,0|2,0,0]=4 2944 B15R1.48 CCOC(=O)C(=O)Nc1ccc(cc1)C 1626a_100000124888_100014798877 [0,2,0,0,0,0|2,0,0]=4 2945 B15R1.48 CCOC(=O)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100014798877 [0,2,0,0,0,0|2,0,0]=4 2946 B15R1.48 CCOC(=O)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100014798877 [0,2,0,0,0,0|2,0,0]=4 2947 B15R1.48 CCOC(=O)C(=O)Nc1ccc(cc1)F 11a_100000185862_100014798877 [0,2,0,0,0,0|2,0,0]=4 2948 B15R1.48 CCOC(=O)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100014798877 [0,2,0,0,0,0|2,0,0]=4 2949 B15R1.48 CCOC(=O)C(=O)Nc1ccc(cc1)I 11a_100000185761_100014798877 [0,2,0,0,0,0|2,0,0]=4 2950 B15R1.48 CCOC(=O)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100014798877 [0,2,0,0,0,0|2,0,0]=4 2951 B15R1.48 CCOC(=O)C(=O)Nc1ccc(cc1)O 271570a_203496583355_200000187817 [0,2,0,0,0,0|1,0,0]=3 2952 B15R1.48 CN(CCO)C(=O)Cc1ccc(cc1)O 240690a_100000210263_100000198540 [0,2,0,0,0,0|2,0,0]=4 2953 B15R1.48 CN(CCO)C(=O)Cc1ccc(cc1)O 527a_100000210263_100000198540 [0,2,0,0,0,0|2,0,0]=4 2954 B15R1.48 CN(Cc1ccc(cc1)O)C(=O)CCO 240690a_100000207500_100011216618 [0,2,0,0,0,0|2,0,0]=4 2955 B15R1.48 CO/N=C(\C)/C(=O)Cc1ccc(cc1)Br 1458a_100160996864_100000189115 [0,2,0,0,0,0|2,0,0]=4 2956 B15R1.48 CO/N=C(\C)/C(=O)Cc1ccc(cc1)C 1458a_100160996864_100000210814 [0,2,0,0,0,0|2,0,0]=4 2957 B15R1.48 CO/N=C(\C)/C(=O)Cc1ccc(cc1)Cl 1458a_100160996864_100000694040 [0,2,0,0,0,0|2,0,0]=4 2958 B15R1.48 CO/N=C(\C)/C(=O)Cc1ccc(cc1)F 1458a_100160996864_100000198546 [0,2,0,0,0,0|2,0,0]=4 2959 B15R1.48 CO/N=C(\C)/C(=O)Cc1ccc(cc1)I 1458a_100160996864_100000189116 [0,2,0,0,0,0|2,0,0]=4 2960 B15R1.48 CO/N=C(\C)/C(=O)Nc1ccc(cc1)O 22a_100000185829_100160996864 [0,2,0,0,0,0|2,0,0]=4 2961 B15R1.48 COCC(=O)N(C)Cc1ccc(cc1)O 240690a_100000207500_100000210968 [0,2,0,0,0,0|2,0,0]=4 2962 B15R1.48 COCC(=O)N(C)Cc1ccc(cc1)O 527a_100000207500_100000210968 [0,2,0,0,0,0|2,0,0]=4 2963 B15R1.48 COCC(C)C(=O)Cc1ccc(cc1)O 1458a_100000198540_100000765312 [0,2,0,0,0,0|1,0,1]=4 2964 B15R1.48 Cc1ccc(cc1)NC(=O)C(=O)CCO 1458a_100000189662_100000211926 [0,2,0,0,0,0|2,0,0]=4 2965 B15R1.48 O=C(CCO)C(O)Cc1ccc(cc1)O 1458a_100015278814_100000211926 [0,2,0,0,0,0|0,0,2]=4 2966 B15R1.1373 CCN(Cc1ccc(cc1)O)C(=O)CO 240690a_100000748449_100000210174 [0,2,0,0,0,0|2,0,0]=4 2967 B15R1.1373 COC(=O)C(C=O)Nc1ccc(cc1)O 34a_100000185829_100000046368 [0,2,0,0,0,0|1,0,1]=4 2968 B15R1.1373 COC(=O)C(C=O)Sc1ccc(cc1)O 62a_100000046368_100000185759 [0,2,0,0,0,0|1,0,1]=4 2969 B15R1.5521 C=C(CO)C(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_200000705526 [0,2,0,0,0,0|2,0,0]=4 2970 B15R1.5521 C=C(CO)C(=O)Nc1ccc(c(c1)C)O 22a_100011218179_200000705526 [0,2,0,0,0,0|2,0,0]=4 2971 B15R1.5521 C=C(CO)C(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_200000705526 [0,2,0,0,0,0|2,0,0]=4 2972 B15R1.5521 C=C(CO)C(=O)Nc1ccc(c(c1)F)O 22a_100011220035_200000705526 [0,2,0,0,0,0|2,0,0]=4 2973 B15R1.5521 C=C(CO)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_200000705526 [0,2,0,0,0,0|2,0,0]=4 2974 B15R1.5521 CN(Cc1ccc(c(c1)O)O)C(=O)CO 240690a_100020587154_100000210174 [0,2,0,0,0,0|2,0,0]=4 2975 B15R1.5521 CNC(=O)C(=O)Cc1cc(=O)c(co1)O 1458a_100011218921_100000010605 [0,2,0,0,0,0|2,0,0]=4 2976 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)Br)Br 1458a_100011218921_100012353900 [0,2,0,0,0,0|2,0,0]=4 2977 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)Br)C 1458a_100011218921_100012232412 [0,2,0,0,0,0|2,0,0]=4 2978 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)Br)Cl 1458a_100011218921_100012353894 [0,2,0,0,0,0|2,0,0]=4 2979 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)Br)F 1458a_100011218921_100011206884 [0,2,0,0,0,0|2,0,0]=4 2980 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)C)Br 1458a_100011218921_100000727479 [0,2,0,0,0,0|2,0,0]=4 2981 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)C)C 1458a_100011218921_100000742320 [0,2,0,0,0,0|2,0,0]=4 2982 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)C)Cl 1458a_100011218921_100012184735 [0,2,0,0,0,0|2,0,0]=4 2983 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)C)F 1458a_100011218921_100011216667 [0,2,0,0,0,0|2,0,0]=4 2984 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)Cl)Br 1458a_100011218921_100012353895 [0,2,0,0,0,0|2,0,0]=4 2985 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)Cl)C 1458a_100011218921_100011823929 [0,2,0,0,0,0|2,0,0]=4 2986 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100011218921_100000184707 [0,2,0,0,0,0|2,0,0]=4 2987 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)Cl)F 1458a_100011218921_100000717365 [0,2,0,0,0,0|2,0,0]=4 2988 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)Cl)I 1458a_100011218921_100012349665 [0,2,0,0,0,0|2,0,0]=4 2989 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)F)Br 1458a_100011218921_100000767054 [0,2,0,0,0,0|2,0,0]=4 2990 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)F)C 1458a_100011218921_100011217369 [0,2,0,0,0,0|2,0,0]=4 2991 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)F)Cl 1458a_100011218921_100000716492 [0,2,0,0,0,0|2,0,0]=4 2992 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)F)F 1458a_100011218921_100000757363 [0,2,0,0,0,0|2,0,0]=4 2993 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)F)I 1458a_100011218921_100010149604 [0,2,0,0,0,0|2,0,0]=4 2994 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)I)Br 1458a_100011218921_100010146616 [0,2,0,0,0,0|2,0,0]=4 2995 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)I)C 1458a_100011218921_100010206137 [0,2,0,0,0,0|2,0,0]=4 2996 B15R1.5521 CNC(=O)C(=O)Cc1ccc(c(c1)I)F 1458a_100011218921_100010188208 [0,2,0,0,0,0|2,0,0]=4 2997 B15R1.5521 CNC(=O)C(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100011218921 [0,2,0,0,0,0|2,0,0]=4 2998 B15R1.5521 CNC(=O)C(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100011218921 [0,2,0,0,0,0|2,0,0]=4 2999 B15R1.5521 CNC(=O)C(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100011218921 [0,2,0,0,0,0|2,0,0]=4 3000 B15R1.5521 CNC(=O)C(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100011218921 [0,2,0,0,0,0|2,0,0]=4 3001 B15R1.5521 CNC(=O)C(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100011218921 [0,2,0,0,0,0|2,0,0]=4 3002 B15R1.5521 CNC(=O)C(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100011218921 [0,2,0,0,0,0|2,0,0]=4 3003 B15R1.5521 CNC(=O)C(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100011218921 [0,2,0,0,0,0|2,0,0]=4 3004 B15R1.5521 CNC(=O)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100011218921 [0,2,0,0,0,0|2,0,0]=4 3005 B15R1.5521 CNC(=O)C(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100011218921 [0,2,0,0,0,0|2,0,0]=4 3006 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)Br 11a_100011306057_100000024059 [0,2,0,0,0,0|2,0,0]=4 3007 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)Br 1626a_100011306057_100000024059 [0,2,0,0,0,0|2,0,0]=4 3008 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)Br 527a_100011306057_100000024059 [0,2,0,0,0,0|2,0,0]=4 3009 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)C 11a_100000736455_100000024059 [0,2,0,0,0,0|2,0,0]=4 3010 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)C 1626a_100000736455_100000024059 [0,2,0,0,0,0|2,0,0]=4 3011 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)C 527a_100000736455_100000024059 [0,2,0,0,0,0|2,0,0]=4 3012 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)Cl 11a_100000686031_100000024059 [0,2,0,0,0,0|2,0,0]=4 3013 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)Cl 1626a_100000686031_100000024059 [0,2,0,0,0,0|2,0,0]=4 3014 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)Cl 527a_100000686031_100000024059 [0,2,0,0,0,0|2,0,0]=4 3015 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)F 11a_100000760356_100000024059 [0,2,0,0,0,0|2,0,0]=4 3016 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)F 1626a_100000760356_100000024059 [0,2,0,0,0,0|2,0,0]=4 3017 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)F 527a_100000760356_100000024059 [0,2,0,0,0,0|2,0,0]=4 3018 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)I 11a_100000750458_100000024059 [0,2,0,0,0,0|2,0,0]=4 3019 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)I 1626a_100000750458_100000024059 [0,2,0,0,0,0|2,0,0]=4 3020 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)I 527a_100000750458_100000024059 [0,2,0,0,0,0|2,0,0]=4 3021 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100000024059 [0,2,0,0,0,0|1,0,0]=3 3022 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)Br 11a_100000210723_100000024059 [0,2,0,0,0,0|2,0,0]=4 3023 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)Br 1626a_100000210723_100000024059 [0,2,0,0,0,0|2,0,0]=4 3024 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)Br 527a_100000210723_100000024059 [0,2,0,0,0,0|2,0,0]=4 3025 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)C 11a_100000724040_100000024059 [0,2,0,0,0,0|2,0,0]=4 3026 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)C 1626a_100000724040_100000024059 [0,2,0,0,0,0|2,0,0]=4 3027 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)C 527a_100000724040_100000024059 [0,2,0,0,0,0|2,0,0]=4 3028 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)Cl 11a_100000187808_100000024059 [0,2,0,0,0,0|2,0,0]=4 3029 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)Cl 1626a_100000187808_100000024059 [0,2,0,0,0,0|2,0,0]=4 3030 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)Cl 527a_100000187808_100000024059 [0,2,0,0,0,0|2,0,0]=4 3031 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)F 11a_100000750164_100000024059 [0,2,0,0,0,0|2,0,0]=4 3032 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)F 1626a_100000750164_100000024059 [0,2,0,0,0,0|2,0,0]=4 3033 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)F 527a_100000750164_100000024059 [0,2,0,0,0,0|2,0,0]=4 3034 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)I 11a_100000198070_100000024059 [0,2,0,0,0,0|2,0,0]=4 3035 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)I 1626a_100000198070_100000024059 [0,2,0,0,0,0|2,0,0]=4 3036 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)I 527a_100000198070_100000024059 [0,2,0,0,0,0|2,0,0]=4 3037 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100000024059 [0,2,0,0,0,0|1,0,0]=3 3038 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100000024059 [0,2,0,0,0,0|1,0,0]=3 3039 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Cl)Br 11a_100000687081_100000024059 [0,2,0,0,0,0|2,0,0]=4 3040 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Cl)Br 1626a_100000687081_100000024059 [0,2,0,0,0,0|2,0,0]=4 3041 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Cl)Br 527a_100000687081_100000024059 [0,2,0,0,0,0|2,0,0]=4 3042 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Cl)C 11a_100000188892_100000024059 [0,2,0,0,0,0|2,0,0]=4 3043 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Cl)C 1626a_100000188892_100000024059 [0,2,0,0,0,0|2,0,0]=4 3044 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Cl)C 527a_100000188892_100000024059 [0,2,0,0,0,0|2,0,0]=4 3045 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Cl)Cl 11a_100000184108_100000024059 [0,2,0,0,0,0|2,0,0]=4 3046 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Cl)Cl 1626a_100000184108_100000024059 [0,2,0,0,0,0|2,0,0]=4 3047 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Cl)Cl 527a_100000184108_100000024059 [0,2,0,0,0,0|2,0,0]=4 3048 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Cl)F 11a_100000211060_100000024059 [0,2,0,0,0,0|2,0,0]=4 3049 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Cl)F 1626a_100000211060_100000024059 [0,2,0,0,0,0|2,0,0]=4 3050 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Cl)F 527a_100000211060_100000024059 [0,2,0,0,0,0|2,0,0]=4 3051 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Cl)I 11a_100000761885_100000024059 [0,2,0,0,0,0|2,0,0]=4 3052 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)Cl)I 1626a_100000761885_100000024059 [0,2,0,0,0,0|2,0,0]=4 3053 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)F)Br 11a_100000759894_100000024059 [0,2,0,0,0,0|2,0,0]=4 3054 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)F)Br 1626a_100000759894_100000024059 [0,2,0,0,0,0|2,0,0]=4 3055 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)F)Br 527a_100000759894_100000024059 [0,2,0,0,0,0|2,0,0]=4 3056 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)F)C 11a_100000210958_100000024059 [0,2,0,0,0,0|2,0,0]=4 3057 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)F)C 1626a_100000210958_100000024059 [0,2,0,0,0,0|2,0,0]=4 3058 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)F)C 527a_100000210958_100000024059 [0,2,0,0,0,0|2,0,0]=4 3059 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)F)Cl 11a_100000739366_100000024059 [0,2,0,0,0,0|2,0,0]=4 3060 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)F)Cl 1626a_100000739366_100000024059 [0,2,0,0,0,0|2,0,0]=4 3061 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)F)F 11a_100000210724_100000024059 [0,2,0,0,0,0|2,0,0]=4 3062 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)F)F 1626a_100000210724_100000024059 [0,2,0,0,0,0|2,0,0]=4 3063 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)F)I 11a_100011356925_100000024059 [0,2,0,0,0,0|2,0,0]=4 3064 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)F)I 1626a_100011356925_100000024059 [0,2,0,0,0,0|2,0,0]=4 3065 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100000024059 [0,2,0,0,0,0|1,0,0]=3 3066 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)I)Br 11a_100000750459_100000024059 [0,2,0,0,0,0|2,0,0]=4 3067 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)I)Br 1626a_100000750459_100000024059 [0,2,0,0,0,0|2,0,0]=4 3068 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)I)Br 527a_100000750459_100000024059 [0,2,0,0,0,0|2,0,0]=4 3069 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)I)C 11a_100000184131_100000024059 [0,2,0,0,0,0|2,0,0]=4 3070 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)I)C 1626a_100000184131_100000024059 [0,2,0,0,0,0|2,0,0]=4 3071 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)I)C 527a_100000184131_100000024059 [0,2,0,0,0,0|2,0,0]=4 3072 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)I)Cl 11a_100012360549_100000024059 [0,2,0,0,0,0|2,0,0]=4 3073 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)I)Cl 1626a_100012360549_100000024059 [0,2,0,0,0,0|2,0,0]=4 3074 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)I)Cl 527a_100012360549_100000024059 [0,2,0,0,0,0|2,0,0]=4 3075 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)I)F 11a_114828291077_100000024059 [0,2,0,0,0,0|2,0,0]=4 3076 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)I)F 1626a_114828291077_100000024059 [0,2,0,0,0,0|2,0,0]=4 3077 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)I)F 527a_114828291077_100000024059 [0,2,0,0,0,0|2,0,0]=4 3078 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)O)C 11a_100000759471_100000024059 [0,2,0,0,0,0|2,0,0]=4 3079 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)O)C 527a_100000759471_100000024059 [0,2,0,0,0,0|2,0,0]=4 3080 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)O)F 527a_100012017398_100000024059 [0,2,0,0,0,0|2,0,0]=4 3081 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000024059 [0,2,0,0,0,0|1,0,0]=3 3082 B15R1.14339 C=C(CO)C(=O)Nc1ccc(cc1Br)O 22a_100012001276_200000705526 [0,2,0,0,0,0|2,0,0]=4 3083 B15R1.14339 C=C(CO)C(=O)Nc1ccc(cc1C)O 22a_100000756630_200000705526 [0,2,0,0,0,0|2,0,0]=4 3084 B15R1.14339 C=C(CO)C(=O)Nc1ccc(cc1Cl)O 22a_100011215599_200000705526 [0,2,0,0,0,0|2,0,0]=4 3085 B15R1.14339 C=C(CO)C(=O)Nc1ccc(cc1F)O 22a_100000759473_200000705526 [0,2,0,0,0,0|2,0,0]=4 3086 B15R1.14339 C=C(CO)C(=O)Nc1ccc(cc1I)O 22a_100010084370_200000705526 [0,2,0,0,0,0|2,0,0]=4 3087 B15R1.14339 C=C(CO)C(=O)Nc1ccc(cc1O)O 22a_100000106777_200000705526 [0,2,0,0,0,0|2,0,0]=4 3088 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1Br)Br 1458a_100011218921_200012351560 [0,2,0,0,0,0|2,0,0]=4 3089 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1Br)Cl 1458a_100011218921_100000755608 [0,2,0,0,0,0|2,0,0]=4 3090 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1Br)F 1458a_100011218921_100000243222 [0,2,0,0,0,0|2,0,0]=4 3091 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1Br)I 1458a_100011218921_100010146610 [0,2,0,0,0,0|2,0,0]=4 3092 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1C)Br 1458a_100011218921_100000708836 [0,2,0,0,0,0|2,0,0]=4 3093 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1C)C 1458a_100011218921_100011219618 [0,2,0,0,0,0|2,0,0]=4 3094 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1C)Cl 1458a_100011218921_100012361307 [0,2,0,0,0,0|2,0,0]=4 3095 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1C)F 1458a_100011218921_100000700533 [0,2,0,0,0,0|2,0,0]=4 3096 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1Cl)Br 1458a_100011218921_100011740631 [0,2,0,0,0,0|2,0,0]=4 3097 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1Cl)C 1458a_100011218921_100012349684 [0,2,0,0,0,0|2,0,0]=4 3098 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1Cl)Cl 1458a_100011218921_100000188473 [0,2,0,0,0,0|2,0,0]=4 3099 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1Cl)F 1458a_100011218921_100011216360 [0,2,0,0,0,0|2,0,0]=4 3100 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1F)Br 1458a_100011218921_100000211606 [0,2,0,0,0,0|2,0,0]=4 3101 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1F)C 1458a_100011218921_100012002367 [0,2,0,0,0,0|2,0,0]=4 3102 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1F)Cl 1458a_100011218921_100000709361 [0,2,0,0,0,0|2,0,0]=4 3103 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1F)F 1458a_100011218921_100000748237 [0,2,0,0,0,0|2,0,0]=4 3104 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1F)I 1458a_100011218921_100010244991 [0,2,0,0,0,0|2,0,0]=4 3105 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1I)Br 1458a_100011218921_100010146615 [0,2,0,0,0,0|2,0,0]=4 3106 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1I)Cl 1458a_100011218921_100010254388 [0,2,0,0,0,0|2,0,0]=4 3107 B15R1.14339 CNC(=O)C(=O)Cc1ccc(cc1I)F 1458a_100011218921_100012354799 [0,2,0,0,0,0|2,0,0]=4 3108 B15R1.14339 CNC(=O)C(=O)Nc1ccc(cc1Br)O 22a_100012001276_100011218921 [0,2,0,0,0,0|2,0,0]=4 3109 B15R1.14339 CNC(=O)C(=O)Nc1ccc(cc1Br)O 527a_100012001276_100011218921 [0,2,0,0,0,0|2,0,0]=4 3110 B15R1.14339 CNC(=O)C(=O)Nc1ccc(cc1C)O 22a_100000756630_100011218921 [0,2,0,0,0,0|2,0,0]=4 3111 B15R1.14339 CNC(=O)C(=O)Nc1ccc(cc1C)O 527a_100000756630_100011218921 [0,2,0,0,0,0|2,0,0]=4 3112 B15R1.14339 CNC(=O)C(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100011218921 [0,2,0,0,0,0|2,0,0]=4 3113 B15R1.14339 CNC(=O)C(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100011218921 [0,2,0,0,0,0|2,0,0]=4 3114 B15R1.14339 CNC(=O)C(=O)Nc1ccc(cc1F)O 22a_100000759473_100011218921 [0,2,0,0,0,0|2,0,0]=4 3115 B15R1.14339 CNC(=O)C(=O)Nc1ccc(cc1F)O 527a_100000759473_100011218921 [0,2,0,0,0,0|2,0,0]=4 3116 B15R1.14339 CNC(=O)C(=O)Nc1ccc(cc1I)O 22a_100010084370_100011218921 [0,2,0,0,0,0|2,0,0]=4 3117 B15R1.14339 CNC(=O)C(=O)Nc1ccc(cc1I)O 527a_100010084370_100011218921 [0,2,0,0,0,0|2,0,0]=4 3118 B15R1.14339 CNC(=O)C(=O)Nc1ccc(cc1O)O 22a_100000106777_100011218921 [0,2,0,0,0,0|2,0,0]=4 3119 B15R1.14339 CNC(=O)C(=O)Nc1ccc(cc1O)O 527a_100000106777_100011218921 [0,2,0,0,0,0|2,0,0]=4 3120 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Br)Br 11a_100000211012_100000024059 [0,2,0,0,0,0|2,0,0]=4 3121 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Br)Br 1626a_100000211012_100000024059 [0,2,0,0,0,0|2,0,0]=4 3122 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Br)C 11a_100000210942_100000024059 [0,2,0,0,0,0|2,0,0]=4 3123 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Br)C 1626a_100000210942_100000024059 [0,2,0,0,0,0|2,0,0]=4 3124 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Br)Cl 11a_100000752454_100000024059 [0,2,0,0,0,0|2,0,0]=4 3125 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Br)Cl 1626a_100000752454_100000024059 [0,2,0,0,0,0|2,0,0]=4 3126 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Br)F 11a_100000738039_100000024059 [0,2,0,0,0,0|2,0,0]=4 3127 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Br)F 1626a_100000738039_100000024059 [0,2,0,0,0,0|2,0,0]=4 3128 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Br)I 11a_100000750455_100000024059 [0,2,0,0,0,0|2,0,0]=4 3129 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Br)I 1626a_100000750455_100000024059 [0,2,0,0,0,0|2,0,0]=4 3130 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Br)O 527a_100012001276_100000024059 [0,2,0,0,0,0|1,0,0]=3 3131 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1C)Br 11a_100000211769_100000024059 [0,2,0,0,0,0|2,0,0]=4 3132 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1C)Br 1626a_100000211769_100000024059 [0,2,0,0,0,0|2,0,0]=4 3133 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1C)C 11a_100000736561_100000024059 [0,2,0,0,0,0|2,0,0]=4 3134 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1C)C 1626a_100000736561_100000024059 [0,2,0,0,0,0|2,0,0]=4 3135 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1C)C 527a_100000736561_100000024059 [0,2,0,0,0,0|2,0,0]=4 3136 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1C)Cl 11a_100000210418_100000024059 [0,2,0,0,0,0|2,0,0]=4 3137 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1C)Cl 1626a_100000210418_100000024059 [0,2,0,0,0,0|2,0,0]=4 3138 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1C)F 11a_100000211637_100000024059 [0,2,0,0,0,0|2,0,0]=4 3139 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1C)F 1626a_100000211637_100000024059 [0,2,0,0,0,0|2,0,0]=4 3140 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1C)F 527a_100000211637_100000024059 [0,2,0,0,0,0|2,0,0]=4 3141 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1C)I 11a_100000184554_100000024059 [0,2,0,0,0,0|2,0,0]=4 3142 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1C)I 1626a_100000184554_100000024059 [0,2,0,0,0,0|2,0,0]=4 3143 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1C)O 527a_100000756630_100000024059 [0,2,0,0,0,0|1,0,0]=3 3144 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Cl)Br 11a_100000211467_100000024059 [0,2,0,0,0,0|2,0,0]=4 3145 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Cl)Br 1626a_100000211467_100000024059 [0,2,0,0,0,0|2,0,0]=4 3146 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100000024059 [0,2,0,0,0,0|2,0,0]=4 3147 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100000024059 [0,2,0,0,0,0|2,0,0]=4 3148 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Cl)Cl 11a_100000185861_100000024059 [0,2,0,0,0,0|2,0,0]=4 3149 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Cl)Cl 1626a_100000185861_100000024059 [0,2,0,0,0,0|2,0,0]=4 3150 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Cl)F 11a_100000212003_100000024059 [0,2,0,0,0,0|2,0,0]=4 3151 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Cl)F 1626a_100000212003_100000024059 [0,2,0,0,0,0|2,0,0]=4 3152 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Cl)I 11a_100011218065_100000024059 [0,2,0,0,0,0|2,0,0]=4 3153 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Cl)I 1626a_100011218065_100000024059 [0,2,0,0,0,0|2,0,0]=4 3154 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100000024059 [0,2,0,0,0,0|1,0,0]=3 3155 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1F)Br 11a_100000210722_100000024059 [0,2,0,0,0,0|2,0,0]=4 3156 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1F)Br 1626a_100000210722_100000024059 [0,2,0,0,0,0|2,0,0]=4 3157 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1F)C 11a_100000211023_100000024059 [0,2,0,0,0,0|2,0,0]=4 3158 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1F)C 1626a_100000211023_100000024059 [0,2,0,0,0,0|2,0,0]=4 3159 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1F)C 527a_100000211023_100000024059 [0,2,0,0,0,0|2,0,0]=4 3160 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1F)Cl 11a_100000211020_100000024059 [0,2,0,0,0,0|2,0,0]=4 3161 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1F)Cl 1626a_100000211020_100000024059 [0,2,0,0,0,0|2,0,0]=4 3162 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1F)F 11a_100000210720_100000024059 [0,2,0,0,0,0|2,0,0]=4 3163 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1F)F 1626a_100000210720_100000024059 [0,2,0,0,0,0|2,0,0]=4 3164 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1F)I 11a_100011215594_100000024059 [0,2,0,0,0,0|2,0,0]=4 3165 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1F)I 1626a_100011215594_100000024059 [0,2,0,0,0,0|2,0,0]=4 3166 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1F)O 527a_100000759473_100000024059 [0,2,0,0,0,0|1,0,0]=3 3167 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1I)Br 11a_100000187925_100000024059 [0,2,0,0,0,0|2,0,0]=4 3168 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1I)Br 1626a_100000187925_100000024059 [0,2,0,0,0,0|2,0,0]=4 3169 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1I)C 11a_100011356834_100000024059 [0,2,0,0,0,0|2,0,0]=4 3170 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1I)C 1626a_100011356834_100000024059 [0,2,0,0,0,0|2,0,0]=4 3171 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1I)Cl 11a_100000761889_100000024059 [0,2,0,0,0,0|2,0,0]=4 3172 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1I)Cl 1626a_100000761889_100000024059 [0,2,0,0,0,0|2,0,0]=4 3173 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1I)F 11a_100000760547_100000024059 [0,2,0,0,0,0|2,0,0]=4 3174 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1I)F 1626a_100000760547_100000024059 [0,2,0,0,0,0|2,0,0]=4 3175 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1I)I 11a_100010002754_100000024059 [0,2,0,0,0,0|2,0,0]=4 3176 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1I)I 1626a_100010002754_100000024059 [0,2,0,0,0,0|2,0,0]=4 3177 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1I)O 527a_100010084370_100000024059 [0,2,0,0,0,0|1,0,0]=3 3178 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000024059 [0,2,0,0,0,0|2,0,0]=4 3179 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1O)C 527a_100000211527_100000024059 [0,2,0,0,0,0|2,0,0]=4 3180 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000024059 [0,2,0,0,0,0|2,0,0]=4 3181 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1O)F 527a_100000753323_100000024059 [0,2,0,0,0,0|2,0,0]=4 3182 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1O)I 527a_100000057187_100000024059 [0,2,0,0,0,0|2,0,0]=4 3183 B15R1.14339 COC(=O)C(=O)Nc1ccc(cc1O)O 527a_100000106777_100000024059 [0,2,0,0,0,0|1,0,0]=3 3184 B15R1.11335 O=C(O)C(=Cc1ccc(cc1)Br)C(=O)O 6a_100000186029_100000189509 [0,2,0,0,0,0|1,0,1]=4 3185 B15R1.11335 O=C(O)C(=Cc1ccc(cc1)F)C(=O)O 6a_100000210084_100000189509 [0,2,0,0,0,0|1,0,1]=4 3186 B15R1.11335 O=C(O)C(=Cc1ccc(cc1)I)C(=O)O 6a_100000188517_100000189509 [0,2,0,0,0,0|1,0,1]=4 3187 B15R1.4038 COc1cc(ccc1O)NC(=O)C(=O)N 22a_100000726020_100011215815 [0,2,0,0,0,0|2,0,0]=4 3188 B15R1.4038 N#Cc1cc(ccc1O)NC(=O)C(=O)N 22a_100011249283_100011215815 [0,2,0,0,0,0|2,0,0]=4 3189 B15R1.8394 Cc1cc(c(cc1O)C)NC(=O)C(=O)N 22a_100000720036_100011215815 [0,2,0,0,0,0|2,0,0]=4 3190 B15R1.8394 NC(=O)C(=O)Nc1cc(c(cc1Cl)O)F 22a_100009886023_100011215815 [0,2,0,0,0,0|2,0,0]=4 3191 B15R1.8394 NC(=O)C(=O)Nc1cc(c(cc1F)O)F 22a_100020635945_100011215815 [0,2,0,0,0,0|2,0,0]=4 3192 B15R1.8408 Cc1c(ccc(c1C)NC(=O)C(=O)N)O 22a_200011216674_100011215815 [0,2,0,0,0,0|2,0,0]=4 3193 B15R1.8408 Cc1c(ccc(c1F)NC(=O)C(=O)N)O 22a_200000126710_100011215815 [0,2,0,0,0,0|2,0,0]=4 3194 B15R1.8408 NC(=O)C(=O)Nc1ccc(c(c1F)Cl)O 22a_200000098347_100011215815 [0,2,0,0,0,0|2,0,0]=4 3195 B15R1.8408 NC(=O)C(=O)Nc1ccc(c(c1F)F)O 22a_100015204651_100011215815 [0,2,0,0,0,0|2,0,0]=4 3196 B15R1.28955 Cc1cc(cc(c1O)Br)NC(=O)C(=O)N 22a_100010064301_100011215815 [0,2,0,0,0,0|2,0,0]=4 3197 B15R1.28955 Cc1cc(cc(c1O)C)NC(=O)C(=O)N 22a_100000703291_100011215815 [0,2,0,0,0,0|2,0,0]=4 3198 B15R1.28955 NC(=O)C(=O)Nc1cc(c(c(c1)Br)O)Br 22a_200000186426_100011215815 [0,2,0,0,0,0|2,0,0]=4 3199 B15R1.28955 NC(=O)C(=O)Nc1cc(c(c(c1)Cl)O)Cl 22a_100000695418_100011215815 [0,2,0,0,0,0|2,0,0]=4 3200 B15R1.28955 NC(=O)C(=O)Nc1cc(c(c(c1)F)O)F 22a_100016987357_100011215815 [0,2,0,0,0,0|2,0,0]=4 3201 B15R1.3552 Cc1cc(cc(c1NC(=O)C(=O)N)C)O 22a_100011934200_100011215815 [0,2,0,0,0,0|2,0,0]=4 3202 B15R1.4059 COc1cc(ccc1NC(=O)C(=O)N)O 22a_100015326901_100011215815 [0,2,0,0,0,0|2,0,0]=4 3203 B13R2.147 O=C1CC(C1)c2ccc(cc2)O 271570a_203496583355_100000741321 [1,0,0,1,0,0|1,0,1]=4 3204 B13R2.155 O=C1CCc2ccc(cc2C1)O 271570a_203496583355_100010138410 [1,0,0,1,0,0|1,0,1]=4 3205 B13R2.155 O=C1CCc2ccc(cc2N1)O 271570a_203496583355_100000763451 [1,0,0,1,0,0|1,0,1]=4 3206 B13R2.155 O=C1NCc2ccc(cc2N1)O 271570a_203496583355_100010161048 [1,0,0,1,0,0|2,0,0]=4 3207 B13R2.155 O=C1Nc2cc(ccc2CO1)O 271570a_203496583355_100000726308 [1,0,0,1,0,0|2,0,0]=4 3208 B13R2.155 O=c1ccc2ccc(cc2o1)O 271570a_203496583355_100009993525 [1,0,0,1,0,0|0,0,1]=3 3209 B13R2.155 Oc1ccc2ccc(cc2c1)O 271570a_203496583355_100009816537 [1,0,0,1,0,0|1,0,1]=4 3210 B13R2.155 Oc1ccc2ccc(nc2c1)O 271570a_203496583355_100000079174 [1,0,0,1,0,0|1,0,1]=4 3211 B13R2.155 Oc1ccc2ccc(nc2c1)O 271570a_203496583355_100000690401 [1,0,0,1,0,0|1,0,1]=4 3212 B13R2.155 Oc1ccc2ncc(cc2c1)O 271570a_203496583355_100000703654 [1,0,0,1,0,0|2,0,0]=4 3213 B13R2.155 Oc1ccc2ncc(cc2c1)O 271570a_203496583355_100010137430 [1,0,0,1,0,0|2,0,0]=4 3214 B13R2.155 Oc1ccc2ncc(nc2c1)O 271570a_203496583355_100010000190 [1,0,0,1,0,0|2,0,0]=4 3215 B13R2.155 Oc1ccc2ncc(nc2c1)O 271570a_203496583355_200020640061 [1,0,0,1,0,0|2,0,0]=4 3216 B13R2.369 O=c1oc2ccccc2cc1O 271570a_203496583355_200000187772 [1,0,0,1,0,0|0,0,2]=4 3217 B13R2.435 CC(=O)C1=Cc2ccccc2C1 1458a_100009862756_200000210301 [1,0,0,1,0,0|2,0,0]=4 3218 B13R2.435 [13CH3]C(=O)C1=Cc2ccccc2C1 1458a_100009862756_200025704644 [1,0,0,1,0,0|2,0,0]=4 3219 B13R2.444 O=C(Cc1ccccc1)C2CO2 1458a_100000701028_100015291786 [1,0,0,1,0,0|1,0,1]=4 3220 B13R2.43 O=Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100009820874 [1,0,0,1,0,0|2,0,0]=4 3221 B13R2.43 O=Cc1cc2cc(ccc2o1)O 271570a_203496583355_100000755920 [1,0,0,1,0,0|2,0,0]=4 3222 B13R2.43 O=Cc1cc2cc(ccc2s1)O 271570a_203496583355_100010238522 [1,0,0,1,0,0|2,0,0]=4 3223 B13R2.43 O=Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100000736022 [1,0,0,1,0,0|1,0,1]=4 3224 B13R2.43 O=Cc1cc2ccc(cc2s1)O 271570a_203496583355_100009814784 [1,0,0,1,0,0|0,1,1]=4 3225 B13R2.43 O=Cc1nc2ccc(cc2[nH]1)O 271570a_203496583355_200011361486 [1,0,0,1,0,0|2,0,0]=4 3226 B13R2.3028 CC1Cc2ccc(cc2C1=O)O 271570a_203496583355_100000694082 [1,0,0,1,0,0|1,0,1]=4 3227 B13R2.3028 CN1C(=O)Cc2c1cc(cc2)O 271570a_203496583355_100010285470 [1,0,0,1,0,0|2,0,0]=4 3228 B13R2.3028 CN1Cc2ccc(cc2C1=O)O 271570a_203496583355_100010125600 [1,0,0,1,0,0|2,0,0]=4 3229 B13R2.3028 O=C1Nc2ccc(cc2C1=O)O 271570a_203496583355_100000024671 [1,0,0,1,0,0|1,0,0]=3 3230 B13R2.3028 O=C1Nc2ncc(cc2C1=O)O 271570a_203496583355_100010174890 [1,0,0,1,0,0|2,0,0]=4 3231 B13R2.3683 O=C1CCc2cc(ccc2C1)O 271570a_203496583355_100000753102 [1,0,0,1,0,0|1,0,1]=4 3232 B13R2.3683 O=C1COc2cc(ccc2N1)O 271570a_203496583355_100000745508 [1,0,0,1,0,0|1,0,1]=4 3233 B13R2.3683 O=C1Cc2ccc(cc2CN1)O 271570a_203496583355_100010174877 [1,0,0,1,0,0|2,0,0]=4 3234 B13R2.3683 O=c1ccc2cc(ccc2[nH]1)O 271570a_203496583355_100011934725 [1,0,0,1,0,0|2,0,0]=4 3235 B13R2.3683 O=c1ccc2cc(ccc2o1)O 271570a_203496583355_100009999946 [1,0,0,1,0,0|2,0,0]=4 3236 B13R2.3683 O=c1cnc2cc(ccc2[nH]1)O 271570a_203496583355_100010209493 [1,0,0,1,0,0|2,0,0]=4 3237 B13R2.5190 Cn1c(=O)oc2c1ccc(c2)O 271570a_203496583355_100000753874 [0,0,0,1,1,0|2,0,0]=4 3238 B13R2.5190 O=C1Nc2cc(ccc2C1=O)O 271570a_203496583355_100000239657 [0,0,0,1,1,0|1,0,0]=3 3239 B15R2.1530 O=C(CCc1ccc(cc1)O)C2CO2 1458a_100000701028_100009816426 [0,0,0,1,0,1|1,0,1]=4 3240 B15R2.1530 O=C(NCc1ccc(cc1)O)C2CO2 240690a_100000185549_100000701028 [0,0,0,1,0,1|1,0,1]=4 3241 B15R2.1530 O=C(NCc1ccc(cc1)O)C2CO2 527a_100000185549_100000701028 [0,0,0,1,0,1|1,0,1]=4 3242 B15R2.309 O=C1CN(C(=O)N1)c2ccc(cc2)O 271570a_203496583355_100000188930 [0,0,0,1,0,1|2,0,0]=4 3243 B15R2.18927 O=C(Cc1ccc(cc1)O)CC2CO2 1458a_100000198540_100011216344 [0,0,0,1,0,1|1,0,1]=4 3244 B15R2.18927 O=C(Cc1ccc(cc1)O)C[C@@H]2CO2 1458a_100000198540_100000745022 [0,0,0,1,0,1|1,0,1]=4 3245 B15R2.444 O=C(Cc1ccc(cc1)CO)C2CO2 1458a_100000701028_100000067286 [0,1,0,1,0,0|1,0,1]=4 3246 B15R2.63893 Cc1c(c(=O)oc2c1ccc(c2)O)O 271570a_203496583355_200009996780 [0,1,0,1,0,0|0,0,2]=4 3247 B15R2.63893 Cn1c(=O)c(=O)[nH]c2c1ccc(c2)O 271570a_203496583355_100009998729 [0,1,0,1,0,0|2,0,0]=4 3248 B15R2.1590 COC(=O)c1cc2cc(ccc2[nH]1)O 271570a_203496583355_100009814476 [0,1,0,1,0,0|2,0,0]=4 3249 B15R2.1590 COC(=O)c1cc2cc(ccc2s1)O 271570a_203496583355_100009812836 [0,1,0,1,0,0|2,0,0]=4 3250 B15R2.1590 COC(=O)c1cc2ccc(cc2[nH]1)O 271570a_203496583355_100000246269 [0,1,0,1,0,0|1,0,1]=4 3251 B15R2.1590 COC(=O)c1cc2ccc(cc2o1)O 271570a_203496583355_100010365216 [0,1,0,1,0,0|0,0,2]=4 3252 B15R2.1590 COC(=O)c1cc2ccc(cc2s1)O 271570a_203496583355_100010178015 [0,1,0,1,0,0|0,1,1]=4 3253 B15R2.1590 COC(=O)c1nc2ccc(cc2[nH]1)O 271570a_203496583355_100012351599 [0,1,0,1,0,0|2,0,0]=4 3254 B15R2.1590 COC(=O)c1nc2ccc(cc2o1)O 271570a_203496583355_100010209328 [0,1,0,1,0,0|1,0,1]=4 3255 B15R2.1590 COC(=O)c1nc2ccc(cc2s1)O 271570a_203496583355_200010167800 [0,1,0,1,0,0|1,1,0]=4 3256 B15R2.1590 O=C(CO)N1Cc2ccc(cc2C1)O 240690a_100015195982_100000210174 [0,1,0,1,0,0|2,0,0]=4 3257 B15R2.1590 O=C(CO)N1Cc2ccc(cc2C1)O 527a_100015195982_100000210174 [0,1,0,1,0,0|2,0,0]=4 3258 B15R2.19022 O=C(Cc1ccc(cc1)O)C2COC2 1458a_100000198540_100000687716 [0,1,0,1,0,0|1,0,1]=4 3259 B11R1.36 C=C(C(=O)C)c1ccccc1 1458a_100000065200_200000210301 [1,0,0,0,1,0|2,0,0]=4 3260 B11R1.36 C=C(C(=O)[13CH3])c1ccccc1 1458a_100000065200_200025704644 [1,0,0,0,1,0|2,0,0]=4 3261 B11R1.22 CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210202 [1,0,0,0,1,0|1,0,1]=4 3262 B11R1.22 CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000211647 [1,0,0,0,1,0|1,0,1]=4 3263 B11R1.22 CNC(=O)c1ccc(cc1)O 240690a_100102657272_100000212099 [1,0,0,0,1,0|2,0,0]=4 3264 B11R1.22 CNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155074 [1,0,0,0,1,0|2,0,0]=4 3265 B11R1.22 CNC(=O)c1ccc(cc1)O 527a_100102657272_100000212099 [1,0,0,0,1,0|2,0,0]=4 3266 B11R1.22 COC(=O)c1ccc(cc1)O 271570a_203496583355_100000150774 [1,0,0,0,1,0|2,0,0]=4 3267 B11R1.22 N#CC(=O)c1ccc(cc1)O 271570a_203496583355_100009994572 [1,0,0,0,1,0|1,0,1]=4 3268 B11R1.22 NCC(=O)c1ccc(cc1)O 271570a_203496583355_100000017248 [1,0,0,0,1,0|1,0,1]=4 3269 B11R1.22 NNC(=O)c1ccc(cc1)O 271570a_203496583355_100000183614 [1,0,0,0,1,0|2,0,0]=4 3270 B11R1.22 O=C(CF)c1ccc(cc1)O 1458a_100000212099_100015361967 [1,0,0,0,1,0|1,0,1]=4 3271 B11R1.22 O=C(CO)c1ccc(cc1)O 271570a_203496583355_100011219529 [1,0,0,0,1,0|0,0,1]=3 3272 B11R1.22 O=CC(=O)c1ccc(cc1)O 271570a_203496583355_100000725942 [1,0,0,0,1,0|0,0,0]=2 3273 B13R1.513 CC(=CCNc1ccc(cc1)O)C 34a_100000185829_100000761012 [1,0,0,0,0,1|2,0,0]=4 3274 B13R1.513 CC(=CCSc1ccc(cc1)O)C 62a_100000761012_100000185759 [1,0,0,0,0,1|2,0,0]=4 3275 B13R1.513 CC(=O)CCCc1ccc(cc1)O 1458a_100000116853_200000210301 [1,0,0,0,0,1|1,0,1]=4 3276 B13R1.513 CC(=O)CCSc1ccc(cc1)O 62a_100000053229_100000185759 [1,0,0,0,0,1|1,0,1]=4 3277 B13R1.513 CC(=O)NCCc1ccc(cc1)O 240690a_100000743037_100015343762 [1,0,0,0,0,1|1,0,1]=4 3278 B13R1.513 CC(=O)NCCc1ccc(cc1)O 527a_100000743037_100103153847 [1,0,0,0,0,1|1,0,1]=4 3279 B13R1.513 CC(=O)OCCc1ccc(cc1)O 271570a_203496583355_200016374084 [1,0,0,0,0,1|1,0,1]=4 3280 B13R1.513 CC(=O)OCNc1ccc(cc1)O 34a_100000185829_100009813279 [1,0,0,0,0,1|2,0,0]=4 3281 B13R1.513 CC(=O)OCSc1ccc(cc1)O 62a_100000076356_100000185759 [1,0,0,0,0,1|2,0,0]=4 3282 B13R1.513 Cc1ccc(cc1)CNCC(=O)O 269956a_100016091260_100000210814 [1,0,0,0,0,1|1,0,1]=4 3283 B13R1.513 NC(=O)CCNc1ccc(cc1)O 34a_100000185829_100000731001 [1,0,0,0,0,1|1,0,1]=4 3284 B13R1.513 NC(=O)CCSc1ccc(cc1)O 62a_100000744528_100000185759 [1,0,0,0,0,1|1,0,1]=4 3285 B13R1.513 NC(=O)CNCc1ccc(cc1)O 34a_100000185549_100000187820 [1,0,0,0,0,1|1,0,1]=4 3286 B13R1.513 O=C(O)CNCc1ccc(cc1)Br 269956a_100016091260_100011217064 [1,0,0,0,0,1|1,0,1]=4 3287 B13R1.513 O=C(O)CNCc1ccc(cc1)Cl 269956a_100016091260_100000187161 [1,0,0,0,0,1|1,0,1]=4 3288 B13R1.513 O=C(O)CNCc1ccc(cc1)F 269956a_100016091260_100000198546 [1,0,0,0,0,1|1,0,1]=4 3289 B13R1.513 O=C(O)CNCc1ccc(cc1)I 269956a_100016091260_100000189116 [1,0,0,0,0,1|1,0,1]=4 3290 B13R1.513 O=C([O-])CNCc1ccc(cc1)O 34a_100000185549_100020667443 [1,0,0,0,0,1|0,0,2]=4 3291 B13R1.513 [13CH3]C(=O)CCCc1ccc(cc1)O 1458a_100000116853_200025704644 [1,0,0,0,0,1|1,0,1]=4 3292 B13R1.348 CC(=CC(=O)Cc1ccccc1)C 1458a_100000211388_100015291786 [1,0,0,0,0,1|2,0,0]=4 3293 B13R1.348 CC(=CC(=O)Cc1ccccc1)Cl 1458a_200042562850_100015291786 [1,0,0,0,0,1|2,0,0]=4 3294 B13R1.348 CC(=CC(=O)Cc1ccccc1)I 1458a_100025716642_100015291786 [1,0,0,0,0,1|2,0,0]=4 3295 B13R1.348 CC(=O)CC(=O)Cc1ccccc1 1458a_100000070787_100000233483 [1,0,0,0,0,1|1,0,0]=3 3296 B13R1.348 CC(=O)CC(=O)Nc1ccccc1 1458a_100000070787_100000182850 [1,0,0,0,0,1|2,0,0]=4 3297 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 1458a_100000070787_100009813826 [1,0,0,0,0,1|2,0,0]=4 3298 B13R1.348 CN(CC(=O)O)Cc1ccccc1 269956a_100000745947_200000210301 [1,0,0,0,0,1|2,0,0]=4 3299 B13R1.348 CN(CC(=O)O)Cc1ccccc1 269956a_100000746989_100015291786 [1,0,0,0,0,1|2,0,0]=4 3300 B13R1.348 C[C@@H](O)CC(=O)Cc1ccccc1 1458a_100011933948_100015291786 [1,0,0,0,0,1|1,0,1]=4 3301 B13R1.348 NC(=O)CC(=O)C[n+]1ccccc1 1458a_200000086051_100000187820 [1,0,0,0,0,1|2,0,0]=4 3302 B13R1.348 NC(=O)CC(=O)Cc1ccccc1 1458a_100134613110_100015291786 [1,0,0,0,0,1|1,0,0]=3 3303 B13R1.348 NC(=O)CC(=O)Cc1ccccn1 1458a_100000233486_100000187820 [1,0,0,0,0,1|2,0,0]=4 3304 B13R1.348 NC(=O)CC(=O)Cc1ccccn1 1458a_100134613110_100000721315 [1,0,0,0,0,1|2,0,0]=4 3305 B13R1.348 NC(=O)CC(=O)Cc1cccnc1 1458a_100000737805_100000187820 [1,0,0,0,0,1|2,0,0]=4 3306 B13R1.348 NC(=O)CC(=O)Cc1cccnc1 1458a_100134613110_100000733263 [1,0,0,0,0,1|2,0,0]=4 3307 B13R1.348 NC(=O)CC(=O)Cc1ccncc1 1458a_100134613110_100000705612 [1,0,0,0,0,1|2,0,0]=4 3308 B13R1.348 NC(=O)CC(=O)Nc1ccccc1 22a_100000106764_100134613110 [1,0,0,0,0,1|2,0,0]=4 3309 B13R1.348 NC(=O)CC(=O)Nc1ccccc1 527a_100000106764_100134613110 [1,0,0,0,0,1|2,0,0]=4 3310 B13R1.348 O=C(C=C(Cl)Cl)Cc1ccccc1 1458a_100000137448_100015291786 [1,0,0,0,0,1|2,0,0]=4 3311 B13R1.348 O=C([O-])CC(=O)C[n+]1ccccc1 1458a_200000086051_100020667443 [1,0,0,0,0,1|1,0,1]=4 3312 B13R1.348 O=C([O-])CC(=O)Cc1ccccn1 1458a_100000233486_100020667443 [1,0,0,0,0,1|1,0,1]=4 3313 B13R1.348 O=C([O-])CC(=O)Cc1cccnc1 1458a_100000737805_100020667443 [1,0,0,0,0,1|1,0,1]=4 3314 B13R1.348 [13CH3]N(CC(=O)O)Cc1ccccc1 269956a_100000745947_200025704644 [1,0,0,0,0,1|2,0,0]=4 3315 B13R1.351 C=C(Br)C(=O)NCc1ccccc1 11a_100015324214_100009813364 [1,0,0,0,0,1|2,0,0]=4 3316 B13R1.351 C=C(Br)C(=O)NCc1ccccc1 1626a_100015324214_100009813364 [1,0,0,0,0,1|2,0,0]=4 3317 B13R1.351 C=C(C)C(=O)CCc1ccccc1 1458a_100000185857_100000765856 [1,0,0,0,0,1|2,0,0]=4 3318 B13R1.351 C=C(C)C(=O)NCc1ccccc1 11a_100015324214_100000185857 [1,0,0,0,0,1|2,0,0]=4 3319 B13R1.351 C=C(C)C(=O)NCc1ccccc1 1626a_100015324214_100000185857 [1,0,0,0,0,1|2,0,0]=4 3320 B13R1.351 C=C(Cl)C(=O)NCc1ccccc1 11a_100015324214_100000039160 [1,0,0,0,0,1|2,0,0]=4 3321 B13R1.351 C=C(Cl)C(=O)NCc1ccccc1 1626a_100015324214_100000039160 [1,0,0,0,0,1|2,0,0]=4 3322 B13R1.351 C=C(F)C(=O)NCc1ccccc1 11a_100015324214_100000036797 [1,0,0,0,0,1|2,0,0]=4 3323 B13R1.351 C=C(F)C(=O)NCc1ccccc1 1626a_100015324214_100000036797 [1,0,0,0,0,1|2,0,0]=4 3324 B13R1.351 CC(=O)C(=O)CNc1ccccc1 34a_100000106764_100011261029 [1,0,0,0,0,1|1,0,0]=3 3325 B13R1.351 CC(=O)C(=O)COc1ccccc1 34a_100000210340_100011261029 [1,0,0,0,0,1|1,0,0]=3 3326 B13R1.351 CC(=O)C(=O)COc1cccnc1 34a_100000210849_100011261029 [1,0,0,0,0,1|2,0,0]=4 3327 B13R1.351 CC(=O)C(=O)COc1ccncc1 34a_100000212176_100011261029 [1,0,0,0,0,1|2,0,0]=4 3328 B13R1.351 CC(=O)C(=O)CSc1ccccc1 62a_100000719477_100011261029 [1,0,0,0,0,1|1,0,0]=3 3329 B13R1.351 CC(=O)C(=O)CSc1ccccc1 62a_100011261029_100000041952 [1,0,0,0,0,1|1,0,0]=3 3330 B13R1.351 CC(=O)C(=O)CSc1ccccn1 62a_100011216584_100011261029 [1,0,0,0,0,1|2,0,0]=4 3331 B13R1.351 CC(=O)C(=O)CSc1ccccn1 62a_100011261029_100011216584 [1,0,0,0,0,1|2,0,0]=4 3332 B13R1.351 CC(=O)C(=O)CSc1cccnc1 62a_100000210063_100011261029 [1,0,0,0,0,1|2,0,0]=4 3333 B13R1.351 CC(=O)C(=O)CSc1cccnc1 62a_100011261029_100000210063 [1,0,0,0,0,1|2,0,0]=4 3334 B13R1.351 CC(=O)C(=O)CSc1ccncc1 62a_100000728582_100011261029 [1,0,0,0,0,1|2,0,0]=4 3335 B13R1.351 CC(=O)C(=O)CSc1ccncc1 62a_100011261029_100000728582 [1,0,0,0,0,1|2,0,0]=4 3336 B13R1.351 C[C@@H](O)C(=O)CCc1ccccc1 1458a_100000717761_100000765856 [1,0,0,0,0,1|1,0,1]=4 3337 B13R1.351 C[C@@H](O)C(=O)NCc1ccccc1 240690a_100015324214_100000717761 [1,0,0,0,0,1|1,0,1]=4 3338 B13R1.351 C[C@H](NCc1ccccc1)C(=O)O 269956a_100000743915_100015291786 [1,0,0,0,0,1|1,0,1]=4 3339 B13R1.351 C[C@H](O)C(=O)CCc1ccccc1 1458a_217856618621_100000765856 [1,0,0,0,0,1|1,0,1]=4 3340 B13R1.351 C[C@H](O)C(=O)NCc1ccccc1 1626a_100015324214_217856618621 [1,0,0,0,0,1|1,0,1]=4 3341 B13R1.351 C[C@H](O)C(=O)NCc1ccccc1 240690a_100015324214_217856618621 [1,0,0,0,0,1|1,0,1]=4 3342 B13R1.351 NC(=O)C(=O)NCc1ccccc1 240690a_100015324214_100011215815 [1,0,0,0,0,1|1,0,0]=3 3343 B13R1.351 NC(=O)C(=O)NCc1ccccn1 240690a_100000210449_100011215815 [1,0,0,0,0,1|2,0,0]=4 3344 B13R1.351 NC(=O)C(=O)NCc1cccnc1 240690a_100000210453_100011215815 [1,0,0,0,0,1|2,0,0]=4 3345 B13R1.351 NC(=O)C(=O)NCc1ccncc1 240690a_100000210450_100011215815 [1,0,0,0,0,1|2,0,0]=4 3346 B13R1.351 NC(=O)C(=O)NNc1ccccc1 22a_100015195140_100011215815 [1,0,0,0,0,1|2,0,0]=4 3347 B13R1.351 O=C(CCc1ccccc1)C(O)O 1458a_100000233687_100000765856 [1,0,0,0,0,1|0,0,2]=4 3348 B13R1.351 O=C(NCc1ccccc1)C(O)O 240690a_100015324214_100000233687 [1,0,0,0,0,1|0,0,2]=4 3349 B15R1.112 CC(=O)C(=O)CNCc1ccc(cc1)Br 34a_100000174875_100011261029 [0,0,0,0,0,2|2,0,0]=4 3350 B15R1.112 CC(=O)C(=O)CNCc1ccc(cc1)C 34a_100000174908_100011261029 [0,0,0,0,0,2|2,0,0]=4 3351 B15R1.112 CC(=O)C(=O)CNCc1ccc(cc1)Cl 34a_100000174871_100011261029 [0,0,0,0,0,2|2,0,0]=4 3352 B15R1.112 CC(=O)C(=O)CNCc1ccc(cc1)F 34a_100000174882_100011261029 [0,0,0,0,0,2|2,0,0]=4 3353 B15R1.112 CC(=O)C(=O)CNCc1ccc(cc1)I 34a_100016989417_100011261029 [0,0,0,0,0,2|2,0,0]=4 3354 B15R1.112 CC(=O)C(=O)CNCc1ccc(cc1)O 34a_100000185549_100011261029 [0,0,0,0,0,2|1,0,0]=3 3355 B15R1.112 CC(=O)C(=O)COCc1ccc(cc1)Br 34a_100000695286_100011261029 [0,0,0,0,0,2|2,0,0]=4 3356 B15R1.112 CC(=O)C(=O)COCc1ccc(cc1)C 34a_100011215236_100011261029 [0,0,0,0,0,2|2,0,0]=4 3357 B15R1.112 CC(=O)C(=O)COCc1ccc(cc1)Cl 34a_100000211118_100011261029 [0,0,0,0,0,2|2,0,0]=4 3358 B15R1.112 CC(=O)C(=O)COCc1ccc(cc1)F 34a_100000210977_100011261029 [0,0,0,0,0,2|2,0,0]=4 3359 B15R1.112 CC(=O)C(=O)COCc1ccc(cc1)I 34a_100000690907_100011261029 [0,0,0,0,0,2|2,0,0]=4 3360 B15R1.112 CC(=O)C(=O)COCc1ccc(cc1)N 34a_100011215238_100011261029 [0,0,0,0,0,2|2,0,0]=4 3361 B15R1.112 CC(=O)C(=O)CSCc1ccc(cc1)Br 62a_100000189115_100011261029 [0,0,0,0,0,2|2,0,0]=4 3362 B15R1.112 CC(=O)C(=O)CSCc1ccc(cc1)Br 62a_100011261029_100000189115 [0,0,0,0,0,2|2,0,0]=4 3363 B15R1.112 CC(=O)C(=O)CSCc1ccc(cc1)C 62a_100000210814_100011261029 [0,0,0,0,0,2|2,0,0]=4 3364 B15R1.112 CC(=O)C(=O)CSCc1ccc(cc1)C 62a_100011261029_100000210814 [0,0,0,0,0,2|2,0,0]=4 3365 B15R1.112 CC(=O)C(=O)CSCc1ccc(cc1)Cl 62a_100000187161_100011261029 [0,0,0,0,0,2|2,0,0]=4 3366 B15R1.112 CC(=O)C(=O)CSCc1ccc(cc1)Cl 62a_100011261029_100000187161 [0,0,0,0,0,2|2,0,0]=4 3367 B15R1.112 CC(=O)C(=O)CSCc1ccc(cc1)F 62a_100000198546_100011261029 [0,0,0,0,0,2|2,0,0]=4 3368 B15R1.112 CC(=O)C(=O)CSCc1ccc(cc1)F 62a_100011261029_100000187164 [0,0,0,0,0,2|2,0,0]=4 3369 B15R1.112 CC(=O)C(=O)CSCc1ccc(cc1)I 62a_100000189116_100011261029 [0,0,0,0,0,2|2,0,0]=4 3370 B15R1.112 CC(=O)C(=O)CSCc1ccc(cc1)I 62a_100011261029_100000189116 [0,0,0,0,0,2|2,0,0]=4 3371 B15R1.112 C[C@@H](O)C(=O)NCCc1ccc(cc1)O 240690a_100000743037_100000717761 [0,0,0,0,0,2|1,0,1]=4 3372 B15R1.112 C[C@H](NCCc1ccc(cc1)O)C(=O)O 269956a_100000743915_100009816426 [0,0,0,0,0,2|1,0,1]=4 3373 B15R1.112 C[C@H](O)C(=O)NCCc1ccc(cc1)O 240690a_100000743037_217856618621 [0,0,0,0,0,2|1,0,1]=4 3374 B15R1.112 Cc1ccc(cc1)CCNC(=O)C(=O)N 240690a_100000705350_100011215815 [0,0,0,0,0,2|2,0,0]=4 3375 B15R1.112 Cc1ccc(cc1)CNNC(=O)C(=O)N 22a_100011197965_100011215815 [0,0,0,0,0,2|2,0,0]=4 3376 B15R1.112 NC(=O)C(=O)NCCc1ccc(cc1)Br 240690a_100000755846_100011215815 [0,0,0,0,0,2|2,0,0]=4 3377 B15R1.112 NC(=O)C(=O)NCCc1ccc(cc1)Cl 240690a_100000185265_100011215815 [0,0,0,0,0,2|2,0,0]=4 3378 B15R1.112 NC(=O)C(=O)NCCc1ccc(cc1)F 240690a_100000199005_100011215815 [0,0,0,0,0,2|2,0,0]=4 3379 B15R1.112 NC(=O)C(=O)NCCc1ccc(cc1)O 240690a_100000743037_100011215815 [0,0,0,0,0,2|1,0,0]=3 3380 B15R1.112 NC(=O)C(=O)NN=Cc1ccc(cc1)O 4a_100000211141_100000185832 [0,0,0,0,0,2|1,0,1]=4 3381 B15R1.112 NC(=O)C(=O)NNCc1ccc(cc1)Br 22a_100016993955_100011215815 [0,0,0,0,0,2|2,0,0]=4 3382 B15R1.112 NC(=O)C(=O)NNCc1ccc(cc1)Cl 22a_100000689899_100011215815 [0,0,0,0,0,2|2,0,0]=4 3383 B15R1.112 NC(=O)C(=O)NNCc1ccc(cc1)F 22a_100000689900_100011215815 [0,0,0,0,0,2|2,0,0]=4 3384 B15R1.112 NC(=O)C(=O)NNCc1ccc(cc1)I 22a_102495363730_100011215815 [0,0,0,0,0,2|2,0,0]=4 3385 B15R1.112 O=C(NCCc1ccc(cc1)O)C(O)O 240690a_100000743037_100000233687 [0,0,0,0,0,2|0,0,2]=4 3386 B15R1.870 C=C(C)CC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000748629 [0,0,0,0,0,2|2,0,0]=4 3387 B15R1.870 C=C(C)CC(=O)COc1ccc(cc1)O 1458a_100000031633_100000748629 [0,0,0,0,0,2|2,0,0]=4 3388 B15R1.870 C=C(F)CC(=O)CCc1ccc(cc1)O 1458a_100000742835_100009893438 [0,0,0,0,0,2|2,0,0]=4 3389 B15R1.870 C=C(F)CC(=O)COc1ccc(cc1)O 1458a_100000031633_100009893438 [0,0,0,0,0,2|2,0,0]=4 3390 B15R1.870 CC(=CC(=O)CCc1ccc(cc1)O)C 1458a_100000211388_100009816426 [0,0,0,0,0,2|2,0,0]=4 3391 B15R1.870 CC(=CC(=O)CCc1ccc(cc1)O)Cl 1458a_200042562850_100009816426 [0,0,0,0,0,2|2,0,0]=4 3392 B15R1.870 CC(=CC(=O)CCc1ccc(cc1)O)I 1458a_100025716642_100009816426 [0,0,0,0,0,2|2,0,0]=4 3393 B15R1.870 CC(=CC(=O)NCc1ccc(cc1)O)C 240690a_100000185549_100000211388 [0,0,0,0,0,2|2,0,0]=4 3394 B15R1.870 CC(=CC(=O)NCc1ccc(cc1)O)Cl 240690a_100000185549_200042562850 [0,0,0,0,0,2|2,0,0]=4 3395 B15R1.870 CC(=O)CC(=O)NCc1ccc(cc1)C 1458a_100000070787_100000183211 [0,0,0,0,0,2|2,0,0]=4 3396 B15R1.870 CC(=O)CC(=O)NCc1ccc(cc1)Cl 1458a_100000070787_100000183476 [0,0,0,0,0,2|2,0,0]=4 3397 B15R1.870 CC(=O)CC(=O)NCc1ccc(cc1)F 1458a_100000070787_100000182461 [0,0,0,0,0,2|2,0,0]=4 3398 B15R1.870 CC(=O)NC(=O)COc1ccc(cc1)Br 7a_100000185759_100000183797 [0,0,0,0,0,2|2,0,0]=4 3399 B15R1.870 CC(=O)NC(=O)COc1ccc(cc1)C 7a_100000210336_100000183797 [0,0,0,0,0,2|2,0,0]=4 3400 B15R1.870 CC(=O)NC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000183797 [0,0,0,0,0,2|2,0,0]=4 3401 B15R1.870 CC(=O)NC(=O)COc1ccc(cc1)I 7a_100000212066_100000183797 [0,0,0,0,0,2|2,0,0]=4 3402 B15R1.870 CC(=O)NC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000183797 [0,0,0,0,0,2|2,0,0]=4 3403 B15R1.870 CC(=O)NC(=O)CSc1ccc(cc1)C 62a_100000186775_100000183797 [0,0,0,0,0,2|2,0,0]=4 3404 B15R1.870 CC(=O)NC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000183797 [0,0,0,0,0,2|2,0,0]=4 3405 B15R1.870 CC(=O)NC(=O)CSc1ccc(cc1)F 62a_100000211213_100000183797 [0,0,0,0,0,2|2,0,0]=4 3406 B15R1.870 CC(=O)NC(=O)CSc1ccc(cc1)N 62a_100000185761_100000183797 [0,0,0,0,0,2|2,0,0]=4 3407 B15R1.870 CC(=O)NC(=O)CSc1ccc(cn1)O 62a_100000685995_100000183797 [0,0,0,0,0,2|2,0,0]=4 3408 B15R1.870 CC(O)CC(=O)CCc1ccc(cc1)O 1458a_100000742835_100011218427 [0,0,0,0,0,2|1,0,1]=4 3409 B15R1.870 CC(O)CC(=O)COc1ccc(cc1)O 1458a_100000031633_100011218427 [0,0,0,0,0,2|1,0,1]=4 3410 B15R1.870 CN(CCc1ccc(cc1)O)CC(=O)O 269956a_100000746989_100009816426 [0,0,0,0,0,2|2,0,0]=4 3411 B15R1.870 C[C@@H](O)CC(=O)CCc1ccc(cc1)O 1458a_100011933948_100009816426 [0,0,0,0,0,2|1,0,1]=4 3412 B15R1.870 C[C@@H](O)CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100011933948 [0,0,0,0,0,2|1,0,1]=4 3413 B15R1.870 Cc1ccc(cc1)CCC(=O)CC(=O)N 1458a_100000234883_100000187820 [0,0,0,0,0,2|2,0,0]=4 3414 B15R1.870 Cc1ccc(cc1)CCC(=O)CC(=O)N 1458a_100134613110_100011713686 [0,0,0,0,0,2|2,0,0]=4 3415 B15R1.870 Cc1ccc(cc1)CCC(=O)CC(=O)[O-] 1458a_100000234883_100020667443 [0,0,0,0,0,2|1,0,1]=4 3416 B15R1.870 Cc1ccc(cc1)CNC(=O)CC(=O)N 240690a_100000174908_100134613110 [0,0,0,0,0,2|2,0,0]=4 3417 B15R1.870 Cc1ccc(cc1)CNC(=O)CC(=O)N 527a_100000174908_100134613110 [0,0,0,0,0,2|2,0,0]=4 3418 B15R1.870 Cc1ccc(cc1)OCC(=O)CC(=O)N 1458a_100000182360_100000187820 [0,0,0,0,0,2|2,0,0]=4 3419 B15R1.870 Cc1ccc(cc1)OCC(=O)CC(=O)[O-] 1458a_100000182360_100020667443 [0,0,0,0,0,2|1,0,1]=4 3420 B15R1.870 Cc1ccc(cc1)OCC(=O)NC(=O)N 7a_100000210336_100000182717 [0,0,0,0,0,2|2,0,0]=4 3421 B15R1.870 Cc1ccc(cc1)SCC(=O)CC(=O)N 1458a_100000179497_100000187820 [0,0,0,0,0,2|2,0,0]=4 3422 B15R1.870 Cc1ccc(cc1)SCC(=O)CC(=O)[O-] 1458a_100000179497_100020667443 [0,0,0,0,0,2|1,0,1]=4 3423 B15R1.870 Cc1ccc(cc1)SCC(=O)NC(=O)N 62a_100000186775_100000182717 [0,0,0,0,0,2|2,0,0]=4 3424 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100000187820 [0,0,0,0,0,2|2,0,0]=4 3425 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)Br 1458a_100134613110_100011740612 [0,0,0,0,0,2|2,0,0]=4 3426 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100000187820 [0,0,0,0,0,2|2,0,0]=4 3427 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)Cl 1458a_100134613110_100011713675 [0,0,0,0,0,2|2,0,0]=4 3428 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)F 1458a_100000198493_100000187820 [0,0,0,0,0,2|2,0,0]=4 3429 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)F 1458a_100134613110_100011217392 [0,0,0,0,0,2|2,0,0]=4 3430 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)I 1458a_100011217499_100000187820 [0,0,0,0,0,2|2,0,0]=4 3431 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000187820 [0,0,0,0,0,2|1,0,0]=3 3432 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)O 1458a_100134613110_100009816426 [0,0,0,0,0,2|1,0,0]=3 3433 B15R1.870 NC(=O)CC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000187820 [0,0,0,0,0,2|2,0,0]=4 3434 B15R1.870 NC(=O)CC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000187820 [0,0,0,0,0,2|2,0,0]=4 3435 B15R1.870 NC(=O)CC(=O)COc1ccc(cc1)F 1458a_100000184765_100000187820 [0,0,0,0,0,2|2,0,0]=4 3436 B15R1.870 NC(=O)CC(=O)COc1ccc(cc1)I 1458a_100000184369_100000187820 [0,0,0,0,0,2|2,0,0]=4 3437 B15R1.870 NC(=O)CC(=O)COc1ccc(cc1)O 1458a_100000031633_100000187820 [0,0,0,0,0,2|1,0,0]=3 3438 B15R1.870 NC(=O)CC(=O)CSc1ccc(cc1)Br 1458a_100000179496_100000187820 [0,0,0,0,0,2|2,0,0]=4 3439 B15R1.870 NC(=O)CC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100000187820 [0,0,0,0,0,2|2,0,0]=4 3440 B15R1.870 NC(=O)CC(=O)CSc1ccc(cc1)F 1458a_100000691584_100000187820 [0,0,0,0,0,2|2,0,0]=4 3441 B15R1.870 NC(=O)CC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100134613110 [0,0,0,0,0,2|2,0,0]=4 3442 B15R1.870 NC(=O)CC(=O)NCc1ccc(cc1)Br 527a_100000174875_100134613110 [0,0,0,0,0,2|2,0,0]=4 3443 B15R1.870 NC(=O)CC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100134613110 [0,0,0,0,0,2|2,0,0]=4 3444 B15R1.870 NC(=O)CC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100134613110 [0,0,0,0,0,2|2,0,0]=4 3445 B15R1.870 NC(=O)CC(=O)NCc1ccc(cc1)F 240690a_100000174882_100134613110 [0,0,0,0,0,2|2,0,0]=4 3446 B15R1.870 NC(=O)CC(=O)NCc1ccc(cc1)F 527a_100000174882_100134613110 [0,0,0,0,0,2|2,0,0]=4 3447 B15R1.870 NC(=O)CC(=O)NCc1ccc(cc1)I 240690a_100016989417_100134613110 [0,0,0,0,0,2|2,0,0]=4 3448 B15R1.870 NC(=O)CC(=O)NCc1ccc(cc1)I 527a_100016989417_100134613110 [0,0,0,0,0,2|2,0,0]=4 3449 B15R1.870 NC(=O)CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100134613110 [0,0,0,0,0,2|1,0,0]=3 3450 B15R1.870 NC(=O)CC(=O)NCc1ccc(cc1)O 527a_100000185549_100134613110 [0,0,0,0,0,2|1,0,0]=3 3451 B15R1.870 NC(=O)CC(=O)NCc1ccc(cn1)O 240690a_100020605196_100134613110 [0,0,0,0,0,2|2,0,0]=4 3452 B15R1.870 NC(=O)CC(=O)NCc1ccc(nc1)O 240690a_100000757128_100134613110 [0,0,0,0,0,2|2,0,0]=4 3453 B15R1.870 NC(=O)NC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000182717 [0,0,0,0,0,2|2,0,0]=4 3454 B15R1.870 NC(=O)NC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000182717 [0,0,0,0,0,2|2,0,0]=4 3455 B15R1.870 NC(=O)NC(=O)COc1ccc(cc1)Br 7a_100000185759_100000182717 [0,0,0,0,0,2|2,0,0]=4 3456 B15R1.870 NC(=O)NC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000182717 [0,0,0,0,0,2|2,0,0]=4 3457 B15R1.870 NC(=O)NC(=O)COc1ccc(cc1)I 7a_100000212066_100000182717 [0,0,0,0,0,2|2,0,0]=4 3458 B15R1.870 NC(=O)NC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000182717 [0,0,0,0,0,2|2,0,0]=4 3459 B15R1.870 NC(=O)NC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000182717 [0,0,0,0,0,2|2,0,0]=4 3460 B15R1.870 NC(=O)NC(=O)CSc1ccc(cc1)F 62a_100000211213_100000182717 [0,0,0,0,0,2|2,0,0]=4 3461 B15R1.870 NC(=O)NC(=O)CSc1ccc(cc1)N 62a_100000185761_100000182717 [0,0,0,0,0,2|2,0,0]=4 3462 B15R1.870 NC(=O)NC(=O)CSc1ccc(cn1)O 62a_100000685995_100000182717 [0,0,0,0,0,2|2,0,0]=4 3463 B15R1.870 O=C(C=C(Cl)Cl)CCc1ccc(cc1)O 1458a_100000137448_100009816426 [0,0,0,0,0,2|2,0,0]=4 3464 B15R1.870 O=C(C=C(Cl)Cl)NCc1ccc(cc1)O 240690a_100000185549_100000137448 [0,0,0,0,0,2|2,0,0]=4 3465 B15R1.870 O=C(CCc1ccc(cc1)O)C[N+](=O)[O-] 1458a_100000742835_100000761209 [0,0,0,0,0,2|1,0,1]=4 3466 B15R1.870 O=C(COc1ccc(cc1)O)C[N+](=O)[O-] 1458a_100000031633_100000761209 [0,0,0,0,0,2|1,0,1]=4 3467 B15R1.870 O=C([O-])CC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100020667443 [0,0,0,0,0,2|1,0,1]=4 3468 B15R1.870 O=C([O-])CC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100020667443 [0,0,0,0,0,2|1,0,1]=4 3469 B15R1.870 O=C([O-])CC(=O)CCc1ccc(cc1)F 1458a_100000198493_100020667443 [0,0,0,0,0,2|1,0,1]=4 3470 B15R1.870 O=C([O-])CC(=O)CCc1ccc(cc1)I 1458a_100011217499_100020667443 [0,0,0,0,0,2|1,0,1]=4 3471 B15R1.870 O=C([O-])CC(=O)CCc1ccc(cc1)O 1458a_100000742835_100020667443 [0,0,0,0,0,2|0,0,1]=3 3472 B15R1.870 O=C([O-])CC(=O)COc1ccc(cc1)Br 1458a_100000182358_100020667443 [0,0,0,0,0,2|1,0,1]=4 3473 B15R1.870 O=C([O-])CC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100020667443 [0,0,0,0,0,2|1,0,1]=4 3474 B15R1.870 O=C([O-])CC(=O)COc1ccc(cc1)F 1458a_100000184765_100020667443 [0,0,0,0,0,2|1,0,1]=4 3475 B15R1.870 O=C([O-])CC(=O)COc1ccc(cc1)I 1458a_100000184369_100020667443 [0,0,0,0,0,2|1,0,1]=4 3476 B15R1.870 O=C([O-])CC(=O)COc1ccc(cc1)O 1458a_100000031633_100020667443 [0,0,0,0,0,2|0,0,1]=3 3477 B15R1.870 O=C([O-])CC(=O)CSc1ccc(cc1)Br 1458a_100000179496_100020667443 [0,0,0,0,0,2|1,0,1]=4 3478 B15R1.870 O=C([O-])CC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100020667443 [0,0,0,0,0,2|1,0,1]=4 3479 B15R1.870 O=C([O-])CC(=O)CSc1ccc(cc1)F 1458a_100000691584_100020667443 [0,0,0,0,0,2|1,0,1]=4 3480 B15R1.111 C=C(C)CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000730704 [0,0,0,0,0,2|2,0,0]=4 3481 B15R1.111 C=C(C)CNC(=O)Cc1ccc(cc1)O 1626a_100000765925_100000198540 [0,0,0,0,0,2|2,0,0]=4 3482 B15R1.111 C=C(C)CNC(=O)Cc1ccc(cc1)O 240690a_100000765925_100000198540 [0,0,0,0,0,2|2,0,0]=4 3483 B15R1.111 C=C(C)CNC(=O)Cc1ccc(cc1)O 527a_100000765925_100000198540 [0,0,0,0,0,2|2,0,0]=4 3484 B15R1.111 CC(=CCC(=O)Cc1ccc(cc1)O)C 1458a_100000198540_100000761012 [0,0,0,0,0,2|2,0,0]=4 3485 B15R1.111 CC(=O)CCC(=O)Nc1ccc(cc1)O 1458a_200000180990_200000210301 [0,0,0,0,0,2|2,0,0]=4 3486 B15R1.111 CC(=O)NCC(=O)Cc1ccc(cc1)Br 1458a_100000194580_100000189115 [0,0,0,0,0,2|2,0,0]=4 3487 B15R1.111 CC(=O)NCC(=O)Cc1ccc(cc1)C 1458a_100000194580_100000210814 [0,0,0,0,0,2|2,0,0]=4 3488 B15R1.111 CC(=O)NCC(=O)Cc1ccc(cc1)Cl 1458a_100000194580_100000694040 [0,0,0,0,0,2|2,0,0]=4 3489 B15R1.111 CC(=O)NCC(=O)Cc1ccc(cc1)F 1458a_100000194580_100000198546 [0,0,0,0,0,2|2,0,0]=4 3490 B15R1.111 CC(=O)NCC(=O)Cc1ccc(cc1)I 1458a_100000194580_100000189116 [0,0,0,0,0,2|2,0,0]=4 3491 B15R1.111 CC(=O)NCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000194580 [0,0,0,0,0,2|2,0,0]=4 3492 B15R1.111 CC(=O)NNC(=O)Cc1ccc(cc1)Br 22a_100000189765_100000198978 [0,0,0,0,0,2|2,0,0]=4 3493 B15R1.111 CC(=O)NNC(=O)Cc1ccc(cc1)C 22a_100000189221_100000070787 [0,0,0,0,0,2|2,0,0]=4 3494 B15R1.111 CC(=O)NNC(=O)Cc1ccc(cc1)C 22a_100000189765_100000212244 [0,0,0,0,0,2|2,0,0]=4 3495 B15R1.111 CC(=O)NNC(=O)Cc1ccc(cc1)Cl 22a_100000181177_100000070787 [0,0,0,0,0,2|2,0,0]=4 3496 B15R1.111 CC(=O)NNC(=O)Cc1ccc(cc1)Cl 22a_100000189765_100000211027 [0,0,0,0,0,2|2,0,0]=4 3497 B15R1.111 CC(=O)NNC(=O)Cc1ccc(cc1)F 22a_100000181394_100000070787 [0,0,0,0,0,2|2,0,0]=4 3498 B15R1.111 CC(=O)NNC(=O)Cc1ccc(cc1)F 22a_100000189765_100000210951 [0,0,0,0,0,2|2,0,0]=4 3499 B15R1.111 CC(=O)NNC(=O)Cc1ccc(cc1)I 22a_100000189765_100000688869 [0,0,0,0,0,2|2,0,0]=4 3500 B15R1.111 CC(=O)NNC(=O)Cc1ccc(cc1)O 22a_100000189765_100000198540 [0,0,0,0,0,2|1,0,0]=3 3501 B15R1.111 CC(=O)OCC(=O)Cc1ccc(cc1)Br 1458a_100000183556_100000189115 [0,0,0,0,0,2|2,0,0]=4 3502 B15R1.111 CC(=O)OCC(=O)Cc1ccc(cc1)C 1458a_100000183556_100000210814 [0,0,0,0,0,2|2,0,0]=4 3503 B15R1.111 CC(=O)OCC(=O)Cc1ccc(cc1)Cl 1458a_100000183556_100000694040 [0,0,0,0,0,2|2,0,0]=4 3504 B15R1.111 CC(=O)OCC(=O)Cc1ccc(cc1)F 1458a_100000183556_100000198546 [0,0,0,0,0,2|2,0,0]=4 3505 B15R1.111 CC(=O)OCC(=O)Cc1ccc(cc1)I 1458a_100000183556_100000189116 [0,0,0,0,0,2|2,0,0]=4 3506 B15R1.111 CC(=O)OCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000183556 [0,0,0,0,0,2|2,0,0]=4 3507 B15R1.111 CC(=O)SCC(=O)Cc1ccc(cc1)Br 1458a_100000049016_100000189115 [0,0,0,0,0,2|2,0,0]=4 3508 B15R1.111 CC(=O)SCC(=O)Cc1ccc(cc1)C 1458a_100000049016_100000210814 [0,0,0,0,0,2|2,0,0]=4 3509 B15R1.111 CC(=O)SCC(=O)Cc1ccc(cc1)Cl 1458a_100000049016_100000694040 [0,0,0,0,0,2|2,0,0]=4 3510 B15R1.111 CC(=O)SCC(=O)Cc1ccc(cc1)F 1458a_100000049016_100000198546 [0,0,0,0,0,2|2,0,0]=4 3511 B15R1.111 CC(=O)SCC(=O)Cc1ccc(cc1)I 1458a_100000049016_100000189116 [0,0,0,0,0,2|2,0,0]=4 3512 B15R1.111 CC(O)CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100012276601 [0,0,0,0,0,2|1,0,1]=4 3513 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)O 240690a_100000210904_100000198540 [0,0,0,0,0,2|1,0,1]=4 3514 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)O 527a_100000210904_100000198540 [0,0,0,0,0,2|1,0,1]=4 3515 B15R1.111 Cc1ccc(cc1)CC(=O)CCC(=O)N 1458a_100011215257_100000210814 [0,0,0,0,0,2|2,0,0]=4 3516 B15R1.111 Cc1ccc(cc1)CC(=O)CNC(=O)N 1458a_100000184981_100000210814 [0,0,0,0,0,2|2,0,0]=4 3517 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(=O)N 11a_100000711301_100000212244 [0,0,0,0,0,2|2,0,0]=4 3518 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(=O)N 240690a_100000711301_100000212244 [0,0,0,0,0,2|2,0,0]=4 3519 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(=O)N 527a_100000711301_100000212244 [0,0,0,0,0,2|2,0,0]=4 3520 B15R1.111 NC(=O)CCC(=O)Cc1ccc(cc1)Br 1458a_100011215257_100000189115 [0,0,0,0,0,2|2,0,0]=4 3521 B15R1.111 NC(=O)CCC(=O)Cc1ccc(cc1)Cl 1458a_100011215257_100000694040 [0,0,0,0,0,2|2,0,0]=4 3522 B15R1.111 NC(=O)CCC(=O)Cc1ccc(cc1)F 1458a_100011215257_100000198546 [0,0,0,0,0,2|2,0,0]=4 3523 B15R1.111 NC(=O)CCC(=O)Cc1ccc(cc1)I 1458a_100011215257_100000189116 [0,0,0,0,0,2|2,0,0]=4 3524 B15R1.111 NC(=O)CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100011215257 [0,0,0,0,0,2|2,0,0]=4 3525 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)Br 11a_100000711301_100000198978 [0,0,0,0,0,2|2,0,0]=4 3526 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)Br 240690a_100000711301_100000198978 [0,0,0,0,0,2|2,0,0]=4 3527 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)Br 527a_100000711301_100000198978 [0,0,0,0,0,2|2,0,0]=4 3528 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)Cl 11a_100000711301_100000211027 [0,0,0,0,0,2|2,0,0]=4 3529 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)Cl 240690a_100000711301_100000211027 [0,0,0,0,0,2|2,0,0]=4 3530 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)Cl 527a_100000711301_100000211027 [0,0,0,0,0,2|2,0,0]=4 3531 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)F 11a_100000711301_100000210951 [0,0,0,0,0,2|2,0,0]=4 3532 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)F 240690a_100000711301_100000210951 [0,0,0,0,0,2|2,0,0]=4 3533 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)F 527a_100000711301_100000210951 [0,0,0,0,0,2|2,0,0]=4 3534 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)I 11a_100000711301_100000688869 [0,0,0,0,0,2|2,0,0]=4 3535 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)I 240690a_100000711301_100000688869 [0,0,0,0,0,2|2,0,0]=4 3536 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)I 527a_100000711301_100000688869 [0,0,0,0,0,2|2,0,0]=4 3537 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)O 240690a_100000711301_100000198540 [0,0,0,0,0,2|1,0,0]=3 3538 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)O 527a_100000711301_100000198540 [0,0,0,0,0,2|1,0,0]=3 3539 B15R1.111 NC(=O)CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000711301 [0,0,0,0,0,2|2,0,0]=4 3540 B15R1.111 NC(=O)NCC(=O)Cc1ccc(cc1)Br 1458a_100000184981_100000189115 [0,0,0,0,0,2|2,0,0]=4 3541 B15R1.111 NC(=O)NCC(=O)Cc1ccc(cc1)Cl 1458a_100000184981_100000694040 [0,0,0,0,0,2|2,0,0]=4 3542 B15R1.111 NC(=O)NCC(=O)Cc1ccc(cc1)F 1458a_100000184981_100000198546 [0,0,0,0,0,2|2,0,0]=4 3543 B15R1.111 NC(=O)NCC(=O)Cc1ccc(cc1)I 1458a_100000184981_100000189116 [0,0,0,0,0,2|2,0,0]=4 3544 B15R1.111 NC(=O)NCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000184981 [0,0,0,0,0,2|2,0,0]=4 3545 B15R1.111 [13CH3]C(=O)CCC(=O)Nc1ccc(cc1)O 1458a_200000180990_200025704644 [0,0,0,0,0,2|2,0,0]=4