0 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)O 7a_100011218179_100000179758 [0,0,0,0,0,0|4,0,0]=4 1 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000179758 [0,0,0,0,0,0|4,0,0]=4 2 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)O)C 7a_100000759471_100000179758 [0,0,0,0,0,0|4,0,0]=4 3 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000179758 [0,0,0,0,0,0|4,0,0]=4 4 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)O 62a_100009814033_100012361655 [0,0,0,0,0,0|4,0,0]=4 5 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100009814033 [0,0,0,0,0,0|4,0,0]=4 6 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)O 62a_100009814033_100000186361 [0,0,0,0,0,0|4,0,0]=4 7 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)O 62a_100009814033_100012360047 [0,0,0,0,0,0|4,0,0]=4 8 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100009814033 [0,0,0,0,0,0|4,0,0]=4 9 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)O 62a_100000185481_100009814033 [0,0,0,0,0,0|4,0,0]=4 10 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)O 62a_100009814033_100000185481 [0,0,0,0,0,0|4,0,0]=4 11 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)O 62a_100000752626_100009814033 [0,0,0,0,0,0|4,0,0]=4 12 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)O 62a_100009814033_100000752626 [0,0,0,0,0,0|4,0,0]=4 13 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)Br 62a_100009814033_100012356990 [0,0,0,0,0,0|4,0,0]=4 14 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100009814033 [0,0,0,0,0,0|4,0,0]=4 15 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)C 62a_100000685420_100009814033 [0,0,0,0,0,0|4,0,0]=4 16 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)C 62a_100009814033_100000685420 [0,0,0,0,0,0|4,0,0]=4 17 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)Cl 62a_100009814033_100011356854 [0,0,0,0,0,0|4,0,0]=4 18 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100009814033 [0,0,0,0,0,0|4,0,0]=4 19 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)F 62a_100000686035_100009814033 [0,0,0,0,0,0|4,0,0]=4 20 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)F 62a_100009814033_100000686035 [0,0,0,0,0,0|4,0,0]=4 21 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)N 62a_100000739049_100009814033 [0,0,0,0,0,0|4,0,0]=4 22 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)N 62a_100009814033_100000739049 [0,0,0,0,0,0|4,0,0]=4 23 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)O 62a_100009814033_100009813601 [0,0,0,0,0,0|3,0,0]=3 24 B14R1.686 CC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200000210301 [0,0,0,0,0,0|2,0,0]=2 25 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)O)O 240690a_100020587154_100015343762 [0,0,0,0,0,0|3,0,0]=3 26 B14R1.686 CC(Nc1ccc(c(c1)Br)O)C(=O)N 34a_100011534360_100000702099 [0,0,0,0,0,0|4,0,0]=4 27 B14R1.686 CC(Nc1ccc(c(c1)Cl)O)C(=O)N 34a_100000744943_100000702099 [0,0,0,0,0,0|4,0,0]=4 28 B14R1.686 CC(Nc1ccc(c(c1)F)O)C(=O)N 34a_100011220035_100000702099 [0,0,0,0,0,0|4,0,0]=4 29 B14R1.686 CC(Nc1ccc(c(c1)F)O)C(=O)N 7a_100011220035_100000702099 [0,0,0,0,0,0|4,0,0]=4 30 B14R1.686 CC(Nc1ccc(c(c1)O)Cl)C(=O)N 34a_100011934209_100000702099 [0,0,0,0,0,0|4,0,0]=4 31 B14R1.686 CC(Nc1ccc(c(c1)O)F)C(=O)N 34a_100012017398_100000702099 [0,0,0,0,0,0|4,0,0]=4 32 B14R1.686 CC(Nc1ccc(c(c1)O)F)C(=O)N 7a_100012017398_100000702099 [0,0,0,0,0,0|4,0,0]=4 33 B14R1.686 CC(Nc1ccc(c(c1)O)O)C(=O)N 34a_100102946323_100000702099 [0,0,0,0,0,0|3,0,0]=3 34 B14R1.686 CC(Sc1ccc(c(c1)Br)O)C(=O)N 62a_100000702099_100012361655 [0,0,0,0,0,0|4,0,0]=4 35 B14R1.686 CC(Sc1ccc(c(c1)Br)O)C(=O)N 62a_100012361655_100000702099 [0,0,0,0,0,0|4,0,0]=4 36 B14R1.686 CC(Sc1ccc(c(c1)Cl)O)C(=O)N 62a_100000702099_100012360047 [0,0,0,0,0,0|4,0,0]=4 37 B14R1.686 CC(Sc1ccc(c(c1)Cl)O)C(=O)N 62a_100012360047_100000702099 [0,0,0,0,0,0|4,0,0]=4 38 B14R1.686 CC(Sc1ccc(c(c1)F)O)C(=O)N 62a_100000185481_100000702099 [0,0,0,0,0,0|4,0,0]=4 39 B14R1.686 CC(Sc1ccc(c(c1)F)O)C(=O)N 62a_100000702099_100000185481 [0,0,0,0,0,0|4,0,0]=4 40 B14R1.686 CC(Sc1ccc(c(c1)N)O)C(=O)N 62a_100000702099_100000752626 [0,0,0,0,0,0|4,0,0]=4 41 B14R1.686 CC(Sc1ccc(c(c1)N)O)C(=O)N 62a_100000752626_100000702099 [0,0,0,0,0,0|4,0,0]=4 42 B14R1.686 CC(Sc1ccc(c(c1)O)Br)C(=O)N 62a_100000702099_100012356990 [0,0,0,0,0,0|4,0,0]=4 43 B14R1.686 CC(Sc1ccc(c(c1)O)Br)C(=O)N 62a_100012356990_100000702099 [0,0,0,0,0,0|4,0,0]=4 44 B14R1.686 CC(Sc1ccc(c(c1)O)Cl)C(=O)N 62a_100000702099_100011356854 [0,0,0,0,0,0|4,0,0]=4 45 B14R1.686 CC(Sc1ccc(c(c1)O)Cl)C(=O)N 62a_100011356854_100000702099 [0,0,0,0,0,0|4,0,0]=4 46 B14R1.686 CC(Sc1ccc(c(c1)O)F)C(=O)N 62a_100000686035_100000702099 [0,0,0,0,0,0|4,0,0]=4 47 B14R1.686 CC(Sc1ccc(c(c1)O)F)C(=O)N 62a_100000702099_100000686035 [0,0,0,0,0,0|4,0,0]=4 48 B14R1.686 CC(Sc1ccc(c(c1)O)N)C(=O)N 62a_100000702099_100000739049 [0,0,0,0,0,0|4,0,0]=4 49 B14R1.686 CC(Sc1ccc(c(c1)O)N)C(=O)N 62a_100000739049_100000702099 [0,0,0,0,0,0|4,0,0]=4 50 B14R1.686 CC(Sc1ccc(c(c1)O)O)C(=O)N 62a_100000702099_100009813601 [0,0,0,0,0,0|3,0,0]=3 51 B14R1.686 Cc1cc(ccc1O)NC(C)C(=O)N 34a_100011218179_100000702099 [0,0,0,0,0,0|4,0,0]=4 52 B14R1.686 Cc1cc(ccc1O)NC(C)C(=O)N 7a_100011218179_100000702099 [0,0,0,0,0,0|4,0,0]=4 53 B14R1.686 Cc1cc(ccc1O)NC(F)C(=O)N 34a_100011218179_100009813875 [0,0,0,0,0,0|4,0,0]=4 54 B14R1.686 Cc1cc(ccc1O)NC(F)C(=O)N 7a_100011218179_100009813875 [0,0,0,0,0,0|4,0,0]=4 55 B14R1.686 Cc1cc(ccc1O)NC(F)C(=O)[O-] 34a_100011218179_100020610796 [0,0,0,0,0,0|3,0,1]=4 56 B14R1.686 Cc1cc(ccc1O)SC(C)C(=O)N 62a_100000702099_100000186361 [0,0,0,0,0,0|4,0,0]=4 57 B14R1.686 Cc1cc(ccc1O)SC(F)C(=O)N 62a_100009813875_100000186361 [0,0,0,0,0,0|4,0,0]=4 58 B14R1.686 Cc1cc(ccc1O)SC(F)C(=O)[O-] 62a_100020610796_100000186361 [0,0,0,0,0,0|3,0,1]=4 59 B14R1.686 Cc1ccc(cc1O)NC(C)C(=O)N 34a_100000759471_100000702099 [0,0,0,0,0,0|4,0,0]=4 60 B14R1.686 Cc1ccc(cc1O)NC(C)C(=O)N 7a_100000759471_100000702099 [0,0,0,0,0,0|4,0,0]=4 61 B14R1.686 Cc1ccc(cc1O)NC(F)C(=O)N 34a_100000759471_100009813875 [0,0,0,0,0,0|4,0,0]=4 62 B14R1.686 Cc1ccc(cc1O)NC(F)C(=O)N 7a_100000759471_100009813875 [0,0,0,0,0,0|4,0,0]=4 63 B14R1.686 Cc1ccc(cc1O)NC(F)C(=O)[O-] 34a_100000759471_100020610796 [0,0,0,0,0,0|3,0,1]=4 64 B14R1.686 Cc1ccc(cc1O)SC(C)C(=O)N 62a_100000685420_100000702099 [0,0,0,0,0,0|4,0,0]=4 65 B14R1.686 Cc1ccc(cc1O)SC(C)C(=O)N 62a_100000702099_100000685420 [0,0,0,0,0,0|4,0,0]=4 66 B14R1.686 Cc1ccc(cc1O)SC(F)C(=O)N 62a_100000685420_100009813875 [0,0,0,0,0,0|4,0,0]=4 67 B14R1.686 Cc1ccc(cc1O)SC(F)C(=O)N 62a_100009813875_100000685420 [0,0,0,0,0,0|4,0,0]=4 68 B14R1.686 Cc1ccc(cc1O)SC(F)C(=O)[O-] 62a_100000685420_100020610796 [0,0,0,0,0,0|3,0,1]=4 69 B14R1.686 Cc1ccc(cc1O)SC(F)C(=O)[O-] 62a_100020610796_100000685420 [0,0,0,0,0,0|3,0,1]=4 70 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100011215815 [0,0,0,0,0,0|3,0,1]=4 71 B14R1.686 NC(=O)C(F)Nc1ccc(c(c1)Br)O 34a_100011534360_100009813875 [0,0,0,0,0,0|4,0,0]=4 72 B14R1.686 NC(=O)C(F)Nc1ccc(c(c1)Cl)O 34a_100000744943_100009813875 [0,0,0,0,0,0|4,0,0]=4 73 B14R1.686 NC(=O)C(F)Nc1ccc(c(c1)F)O 34a_100011220035_100009813875 [0,0,0,0,0,0|4,0,0]=4 74 B14R1.686 NC(=O)C(F)Nc1ccc(c(c1)F)O 7a_100011220035_100009813875 [0,0,0,0,0,0|4,0,0]=4 75 B14R1.686 NC(=O)C(F)Nc1ccc(c(c1)O)Cl 34a_100011934209_100009813875 [0,0,0,0,0,0|4,0,0]=4 76 B14R1.686 NC(=O)C(F)Nc1ccc(c(c1)O)F 34a_100012017398_100009813875 [0,0,0,0,0,0|4,0,0]=4 77 B14R1.686 NC(=O)C(F)Nc1ccc(c(c1)O)F 7a_100012017398_100009813875 [0,0,0,0,0,0|4,0,0]=4 78 B14R1.686 NC(=O)C(F)Nc1ccc(c(c1)O)O 34a_100102946323_100009813875 [0,0,0,0,0,0|3,0,0]=3 79 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)Br)O 62a_100009813875_100012361655 [0,0,0,0,0,0|4,0,0]=4 80 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)Br)O 62a_100012361655_100009813875 [0,0,0,0,0,0|4,0,0]=4 81 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)Cl)O 62a_100009813875_100012360047 [0,0,0,0,0,0|4,0,0]=4 82 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)Cl)O 62a_100012360047_100009813875 [0,0,0,0,0,0|4,0,0]=4 83 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)F)O 62a_100000185481_100009813875 [0,0,0,0,0,0|4,0,0]=4 84 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)F)O 62a_100009813875_100000185481 [0,0,0,0,0,0|4,0,0]=4 85 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)N)O 62a_100000752626_100009813875 [0,0,0,0,0,0|4,0,0]=4 86 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)N)O 62a_100009813875_100000752626 [0,0,0,0,0,0|4,0,0]=4 87 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)O)Br 62a_100009813875_100012356990 [0,0,0,0,0,0|4,0,0]=4 88 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)O)Br 62a_100012356990_100009813875 [0,0,0,0,0,0|4,0,0]=4 89 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)O)Cl 62a_100009813875_100011356854 [0,0,0,0,0,0|4,0,0]=4 90 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)O)Cl 62a_100011356854_100009813875 [0,0,0,0,0,0|4,0,0]=4 91 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)O)F 62a_100000686035_100009813875 [0,0,0,0,0,0|4,0,0]=4 92 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)O)F 62a_100009813875_100000686035 [0,0,0,0,0,0|4,0,0]=4 93 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)O)N 62a_100000739049_100009813875 [0,0,0,0,0,0|4,0,0]=4 94 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)O)N 62a_100009813875_100000739049 [0,0,0,0,0,0|4,0,0]=4 95 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)O)O 62a_100009813875_100009813601 [0,0,0,0,0,0|3,0,0]=3 96 B14R1.686 Nc1cc(ccc1O)SC(F)C(=O)[O-] 62a_100000752626_100020610796 [0,0,0,0,0,0|3,0,1]=4 97 B14R1.686 Nc1cc(ccc1O)SC(F)C(=O)[O-] 62a_100020610796_100000752626 [0,0,0,0,0,0|3,0,1]=4 98 B14R1.686 Nc1ccc(cc1O)SC(F)C(=O)[O-] 62a_100000739049_100020610796 [0,0,0,0,0,0|3,0,1]=4 99 B14R1.686 Nc1ccc(cc1O)SC(F)C(=O)[O-] 62a_100020610796_100000739049 [0,0,0,0,0,0|3,0,1]=4 100 B14R1.686 O=C([O-])C(F)Nc1ccc(c(c1)Br)O 34a_100011534360_100020610796 [0,0,0,0,0,0|3,0,1]=4 101 B14R1.686 O=C([O-])C(F)Nc1ccc(c(c1)Cl)O 34a_100000744943_100020610796 [0,0,0,0,0,0|3,0,1]=4 102 B14R1.686 O=C([O-])C(F)Nc1ccc(c(c1)F)O 34a_100011220035_100020610796 [0,0,0,0,0,0|3,0,1]=4 103 B14R1.686 O=C([O-])C(F)Nc1ccc(c(c1)O)Cl 34a_100011934209_100020610796 [0,0,0,0,0,0|3,0,1]=4 104 B14R1.686 O=C([O-])C(F)Nc1ccc(c(c1)O)F 34a_100012017398_100020610796 [0,0,0,0,0,0|3,0,1]=4 105 B14R1.686 O=C([O-])C(F)Nc1ccc(c(c1)O)O 34a_100102946323_100020610796 [0,0,0,0,0,0|2,0,1]=3 106 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)Br)O 62a_100012361655_100020610796 [0,0,0,0,0,0|3,0,1]=4 107 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)Br)O 62a_100020610796_100012361655 [0,0,0,0,0,0|3,0,1]=4 108 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)Cl)O 62a_100012360047_100020610796 [0,0,0,0,0,0|3,0,1]=4 109 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)Cl)O 62a_100020610796_100012360047 [0,0,0,0,0,0|3,0,1]=4 110 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)F)O 62a_100000185481_100020610796 [0,0,0,0,0,0|3,0,1]=4 111 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)F)O 62a_100020610796_100000185481 [0,0,0,0,0,0|3,0,1]=4 112 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)O)Br 62a_100012356990_100020610796 [0,0,0,0,0,0|3,0,1]=4 113 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)O)Br 62a_100020610796_100012356990 [0,0,0,0,0,0|3,0,1]=4 114 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)O)Cl 62a_100011356854_100020610796 [0,0,0,0,0,0|3,0,1]=4 115 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)O)Cl 62a_100020610796_100011356854 [0,0,0,0,0,0|3,0,1]=4 116 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)O)F 62a_100000686035_100020610796 [0,0,0,0,0,0|3,0,1]=4 117 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)O)F 62a_100020610796_100000686035 [0,0,0,0,0,0|3,0,1]=4 118 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)O)O 62a_100020610796_100009813601 [0,0,0,0,0,0|2,0,1]=3 119 B14R1.686 [13CH3]C(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200025704644 [0,0,0,0,0,0|2,0,0]=2 120 B13R1.133 CC(=O)C(C)Cc1ccc(cc1)Br 1458a_100000695199_200000210301 [1,0,0,0,0,0|3,0,0]=4 121 B13R1.133 CC(=O)C(C)Cc1ccc(cc1)F 1458a_100000746122_200000210301 [1,0,0,0,0,0|3,0,0]=4 122 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)O 62a_100009814033_100000185759 [1,0,0,0,0,0|3,0,0]=4 123 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)Cl 1458a_100012362158_200000210301 [1,0,0,0,0,0|3,0,0]=4 124 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)F 1458a_100012179405_200000210301 [1,0,0,0,0,0|3,0,0]=4 125 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200000210301 [1,0,0,0,0,0|2,0,0]=3 126 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)O 240690a_100000207500_100015343762 [1,0,0,0,0,0|3,0,0]=4 127 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)O 527a_100000207500_100103153847 [1,0,0,0,0,0|3,0,0]=4 128 B13R1.133 CC(=O)[C@@H](C)Oc1ccc(cc1)O 1458a_100000005562_200000210301 [1,0,0,0,0,0|3,0,0]=4 129 B13R1.133 CC(=O)[C@@H](O)Cc1ccc(cc1)Br 1458a_200015644258_200000210301 [1,0,0,0,0,0|3,0,0]=4 130 B13R1.133 CC(Cc1ccc(cc1)Br)C(=O)[13CH3] 1458a_100000695199_200025704644 [1,0,0,0,0,0|3,0,0]=4 131 B13R1.133 CC(Cc1ccc(cc1)F)C(=O)[13CH3] 1458a_100000746122_200025704644 [1,0,0,0,0,0|3,0,0]=4 132 B13R1.133 CC(Nc1ccc(cc1)O)C(=O)N 34a_100000185829_100000702099 [1,0,0,0,0,0|3,0,0]=4 133 B13R1.133 CC(Oc1ccc(cc1)O)C(=O)N 271570a_203496583355_100000150412 [1,0,0,0,0,0|3,0,0]=4 134 B13R1.133 CC(Sc1ccc(cc1)O)C(=O)N 62a_100000702099_100000185759 [1,0,0,0,0,0|3,0,0]=4 135 B13R1.133 C[C@@H](Oc1ccc(cc1)O)C(=O)[13CH3] 1458a_100000005562_200025704644 [1,0,0,0,0,0|3,0,0]=4 136 B13R1.133 NC(=O)C(F)Nc1ccc(cc1)O 34a_100000185829_100009813875 [1,0,0,0,0,0|3,0,0]=4 137 B13R1.133 NC(=O)C(F)Sc1ccc(cc1)O 62a_100009813875_100000185759 [1,0,0,0,0,0|3,0,0]=4 138 B13R1.133 O=C([O-])C(F)Nc1ccc(cc1)O 34a_100000185829_100020610796 [1,0,0,0,0,0|2,0,1]=4 139 B13R1.133 O=C([O-])C(F)Sc1ccc(cc1)O 62a_100020610796_100000185759 [1,0,0,0,0,0|2,0,1]=4 140 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)Cl 1458a_100012362158_200025704644 [1,0,0,0,0,0|3,0,0]=4 141 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)F 1458a_100012179405_200025704644 [1,0,0,0,0,0|3,0,0]=4 142 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200025704644 [1,0,0,0,0,0|2,0,0]=3 143 B13R1.133 [13CH3]C(=O)[C@@H](O)Cc1ccc(cc1)Br 1458a_200015644258_200025704644 [1,0,0,0,0,0|3,0,0]=4 144 B13R1.148 CC(=O)C(C)Sc1cccc(c1)O 62a_100009814033_100000211634 [1,0,0,0,0,0|3,0,0]=4 145 B13R1.148 CC(=O)C(O)Cc1cccc(c1)Br 1458a_100012362086_200000210301 [1,0,0,0,0,0|3,0,0]=4 146 B13R1.148 CC(=O)N(C)Cc1cccc(c1)O 240690a_100000207540_100015343762 [1,0,0,0,0,0|3,0,0]=4 147 B13R1.148 CC(=O)N(C)Cc1cccc(c1)O 527a_100000207540_100103153847 [1,0,0,0,0,0|3,0,0]=4 148 B13R1.148 CC(=O)[C@@H](O)Cc1cccc(c1)F 1458a_200016142683_200000210301 [1,0,0,0,0,0|3,0,0]=4 149 B13R1.148 CC(Nc1cccc(c1)O)C(=O)N 34a_100000210217_100000702099 [1,0,0,0,0,0|3,0,0]=4 150 B13R1.148 CC(Oc1cccc(c1)O)C(=O)N 271570a_203496583355_200000150601 [1,0,0,0,0,0|3,0,0]=4 151 B13R1.148 CC(Sc1cccc(c1)O)C(=O)N 62a_100000702099_100000211634 [1,0,0,0,0,0|3,0,0]=4 152 B13R1.148 NC(=O)C(F)Nc1cccc(c1)O 34a_100000210217_100009813875 [1,0,0,0,0,0|3,0,0]=4 153 B13R1.148 NC(=O)C(F)Sc1cccc(c1)O 62a_100009813875_100000211634 [1,0,0,0,0,0|3,0,0]=4 154 B13R1.148 O=C([O-])C(F)Nc1cccc(c1)O 34a_100000210217_100020610796 [1,0,0,0,0,0|2,0,1]=4 155 B13R1.148 O=C([O-])C(F)Sc1cccc(c1)O 62a_100020610796_100000211634 [1,0,0,0,0,0|2,0,1]=4 156 B13R1.148 [13CH3]C(=O)C(O)Cc1cccc(c1)Br 1458a_100012362086_200025704644 [1,0,0,0,0,0|3,0,0]=4 157 B13R1.148 [13CH3]C(=O)[C@@H](O)Cc1cccc(c1)F 1458a_200016142683_200025704644 [1,0,0,0,0,0|3,0,0]=4 158 B13R1.511 C=C(C)CNc1ccc(c(c1)O)O 34a_100102946323_100000748629 [1,0,0,0,0,0|3,0,0]=4 159 B13R1.511 C=C(C)CSc1ccc(c(c1)O)O 62a_100000748629_100009813601 [1,0,0,0,0,0|3,0,0]=4 160 B13R1.511 C=C(F)CNc1ccc(c(c1)O)O 34a_100102946323_100009893438 [1,0,0,0,0,0|3,0,0]=4 161 B13R1.511 C=C(F)CSc1ccc(c(c1)O)O 62a_100000042424_100009813601 [1,0,0,0,0,0|3,0,0]=4 162 B13R1.511 CC(=O)CCc1ccc(c(c1)Br)C 1458a_100010220830_200000210301 [1,0,0,0,0,0|3,0,0]=4 163 B13R1.511 CC(=O)CCc1ccc(c(c1)Br)F 1458a_100011308364_200000210301 [1,0,0,0,0,0|3,0,0]=4 164 B13R1.511 CC(=O)CCc1ccc(c(c1)C)C 1458a_100011338283_200000210301 [1,0,0,0,0,0|3,0,0]=4 165 B13R1.511 CC(=O)CCc1ccc(c(c1)C)F 1458a_100011615030_200000210301 [1,0,0,0,0,0|3,0,0]=4 166 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Br 1458a_100009812081_200000210301 [1,0,0,0,0,0|3,0,0]=4 167 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000070787_100011713676 [1,0,0,0,0,0|3,0,0]=4 168 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000735579_200000210301 [1,0,0,0,0,0|3,0,0]=4 169 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)F 1458a_100000070787_100012361305 [1,0,0,0,0,0|3,0,0]=4 170 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)F 1458a_100011218152_200000210301 [1,0,0,0,0,0|3,0,0]=4 171 B13R1.511 CC(=O)CCc1ccc(c(c1)F)Br 1458a_100010146367_200000210301 [1,0,0,0,0,0|3,0,0]=4 172 B13R1.511 CC(=O)CCc1ccc(c(c1)F)C 1458a_100011830284_200000210301 [1,0,0,0,0,0|3,0,0]=4 173 B13R1.511 CC(=O)CCc1ccc(c(c1)F)Cl 1458a_100011518922_200000210301 [1,0,0,0,0,0|3,0,0]=4 174 B13R1.511 CC(=O)CCc1ccc(c(c1)F)F 1458a_100000070787_100000690553 [1,0,0,0,0,0|3,0,0]=4 175 B13R1.511 CC(=O)CCc1ccc(c(c1)F)F 1458a_100000737970_200000210301 [1,0,0,0,0,0|3,0,0]=4 176 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200000210301 [1,0,0,0,0,0|1,0,0]=2 177 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000070787_200010393615 [1,0,0,0,0,0|1,0,0]=2 178 B13R1.511 CC(=O)NCc1ccc(c(c1)F)O 240690a_100000758358_100015343762 [1,0,0,0,0,0|3,0,0]=4 179 B13R1.511 CC(=O)NCc1ccc(c(c1)F)O 527a_100000758358_100103153847 [1,0,0,0,0,0|3,0,0]=4 180 B13R1.511 CC(=O)NCc1ccc(c(c1)O)Cl 240690a_100020636435_100015343762 [1,0,0,0,0,0|3,0,0]=4 181 B13R1.511 CC(=O)NCc1ccc(c(c1)O)Cl 527a_100020636435_100103153847 [1,0,0,0,0,0|3,0,0]=4 182 B13R1.511 CC(=O)NCc1ccc(c(c1)O)F 240690a_100160469508_100015343762 [1,0,0,0,0,0|3,0,0]=4 183 B13R1.511 CC(=O)NCc1ccc(c(c1)O)F 527a_100160469508_100103153847 [1,0,0,0,0,0|3,0,0]=4 184 B13R1.511 CC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100015343762 [1,0,0,0,0,0|2,0,0]=3 185 B13R1.511 CC(O)CNc1ccc(c(c1)O)O 34a_100102946323_100011218427 [1,0,0,0,0,0|2,0,1]=4 186 B13R1.511 CC(O)CSc1ccc(c(c1)O)O 62a_100011218427_100009813601 [1,0,0,0,0,0|2,0,1]=4 187 B13R1.511 CN(C)CCc1ccc(c(c1)O)O 269982a_100102631434_200010393615 [1,0,0,0,0,0|3,0,0]=4 188 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)O)O 34a_100102946323_100009817552 [1,0,0,0,0,0|2,0,1]=4 189 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)O 62a_100009817552_100009813601 [1,0,0,0,0,0|2,0,1]=4 190 B13R1.511 Cc1cc(ccc1F)CCC(=O)[13CH3] 1458a_100011615030_200025704644 [1,0,0,0,0,0|3,0,0]=4 191 B13R1.511 Cc1cc(ccc1O)NCC(=O)N 34a_100011218179_100000187820 [1,0,0,0,0,0|3,0,0]=4 192 B13R1.511 Cc1cc(ccc1O)NCC(=O)N 7a_100011218179_100000187820 [1,0,0,0,0,0|3,0,0]=4 193 B13R1.511 Cc1cc(ccc1O)NCC(=O)[O-] 34a_100011218179_100020667443 [1,0,0,0,0,0|2,0,1]=4 194 B13R1.511 Cc1cc(ccc1O)SCC(=O)N 62a_100000747473_100000186361 [1,0,0,0,0,0|3,0,0]=4 195 B13R1.511 Cc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000186361 [1,0,0,0,0,0|2,0,1]=4 196 B13R1.511 Cc1ccc(cc1Br)CCC(=O)[13CH3] 1458a_100010220830_200025704644 [1,0,0,0,0,0|3,0,0]=4 197 B13R1.511 Cc1ccc(cc1C)CCC(=O)[13CH3] 1458a_100011338283_200025704644 [1,0,0,0,0,0|3,0,0]=4 198 B13R1.511 Cc1ccc(cc1F)CCC(=O)[13CH3] 1458a_100011830284_200025704644 [1,0,0,0,0,0|3,0,0]=4 199 B13R1.511 Cc1ccc(cc1O)NCC(=O)N 34a_100000759471_100000187820 [1,0,0,0,0,0|3,0,0]=4 200 B13R1.511 Cc1ccc(cc1O)NCC(=O)N 7a_100000759471_100000187820 [1,0,0,0,0,0|3,0,0]=4 201 B13R1.511 Cc1ccc(cc1O)NCC(=O)[O-] 34a_100000759471_100020667443 [1,0,0,0,0,0|2,0,1]=4 202 B13R1.511 Cc1ccc(cc1O)SCC(=O)N 62a_100000685420_100000747473 [1,0,0,0,0,0|3,0,0]=4 203 B13R1.511 Cc1ccc(cc1O)SCC(=O)N 62a_100000747473_100000685420 [1,0,0,0,0,0|3,0,0]=4 204 B13R1.511 Cc1ccc(cc1O)SCC(=O)[O-] 62a_100000685420_100020667443 [1,0,0,0,0,0|2,0,1]=4 205 B13R1.511 Cc1ccc(cc1O)SCC(=O)[O-] 62a_100020667443_100000685420 [1,0,0,0,0,0|2,0,1]=4 206 B13R1.511 NC(=O)CNc1ccc(c(c1)Br)O 34a_100011534360_100000187820 [1,0,0,0,0,0|3,0,0]=4 207 B13R1.511 NC(=O)CNc1ccc(c(c1)Cl)O 34a_100000744943_100000187820 [1,0,0,0,0,0|3,0,0]=4 208 B13R1.511 NC(=O)CNc1ccc(c(c1)F)O 34a_100011220035_100000187820 [1,0,0,0,0,0|3,0,0]=4 209 B13R1.511 NC(=O)CNc1ccc(c(c1)F)O 7a_100011220035_100000187820 [1,0,0,0,0,0|3,0,0]=4 210 B13R1.511 NC(=O)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000187820 [1,0,0,0,0,0|3,0,0]=4 211 B13R1.511 NC(=O)CNc1ccc(c(c1)O)F 34a_100012017398_100000187820 [1,0,0,0,0,0|3,0,0]=4 212 B13R1.511 NC(=O)CNc1ccc(c(c1)O)F 7a_100012017398_100000187820 [1,0,0,0,0,0|3,0,0]=4 213 B13R1.511 NC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000187820 [1,0,0,0,0,0|2,0,0]=3 214 B13R1.511 NC(=O)CSc1ccc(c(c1)Br)O 62a_100000747473_100012361655 [1,0,0,0,0,0|3,0,0]=4 215 B13R1.511 NC(=O)CSc1ccc(c(c1)Br)O 62a_100012361655_100000747473 [1,0,0,0,0,0|3,0,0]=4 216 B13R1.511 NC(=O)CSc1ccc(c(c1)Cl)O 62a_100000747473_100012360047 [1,0,0,0,0,0|3,0,0]=4 217 B13R1.511 NC(=O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000747473 [1,0,0,0,0,0|3,0,0]=4 218 B13R1.511 NC(=O)CSc1ccc(c(c1)F)O 62a_100000185481_100000747473 [1,0,0,0,0,0|3,0,0]=4 219 B13R1.511 NC(=O)CSc1ccc(c(c1)F)O 62a_100000747473_100000185481 [1,0,0,0,0,0|3,0,0]=4 220 B13R1.511 NC(=O)CSc1ccc(c(c1)N)O 62a_100000747473_100000752626 [1,0,0,0,0,0|3,0,0]=4 221 B13R1.511 NC(=O)CSc1ccc(c(c1)N)O 62a_100000752626_100000747473 [1,0,0,0,0,0|3,0,0]=4 222 B13R1.511 NC(=O)CSc1ccc(c(c1)O)Br 62a_100000747473_100012356990 [1,0,0,0,0,0|3,0,0]=4 223 B13R1.511 NC(=O)CSc1ccc(c(c1)O)Br 62a_100012356990_100000747473 [1,0,0,0,0,0|3,0,0]=4 224 B13R1.511 NC(=O)CSc1ccc(c(c1)O)Cl 62a_100000747473_100011356854 [1,0,0,0,0,0|3,0,0]=4 225 B13R1.511 NC(=O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000747473 [1,0,0,0,0,0|3,0,0]=4 226 B13R1.511 NC(=O)CSc1ccc(c(c1)O)F 62a_100000686035_100000747473 [1,0,0,0,0,0|3,0,0]=4 227 B13R1.511 NC(=O)CSc1ccc(c(c1)O)F 62a_100000747473_100000686035 [1,0,0,0,0,0|3,0,0]=4 228 B13R1.511 NC(=O)CSc1ccc(c(c1)O)N 62a_100000739049_100000747473 [1,0,0,0,0,0|3,0,0]=4 229 B13R1.511 NC(=O)CSc1ccc(c(c1)O)N 62a_100000747473_100000739049 [1,0,0,0,0,0|3,0,0]=4 230 B13R1.511 NC(=O)CSc1ccc(c(c1)O)O 62a_100000747473_100009813601 [1,0,0,0,0,0|2,0,0]=3 231 B13R1.511 Nc1cc(ccc1O)SCC(=O)[O-] 62a_100000752626_100020667443 [1,0,0,0,0,0|2,0,1]=4 232 B13R1.511 Nc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000752626 [1,0,0,0,0,0|2,0,1]=4 233 B13R1.511 Nc1ccc(cc1O)SCC(=O)[O-] 62a_100000739049_100020667443 [1,0,0,0,0,0|2,0,1]=4 234 B13R1.511 Nc1ccc(cc1O)SCC(=O)[O-] 62a_100020667443_100000739049 [1,0,0,0,0,0|2,0,1]=4 235 B13R1.511 O=C([O-])CNc1ccc(c(c1)Br)O 34a_100011534360_100020667443 [1,0,0,0,0,0|2,0,1]=4 236 B13R1.511 O=C([O-])CNc1ccc(c(c1)Cl)O 34a_100000744943_100020667443 [1,0,0,0,0,0|2,0,1]=4 237 B13R1.511 O=C([O-])CNc1ccc(c(c1)F)O 34a_100011220035_100020667443 [1,0,0,0,0,0|2,0,1]=4 238 B13R1.511 O=C([O-])CNc1ccc(c(c1)O)Cl 34a_100011934209_100020667443 [1,0,0,0,0,0|2,0,1]=4 239 B13R1.511 O=C([O-])CNc1ccc(c(c1)O)F 34a_100012017398_100020667443 [1,0,0,0,0,0|2,0,1]=4 240 B13R1.511 O=C([O-])CNc1ccc(c(c1)O)O 34a_100102946323_100020667443 [1,0,0,0,0,0|1,0,1]=3 241 B13R1.511 O=C([O-])CSc1ccc(c(c1)Br)O 62a_100012361655_100020667443 [1,0,0,0,0,0|2,0,1]=4 242 B13R1.511 O=C([O-])CSc1ccc(c(c1)Br)O 62a_100020667443_100012361655 [1,0,0,0,0,0|2,0,1]=4 243 B13R1.511 O=C([O-])CSc1ccc(c(c1)Cl)O 62a_100012360047_100020667443 [1,0,0,0,0,0|2,0,1]=4 244 B13R1.511 O=C([O-])CSc1ccc(c(c1)Cl)O 62a_100020667443_100012360047 [1,0,0,0,0,0|2,0,1]=4 245 B13R1.511 O=C([O-])CSc1ccc(c(c1)F)O 62a_100000185481_100020667443 [1,0,0,0,0,0|2,0,1]=4 246 B13R1.511 O=C([O-])CSc1ccc(c(c1)F)O 62a_100020667443_100000185481 [1,0,0,0,0,0|2,0,1]=4 247 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)Br 62a_100012356990_100020667443 [1,0,0,0,0,0|2,0,1]=4 248 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)Br 62a_100020667443_100012356990 [1,0,0,0,0,0|2,0,1]=4 249 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)Cl 62a_100011356854_100020667443 [1,0,0,0,0,0|2,0,1]=4 250 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)Cl 62a_100020667443_100011356854 [1,0,0,0,0,0|2,0,1]=4 251 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)F 62a_100000686035_100020667443 [1,0,0,0,0,0|2,0,1]=4 252 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)F 62a_100020667443_100000686035 [1,0,0,0,0,0|2,0,1]=4 253 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)O 62a_100020667443_100009813601 [1,0,0,0,0,0|1,0,1]=3 254 B13R1.511 O=[N+]([O-])CNc1ccc(c(c1)O)O 34a_100102946323_100000761209 [1,0,0,0,0,0|2,0,1]=4 255 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Br)F 1458a_100011308364_200025704644 [1,0,0,0,0,0|3,0,0]=4 256 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)Br 1458a_100009812081_200025704644 [1,0,0,0,0,0|3,0,0]=4 257 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000735579_200025704644 [1,0,0,0,0,0|3,0,0]=4 258 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)F 1458a_100011218152_200025704644 [1,0,0,0,0,0|3,0,0]=4 259 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)Br 1458a_100010146367_200025704644 [1,0,0,0,0,0|3,0,0]=4 260 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)Cl 1458a_100011518922_200025704644 [1,0,0,0,0,0|3,0,0]=4 261 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)F 1458a_100000737970_200025704644 [1,0,0,0,0,0|3,0,0]=4 262 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200025704644 [1,0,0,0,0,0|1,0,0]=2 263 B13R1.2879 C=CC(C)Sc1ccc(c(c1)O)O 62a_100011215867_100009813601 [1,0,0,0,0,0|3,0,0]=4 264 B13R1.2879 CC(CO)Nc1ccc(c(c1)O)O 34a_100102946323_100012180447 [1,0,0,0,0,0|2,0,1]=4 265 B13R1.2879 CC(CO)Sc1ccc(c(c1)O)O 62a_100012180447_100009813601 [1,0,0,0,0,0|2,0,1]=4 266 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)O)O 62a_100016084084_100009813601 [1,0,0,0,0,0|2,0,1]=4 267 B15R1.676 CCC(Nc1ccc(c(c1)O)O)C(=O)N 34a_100102946323_100000750255 [0,1,0,0,0,0|3,0,0]=4 268 B15R1.676 CCC(Sc1ccc(c(c1)O)O)C(=O)N 62a_100000750255_100009813601 [0,1,0,0,0,0|3,0,0]=4 269 B15R1.676 CNC(Cc1ccc(c(c1)Cl)F)C(=O)O 269956a_103549770568_200000210301 [0,1,0,0,0,0|2,0,0]=3 270 B15R1.676 CN[C@@H](Cc1ccc(c(c1)Cl)Cl)C(=O)O 269956a_100011737835_200000210301 [0,1,0,0,0,0|2,0,0]=3 271 B15R1.676 CN[C@@H](Cc1ccc(c(c1)F)F)C(=O)O 269956a_100011737850_200000210301 [0,1,0,0,0,0|2,0,0]=3 272 B15R1.676 [13CH3]NC(Cc1ccc(c(c1)Cl)F)C(=O)O 269956a_103549770568_200025704644 [0,1,0,0,0,0|2,0,0]=3 273 B15R1.676 [13CH3]N[C@@H](Cc1ccc(c(c1)Cl)Cl)C(=O)O 269956a_100011737835_200025704644 [0,1,0,0,0,0|2,0,0]=3 274 B15R1.676 [13CH3]N[C@@H](Cc1ccc(c(c1)F)F)C(=O)O 269956a_100011737850_200025704644 [0,1,0,0,0,0|2,0,0]=3 275 B15R1.890 CC(=O)C(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000179758 [0,1,0,0,0,0|2,0,1]=4 276 B15R1.890 CC(C(=O)N)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000702099 [0,1,0,0,0,0|2,0,1]=4 277 B15R1.890 NC(=O)C(F)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100009813875 [0,1,0,0,0,0|2,0,1]=4 278 B15R1.890 O=C([O-])C(F)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100020610796 [0,1,0,0,0,0|1,0,2]=4 279 B15R1.3777 CC(=O)C(C)Sc1ccc(c(c1)O)CO 62a_100000071718_100009814033 [0,1,0,0,0,0|3,0,0]=4 280 B15R1.3777 CC(=O)C(C)Sc1ccc(c(c1)O)CO 62a_100009814033_100000071718 [0,1,0,0,0,0|3,0,0]=4 281 B15R1.3777 CC(Sc1ccc(c(c1)O)CO)C(=O)N 62a_100000071718_100000702099 [0,1,0,0,0,0|3,0,0]=4 282 B15R1.3777 CC(Sc1ccc(c(c1)O)CO)C(=O)N 62a_100000702099_100000071718 [0,1,0,0,0,0|3,0,0]=4 283 B15R1.3777 COc1ccc(cc1O)CN(C)C(=O)C 240690a_100000188468_100015343762 [0,1,0,0,0,0|3,0,0]=4 284 B15R1.3777 COc1ccc(cc1O)CN(C)C(=O)C 527a_100000188468_100103153847 [0,1,0,0,0,0|3,0,0]=4 285 B15R1.3777 COc1ccc(cc1O)NC(C)C(=O)N 34a_100000211920_100000702099 [0,1,0,0,0,0|3,0,0]=4 286 B15R1.3777 COc1ccc(cc1O)NC(F)C(=O)N 34a_100000211920_100009813875 [0,1,0,0,0,0|3,0,0]=4 287 B15R1.3777 COc1ccc(cc1O)NC(F)C(=O)[O-] 34a_100000211920_100020610796 [0,1,0,0,0,0|2,0,1]=4 288 B15R1.3777 COc1ccc(cc1O)SC(C)C(=O)C 62a_100009814033_100009816560 [0,1,0,0,0,0|3,0,0]=4 289 B15R1.3777 COc1ccc(cc1O)SC(C)C(=O)N 62a_100000702099_100009816560 [0,1,0,0,0,0|3,0,0]=4 290 B15R1.3777 COc1ccc(cc1O)SC(F)C(=O)N 62a_100009813875_100009816560 [0,1,0,0,0,0|3,0,0]=4 291 B15R1.3777 COc1ccc(cc1O)SC(F)C(=O)[O-] 62a_100020610796_100009816560 [0,1,0,0,0,0|2,0,1]=4 292 B15R1.3777 NC(=O)C(F)Sc1ccc(c(c1)O)CO 62a_100000071718_100009813875 [0,1,0,0,0,0|3,0,0]=4 293 B15R1.3777 NC(=O)C(F)Sc1ccc(c(c1)O)CO 62a_100009813875_100000071718 [0,1,0,0,0,0|3,0,0]=4 294 B15R1.3777 O=C([O-])C(F)Sc1ccc(c(c1)O)CO 62a_100000071718_100020610796 [0,1,0,0,0,0|2,0,1]=4 295 B15R1.3777 O=C([O-])C(F)Sc1ccc(c(c1)O)CO 62a_100020610796_100000071718 [0,1,0,0,0,0|2,0,1]=4 296 B15R1.4038 CC(=O)C(C)Sc1ccc(c(c1)CO)O 62a_100000184703_100009814033 [0,1,0,0,0,0|3,0,0]=4 297 B15R1.4038 CC(=O)C(C)Sc1ccc(c(c1)CO)O 62a_100009814033_100000184703 [0,1,0,0,0,0|3,0,0]=4 298 B15R1.4038 CC(Sc1ccc(c(c1)CO)O)C(=O)N 62a_100000184703_100000702099 [0,1,0,0,0,0|3,0,0]=4 299 B15R1.4038 CC(Sc1ccc(c(c1)CO)O)C(=O)N 62a_100000702099_100000184703 [0,1,0,0,0,0|3,0,0]=4 300 B15R1.4038 COc1cc(ccc1O)NC(C)C(=O)N 34a_100000726020_100000702099 [0,1,0,0,0,0|3,0,0]=4 301 B15R1.4038 COc1cc(ccc1O)NC(F)C(=O)N 34a_100000726020_100009813875 [0,1,0,0,0,0|3,0,0]=4 302 B15R1.4038 COc1cc(ccc1O)NC(F)C(=O)[O-] 34a_100000726020_100020610796 [0,1,0,0,0,0|2,0,1]=4 303 B15R1.4038 COc1cc(ccc1O)SC(C)C(=O)C 62a_100009814033_100000694246 [0,1,0,0,0,0|3,0,0]=4 304 B15R1.4038 COc1cc(ccc1O)SC(C)C(=O)N 62a_100000702099_100000694246 [0,1,0,0,0,0|3,0,0]=4 305 B15R1.4038 COc1cc(ccc1O)SC(F)C(=O)N 62a_100009813875_100000694246 [0,1,0,0,0,0|3,0,0]=4 306 B15R1.4038 COc1cc(ccc1O)SC(F)C(=O)[O-] 62a_100020610796_100000694246 [0,1,0,0,0,0|2,0,1]=4 307 B15R1.4038 NC(=O)C(F)Sc1ccc(c(c1)CO)O 62a_100000184703_100009813875 [0,1,0,0,0,0|3,0,0]=4 308 B15R1.4038 NC(=O)C(F)Sc1ccc(c(c1)CO)O 62a_100009813875_100000184703 [0,1,0,0,0,0|3,0,0]=4 309 B15R1.4038 O=C([O-])C(F)Sc1ccc(c(c1)CO)O 62a_100000184703_100020610796 [0,1,0,0,0,0|2,0,1]=4 310 B15R1.4038 O=C([O-])C(F)Sc1ccc(c(c1)CO)O 62a_100020610796_100000184703 [0,1,0,0,0,0|2,0,1]=4 311 B15R1.5521 C=CC(=O)N(C)Cc1ccc(c(c1)O)O 240690a_100020587154_200121576911 [0,1,0,0,0,0|3,0,0]=4 312 B15R1.5521 CCC(=O)C(C)Sc1ccc(c(c1)O)O 62a_100000742827_100009813601 [0,1,0,0,0,0|3,0,0]=4 313 B15R1.5521 CCC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_100000210202 [0,1,0,0,0,0|2,0,0]=3 314 B15R1.5521 CCC(=O)N(C)Cc1ccc(c(c1)O)O 240690a_100020587154_100000210414 [0,1,0,0,0,0|3,0,0]=4 315 B15R1.5521 CN(Cc1ccc(c(c1)O)O)C(=O)CO 240690a_100020587154_100000210174 [0,1,0,0,0,0|2,0,0]=3 316 B15R1.5521 CNC(=O)C(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000731044 [0,1,0,0,0,0|3,0,0]=4 317 B15R1.5521 CNC(=O)C(C)Sc1ccc(c(c1)O)O 62a_100000209862_100009813601 [0,1,0,0,0,0|3,0,0]=4 318 B15R1.5521 CNC(=O)C(F)Nc1ccc(c(c1)O)O 34a_100102946323_100009813575 [0,1,0,0,0,0|3,0,0]=4 319 B15R1.5521 CNC(=O)C(F)Sc1ccc(c(c1)O)O 62a_100009813575_100009813601 [0,1,0,0,0,0|3,0,0]=4 320 B15R1.5521 CNC(=O)N(C)Cc1ccc(c(c1)O)O 273464a_100102657272_100020587154 [0,1,0,0,0,0|3,0,0]=4 321 B15R1.5521 COC(=O)C(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000024059 [0,1,0,0,0,0|2,0,1]=4 322 B15R1.5521 COC(=O)C(C)Nc1ccc(c(c1)Br)O 34a_100011534360_100000211248 [0,1,0,0,0,0|3,0,0]=4 323 B15R1.5521 COC(=O)C(C)Nc1ccc(c(c1)C)O 34a_100011218179_100000211248 [0,1,0,0,0,0|3,0,0]=4 324 B15R1.5521 COC(=O)C(C)Nc1ccc(c(c1)C)O 7a_100011218179_100000211248 [0,1,0,0,0,0|3,0,0]=4 325 B15R1.5521 COC(=O)C(C)Nc1ccc(c(c1)Cl)O 34a_100000744943_100000211248 [0,1,0,0,0,0|3,0,0]=4 326 B15R1.5521 COC(=O)C(C)Nc1ccc(c(c1)F)O 34a_100011220035_100000211248 [0,1,0,0,0,0|3,0,0]=4 327 B15R1.5521 COC(=O)C(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000211248 [0,1,0,0,0,0|3,0,0]=4 328 B15R1.5521 COC(=O)C(C)Nc1ccc(c(c1)O)C 34a_100000759471_100000211248 [0,1,0,0,0,0|3,0,0]=4 329 B15R1.5521 COC(=O)C(C)Nc1ccc(c(c1)O)C 7a_100000759471_100000211248 [0,1,0,0,0,0|3,0,0]=4 330 B15R1.5521 COC(=O)C(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100000211248 [0,1,0,0,0,0|3,0,0]=4 331 B15R1.5521 COC(=O)C(C)Nc1ccc(c(c1)O)F 34a_100012017398_100000211248 [0,1,0,0,0,0|3,0,0]=4 332 B15R1.5521 COC(=O)C(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000211248 [0,1,0,0,0,0|3,0,0]=4 333 B15R1.5521 COC(=O)C(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000211248 [0,1,0,0,0,0|2,0,0]=3 334 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)Br)O 62a_100000211248_100012361655 [0,1,0,0,0,0|3,0,0]=4 335 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100000211248 [0,1,0,0,0,0|3,0,0]=4 336 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)C)O 62a_100000211248_100000186361 [0,1,0,0,0,0|3,0,0]=4 337 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)Cl)O 62a_100000211248_100012360047 [0,1,0,0,0,0|3,0,0]=4 338 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100000211248 [0,1,0,0,0,0|3,0,0]=4 339 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)F)O 62a_100000185481_100000211248 [0,1,0,0,0,0|3,0,0]=4 340 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)F)O 62a_100000211248_100000185481 [0,1,0,0,0,0|3,0,0]=4 341 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)N)O 62a_100000211248_100000752626 [0,1,0,0,0,0|3,0,0]=4 342 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)N)O 62a_100000752626_100000211248 [0,1,0,0,0,0|3,0,0]=4 343 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)O)Br 62a_100000211248_100012356990 [0,1,0,0,0,0|3,0,0]=4 344 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100000211248 [0,1,0,0,0,0|3,0,0]=4 345 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)O)C 62a_100000211248_100000685420 [0,1,0,0,0,0|3,0,0]=4 346 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)O)C 62a_100000685420_100000211248 [0,1,0,0,0,0|3,0,0]=4 347 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)O)Cl 62a_100000211248_100011356854 [0,1,0,0,0,0|3,0,0]=4 348 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100000211248 [0,1,0,0,0,0|3,0,0]=4 349 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)O)F 62a_100000211248_100000686035 [0,1,0,0,0,0|3,0,0]=4 350 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)O)F 62a_100000686035_100000211248 [0,1,0,0,0,0|3,0,0]=4 351 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)O)N 62a_100000211248_100000739049 [0,1,0,0,0,0|3,0,0]=4 352 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)O)N 62a_100000739049_100000211248 [0,1,0,0,0,0|3,0,0]=4 353 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)O)O 62a_100000211248_100009813601 [0,1,0,0,0,0|2,0,0]=3 354 B15R1.5521 O=C(CF)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_100015361967 [0,1,0,0,0,0|2,0,0]=3 355 B15R1.11316 CC(=O)C(C)(C)Sc1ccc(c(c1)O)O 62a_100000075568_100009813601 [0,1,0,0,0,0|3,0,0]=4 356 B15R1.11316 CC(C)(Nc1ccc(c(c1)O)O)C(=O)N 34a_100102946323_100000702505 [0,1,0,0,0,0|3,0,0]=4 357 B15R1.11316 CC(C)(Sc1ccc(c(c1)O)O)C(=O)N 62a_100000702505_100009813601 [0,1,0,0,0,0|3,0,0]=4 358 B15R1.11316 NC(=O)C(F)(F)Sc1ccc(c(c1)O)O 62a_100009811971_100009813601 [0,1,0,0,0,0|3,0,0]=4 359 B15R1.11316 O=C([O-])C(F)(F)Nc1ccc(c(c1)O)O 34a_100102946323_100020612412 [0,1,0,0,0,0|2,0,1]=4 360 B15R1.11316 O=C([O-])C(F)(F)Sc1ccc(c(c1)O)O 62a_100000745680_100009813601 [0,1,0,0,0,0|2,0,1]=4 361 B15R1.28955 CC(=O)C(C)Sc1cc(c(c(c1)F)O)O 62a_100009814033_100010114375 [0,1,0,0,0,0|3,0,0]=4 362 B15R1.28955 CC(=O)C(C)Sc1cc(c(c(c1)O)O)O 62a_100009814033_100010658518 [0,1,0,0,0,0|3,0,0]=4 363 B15R1.28955 CC(Sc1cc(c(c(c1)F)O)O)C(=O)N 62a_100000702099_100010114375 [0,1,0,0,0,0|3,0,0]=4 364 B15R1.28955 CC(Sc1cc(c(c(c1)O)O)O)C(=O)N 62a_100000702099_100010658518 [0,1,0,0,0,0|3,0,0]=4 365 B15R1.28955 NC(=O)C(F)Sc1cc(c(c(c1)F)O)O 62a_100009813875_100010114375 [0,1,0,0,0,0|3,0,0]=4 366 B15R1.28955 NC(=O)C(F)Sc1cc(c(c(c1)O)O)O 62a_100009813875_100010658518 [0,1,0,0,0,0|3,0,0]=4 367 B15R1.28955 O=C([O-])C(F)Sc1cc(c(c(c1)F)O)O 62a_100020610796_100010114375 [0,1,0,0,0,0|2,0,1]=4 368 B15R1.28955 O=C([O-])C(F)Sc1cc(c(c(c1)O)O)O 62a_100020610796_100010658518 [0,1,0,0,0,0|2,0,1]=4 369 B15R2.1522 O=C1CCC1Nc2ccc(c(c2)O)O 34a_100102946323_100009892977 [0,0,0,1,0,0|3,0,0]=4 370 B15R2.1522 O=C1CCC1Sc2ccc(c(c2)O)O 62a_100009892977_100009813601 [0,0,0,1,0,0|3,0,0]=4 371 B13R1.510 CC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200000210301 [0,0,0,0,1,0|2,0,0]=3 372 B13R1.510 [13CH3]C(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200025704644 [0,0,0,0,1,0|2,0,0]=3 373 B15R1.883 CC(=O)OC(C)Sc1ccc(c(c1)O)O 62a_100009818208_100009813601 [0,0,0,0,0,1|3,0,0]=4 374 B15R1.883 NC(=O)CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000187820 [0,0,0,0,0,1|2,0,1]=4 375 B15R1.883 O=C([O-])CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100020667443 [0,0,0,0,0,1|1,0,2]=4 376 B15R1.884 CC(=O)C(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100011261029 [0,0,0,0,0,1|2,0,1]=4 377 B15R1.884 CC(=O)C(=O)CSc1ccc(c(c1)O)O 62a_100011261029_100009813601 [0,0,0,0,0,1|2,0,1]=4 378 B15R1.884 CC(NCc1ccc(c(c1)F)O)C(=O)N 34a_100000758358_100000702099 [0,0,0,0,0,1|3,0,0]=4 379 B15R1.884 CC(NCc1ccc(c(c1)O)Cl)C(=O)N 34a_100020636435_100000702099 [0,0,0,0,0,1|3,0,0]=4 380 B15R1.884 CC(NCc1ccc(c(c1)O)F)C(=O)N 34a_100160469508_100000702099 [0,0,0,0,0,1|3,0,0]=4 381 B15R1.884 CC(NCc1ccc(c(c1)O)O)C(=O)N 34a_100000010075_100000702099 [0,0,0,0,0,1|2,0,0]=3 382 B15R1.884 C[C@H](NCc1cc(=O)c(co1)O)C(=O)O 269956a_100000743915_100000010605 [0,0,0,0,0,1|2,0,1]=4 383 B15R1.884 C[C@H](NCc1ccc(c(c1)Br)Br)C(=O)O 269956a_100000743915_100012353900 [0,0,0,0,0,1|3,0,0]=4 384 B15R1.884 C[C@H](NCc1ccc(c(c1)Br)Cl)C(=O)O 269956a_100000743915_100012353894 [0,0,0,0,0,1|3,0,0]=4 385 B15R1.884 C[C@H](NCc1ccc(c(c1)Br)F)C(=O)O 269956a_100000743915_100000743011 [0,0,0,0,0,1|3,0,0]=4 386 B15R1.884 C[C@H](NCc1ccc(c(c1)Cl)Br)C(=O)O 269956a_100000743915_100012353895 [0,0,0,0,0,1|3,0,0]=4 387 B15R1.884 C[C@H](NCc1ccc(c(c1)Cl)Cl)C(=O)O 269956a_100000743915_100000188800 [0,0,0,0,0,1|3,0,0]=4 388 B15R1.884 C[C@H](NCc1ccc(c(c1)Cl)F)C(=O)O 269956a_100000743915_100000717365 [0,0,0,0,0,1|3,0,0]=4 389 B15R1.884 C[C@H](NCc1ccc(c(c1)Cl)I)C(=O)O 269956a_100000743915_100012349665 [0,0,0,0,0,1|3,0,0]=4 390 B15R1.884 C[C@H](NCc1ccc(c(c1)F)Br)C(=O)O 269956a_100000743915_100000767054 [0,0,0,0,0,1|3,0,0]=4 391 B15R1.884 C[C@H](NCc1ccc(c(c1)F)Cl)C(=O)O 269956a_100000743915_100000716492 [0,0,0,0,0,1|3,0,0]=4 392 B15R1.884 C[C@H](NCc1ccc(c(c1)F)F)C(=O)O 269956a_100000743915_100000757363 [0,0,0,0,0,1|3,0,0]=4 393 B15R1.884 C[C@H](NCc1ccc(c(c1)F)I)C(=O)O 269956a_100000743915_100010149604 [0,0,0,0,0,1|3,0,0]=4 394 B15R1.884 C[C@H](NCc1ccc(c(c1)I)Br)C(=O)O 269956a_100000743915_100010146616 [0,0,0,0,0,1|3,0,0]=4 395 B15R1.884 C[C@H](NCc1ccc(c(c1)I)F)C(=O)O 269956a_100000743915_100010188208 [0,0,0,0,0,1|3,0,0]=4 396 B15R1.884 Cc1cc(ccc1Br)CN[C@@H](C)C(=O)O 269956a_100000743915_100000727479 [0,0,0,0,0,1|3,0,0]=4 397 B15R1.884 Cc1cc(ccc1Cl)CN[C@@H](C)C(=O)O 269956a_100000743915_100012184735 [0,0,0,0,0,1|3,0,0]=4 398 B15R1.884 Cc1cc(ccc1F)CN[C@@H](C)C(=O)O 269956a_100000743915_100011216667 [0,0,0,0,0,1|3,0,0]=4 399 B15R1.884 Cc1ccc(cc1Br)CN[C@@H](C)C(=O)O 269956a_100000743915_100012232412 [0,0,0,0,0,1|3,0,0]=4 400 B15R1.884 Cc1ccc(cc1C)CN[C@@H](C)C(=O)O 269956a_100000743915_100000742320 [0,0,0,0,0,1|3,0,0]=4 401 B15R1.884 Cc1ccc(cc1Cl)CN[C@@H](C)C(=O)O 269956a_100000743915_100011823929 [0,0,0,0,0,1|3,0,0]=4 402 B15R1.884 Cc1ccc(cc1F)CN[C@@H](C)C(=O)O 269956a_100000743915_100011217369 [0,0,0,0,0,1|3,0,0]=4 403 B15R1.884 Cc1ccc(cc1I)CN[C@@H](C)C(=O)O 269956a_100000743915_100010206137 [0,0,0,0,0,1|3,0,0]=4 404 B15R1.884 NC(=O)C(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100011215815 [0,0,0,0,0,1|2,0,1]=4 405 B15R1.884 NC(=O)C(F)NCc1ccc(c(c1)F)O 34a_100000758358_100009813875 [0,0,0,0,0,1|3,0,0]=4 406 B15R1.884 NC(=O)C(F)NCc1ccc(c(c1)O)Cl 34a_100020636435_100009813875 [0,0,0,0,0,1|3,0,0]=4 407 B15R1.884 NC(=O)C(F)NCc1ccc(c(c1)O)F 34a_100160469508_100009813875 [0,0,0,0,0,1|3,0,0]=4 408 B15R1.884 NC(=O)C(F)NCc1ccc(c(c1)O)O 34a_100000010075_100009813875 [0,0,0,0,0,1|2,0,0]=3 409 B15R1.884 O=C([O-])C(F)NCc1ccc(c(c1)F)O 34a_100000758358_100020610796 [0,0,0,0,0,1|2,0,1]=4 410 B15R1.884 O=C([O-])C(F)NCc1ccc(c(c1)O)Cl 34a_100020636435_100020610796 [0,0,0,0,0,1|2,0,1]=4 411 B15R1.884 O=C([O-])C(F)NCc1ccc(c(c1)O)F 34a_100160469508_100020610796 [0,0,0,0,0,1|2,0,1]=4 412 B15R1.884 O=C([O-])C(F)NCc1ccc(c(c1)O)O 34a_100000010075_100020610796 [0,0,0,0,0,1|1,0,1]=3 413 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000070787_100011740612 [2,0,0,0,0,0|2,0,0]=4 414 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000217147_200000210301 [2,0,0,0,0,0|2,0,0]=4 415 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000070787_100011713686 [2,0,0,0,0,0|2,0,0]=4 416 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000234883_200000210301 [2,0,0,0,0,0|2,0,0]=4 417 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000070787_100011713675 [2,0,0,0,0,0|2,0,0]=4 418 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200000210301 [2,0,0,0,0,0|2,0,0]=4 419 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000070787_100011217392 [2,0,0,0,0,0|2,0,0]=4 420 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000198493_200000210301 [2,0,0,0,0,0|2,0,0]=4 421 B12R1.21 CC(=O)CCc1ccc(cc1)I 1458a_100011217499_200000210301 [2,0,0,0,0,0|2,0,0]=4 422 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000070787_100009816426 [2,0,0,0,0,0|1,0,0]=3 423 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000742835_200000210301 [2,0,0,0,0,0|1,0,0]=3 424 B12R1.21 CC(=O)CCc1ccc(cc1)O 271570a_203496583355_100000723691 [2,0,0,0,0,0|1,0,0]=3 425 B12R1.21 CC(=O)COc1ccc(cc1)O 1458a_100000031633_200000210301 [2,0,0,0,0,0|2,0,0]=4 426 B12R1.21 CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100015343762 [2,0,0,0,0,0|2,0,0]=4 427 B12R1.21 CC(=O)NCc1ccc(cc1)O 271570a_203496583355_200000685173 [2,0,0,0,0,0|2,0,0]=4 428 B12R1.21 CC(=O)NCc1ccc(cc1)O 527a_100000185549_100103153847 [2,0,0,0,0,0|2,0,0]=4 429 B12R1.21 Cc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000234883_200025704644 [2,0,0,0,0,0|2,0,0]=4 430 B12R1.21 NC(=O)CCc1ccc(cc1)O 271570a_203496583355_200010110666 [2,0,0,0,0,0|1,0,0]=3 431 B12R1.21 NC(=O)CNc1ccc(cc1)O 34a_100000185829_100000187820 [2,0,0,0,0,0|2,0,0]=4 432 B12R1.21 NC(=O)CSc1ccc(cc1)O 271570a_203496583355_100000149456 [2,0,0,0,0,0|2,0,0]=4 433 B12R1.21 NC(=O)CSc1ccc(cc1)O 62a_100000747473_100000185759 [2,0,0,0,0,0|2,0,0]=4 434 B12R1.21 O=C([O-])CNc1ccc(cc1)O 34a_100000185829_100020667443 [2,0,0,0,0,0|1,0,1]=4 435 B12R1.21 O=C([O-])CSc1ccc(cc1)O 62a_100020667443_100000185759 [2,0,0,0,0,0|1,0,1]=4 436 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Br 1458a_100000217147_200025704644 [2,0,0,0,0,0|2,0,0]=4 437 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200025704644 [2,0,0,0,0,0|2,0,0]=4 438 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)F 1458a_100000198493_200025704644 [2,0,0,0,0,0|2,0,0]=4 439 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)I 1458a_100011217499_200025704644 [2,0,0,0,0,0|2,0,0]=4 440 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)O 1458a_100000742835_200025704644 [2,0,0,0,0,0|1,0,0]=3 441 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)O 1458a_100000031633_200025704644 [2,0,0,0,0,0|2,0,0]=4 442 B12R1.43 CC(=O)C(C)Cc1ccccc1 1458a_100000070787_200011218536 [2,0,0,0,0,0|2,0,0]=4 443 B12R1.43 CC(=O)C(C)Cc1ccccc1 1458a_100000754839_200000210301 [2,0,0,0,0,0|2,0,0]=4 444 B12R1.43 CC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_200000210301 [2,0,0,0,0,0|2,0,0]=4 445 B12R1.43 CC(Cc1ccccc1)C(=O)[13CH3] 1458a_100000754839_200025704644 [2,0,0,0,0,0|2,0,0]=4 446 B12R1.43 [13CH3]C(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_200025704644 [2,0,0,0,0,0|2,0,0]=4 447 B12R1.50 NC(CO)Cc1cccc(c1)O 271570a_203496583355_114802770106 [2,0,0,0,0,0|0,0,1]=3 448 B12R1.226 CC(=O)CCc1cccc(c1)Br 1458a_100000070787_100011740638 [2,0,0,0,0,0|2,0,0]=4 449 B12R1.226 CC(=O)CCc1cccc(c1)Br 1458a_100000184314_200000210301 [2,0,0,0,0,0|2,0,0]=4 450 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000070787_100011713685 [2,0,0,0,0,0|2,0,0]=4 451 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000234952_200000210301 [2,0,0,0,0,0|2,0,0]=4 452 B12R1.226 CC(=O)CCc1cccc(c1)Cl 1458a_100000070787_100011713710 [2,0,0,0,0,0|2,0,0]=4 453 B12R1.226 CC(=O)CCc1cccc(c1)Cl 1458a_100000235675_200000210301 [2,0,0,0,0,0|2,0,0]=4 454 B12R1.226 CC(=O)CCc1cccc(c1)F 1458a_100000070787_100011217235 [2,0,0,0,0,0|2,0,0]=4 455 B12R1.226 CC(=O)CCc1cccc(c1)F 1458a_100000235673_200000210301 [2,0,0,0,0,0|2,0,0]=4 456 B12R1.226 CC(=O)CCc1cccc(c1)I 1458a_100010007846_200000210301 [2,0,0,0,0,0|2,0,0]=4 457 B12R1.226 CC(=O)CCc1cccc(c1)O 1458a_100011216126_200000210301 [2,0,0,0,0,0|1,0,0]=3 458 B12R1.226 CC(=O)CCc1cccc(c1)O 271570a_203496583355_100011279149 [2,0,0,0,0,0|1,0,0]=3 459 B12R1.226 CC(=O)NCc1cccc(c1)O 240690a_100000743036_100015343762 [2,0,0,0,0,0|2,0,0]=4 460 B12R1.226 CC(=O)NCc1cccc(c1)O 271570a_203496583355_100000766983 [2,0,0,0,0,0|2,0,0]=4 461 B12R1.226 CC(=O)NCc1cccc(c1)O 527a_100000743036_100103153847 [2,0,0,0,0,0|2,0,0]=4 462 B12R1.226 Cc1cccc(c1)CCC(=O)[13CH3] 1458a_100000234952_200025704644 [2,0,0,0,0,0|2,0,0]=4 463 B12R1.226 NC(=O)CCc1cccc(c1)O 271570a_203496583355_100000162029 [2,0,0,0,0,0|1,0,0]=3 464 B12R1.226 NC(=O)CNc1cccc(c1)O 34a_100000210217_100000187820 [2,0,0,0,0,0|2,0,0]=4 465 B12R1.226 NC(=O)COc1cccc(c1)O 271570a_203496583355_200000150604 [2,0,0,0,0,0|2,0,0]=4 466 B12R1.226 NC(=O)CSc1cccc(c1)O 62a_100000747473_100000211634 [2,0,0,0,0,0|2,0,0]=4 467 B12R1.226 O=C([O-])CNc1cccc(c1)O 34a_100000210217_100020667443 [2,0,0,0,0,0|1,0,1]=4 468 B12R1.226 O=C([O-])CSc1cccc(c1)O 62a_100020667443_100000211634 [2,0,0,0,0,0|1,0,1]=4 469 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)Br 1458a_100000184314_200025704644 [2,0,0,0,0,0|2,0,0]=4 470 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)Cl 1458a_100000235675_200025704644 [2,0,0,0,0,0|2,0,0]=4 471 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)F 1458a_100000235673_200025704644 [2,0,0,0,0,0|2,0,0]=4 472 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)I 1458a_100010007846_200025704644 [2,0,0,0,0,0|2,0,0]=4 473 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)O 1458a_100011216126_200025704644 [2,0,0,0,0,0|1,0,0]=3 474 B12R1.385 C=CCNc1ccc(c(c1)O)O 34a_100102946323_100015514636 [2,0,0,0,0,0|2,0,0]=4 475 B12R1.385 C=CCSc1ccc(c(c1)O)O 62a_100000210623_100009813601 [2,0,0,0,0,0|2,0,0]=4 476 B12R1.385 CCCCc1ccc(c(c1)O)O 271570a_100020621405_100009813601 [2,0,0,0,0,0|1,0,1]=4 477 B12R1.385 CNCCc1ccc(c(c1)O)O 34a_100000210387_200000210301 [2,0,0,0,0,0|2,0,0]=4 478 B12R1.385 CNCCc1ccc(c(c1)O)O 7a_106832991635_200010393615 [2,0,0,0,0,0|2,0,0]=4 479 B12R1.385 CSCCc1ccc(c(c1)O)O 62a_200000210301_200010393615 [2,0,0,0,0,0|2,0,0]=4 480 B12R1.385 Cc1cc(ccc1O)NCC=O 34a_100011218179_200009817547 [2,0,0,0,0,0|2,0,0]=4 481 B12R1.385 Cc1cc(ccc1O)NCC=O 7a_100011218179_200015260668 [2,0,0,0,0,0|2,0,0]=4 482 B12R1.385 Cc1cc(ccc1O)SCC=O 62a_200015260668_100000186361 [2,0,0,0,0,0|2,0,0]=4 483 B12R1.385 Cc1ccc(cc1O)NCC=O 34a_100000759471_200009817547 [2,0,0,0,0,0|2,0,0]=4 484 B12R1.385 Cc1ccc(cc1O)NCC=O 7a_100000759471_200015260668 [2,0,0,0,0,0|2,0,0]=4 485 B12R1.385 Cc1ccc(cc1O)SCC=O 62a_100000685420_200015260668 [2,0,0,0,0,0|2,0,0]=4 486 B12R1.385 Cc1ccc(cc1O)SCC=O 62a_200015260668_100000685420 [2,0,0,0,0,0|2,0,0]=4 487 B12R1.385 Nc1cc(ccc1O)SCC=O 62a_100000752626_200015260668 [2,0,0,0,0,0|2,0,0]=4 488 B12R1.385 Nc1cc(ccc1O)SCC=O 62a_200015260668_100000752626 [2,0,0,0,0,0|2,0,0]=4 489 B12R1.385 Nc1ccc(cc1O)SCC=O 62a_100000739049_200015260668 [2,0,0,0,0,0|2,0,0]=4 490 B12R1.385 Nc1ccc(cc1O)SCC=O 62a_200015260668_100000739049 [2,0,0,0,0,0|2,0,0]=4 491 B12R1.385 O=CCNc1ccc(c(c1)Br)O 34a_100011534360_200009817547 [2,0,0,0,0,0|2,0,0]=4 492 B12R1.385 O=CCNc1ccc(c(c1)Cl)O 34a_100000744943_200009817547 [2,0,0,0,0,0|2,0,0]=4 493 B12R1.385 O=CCNc1ccc(c(c1)F)O 34a_100011220035_200009817547 [2,0,0,0,0,0|2,0,0]=4 494 B12R1.385 O=CCNc1ccc(c(c1)F)O 7a_100011220035_200015260668 [2,0,0,0,0,0|2,0,0]=4 495 B12R1.385 O=CCNc1ccc(c(c1)O)Cl 34a_100011934209_200009817547 [2,0,0,0,0,0|2,0,0]=4 496 B12R1.385 O=CCNc1ccc(c(c1)O)F 34a_100012017398_200009817547 [2,0,0,0,0,0|2,0,0]=4 497 B12R1.385 O=CCNc1ccc(c(c1)O)F 7a_100012017398_200015260668 [2,0,0,0,0,0|2,0,0]=4 498 B12R1.385 O=CCNc1ccc(c(c1)O)O 34a_100102946323_200009817547 [2,0,0,0,0,0|1,0,0]=3 499 B12R1.385 O=CCSc1ccc(c(c1)Br)O 62a_100012361655_200015260668 [2,0,0,0,0,0|2,0,0]=4 500 B12R1.385 O=CCSc1ccc(c(c1)Br)O 62a_200015260668_100012361655 [2,0,0,0,0,0|2,0,0]=4 501 B12R1.385 O=CCSc1ccc(c(c1)Cl)O 62a_100012360047_200015260668 [2,0,0,0,0,0|2,0,0]=4 502 B12R1.385 O=CCSc1ccc(c(c1)Cl)O 62a_200015260668_100012360047 [2,0,0,0,0,0|2,0,0]=4 503 B12R1.385 O=CCSc1ccc(c(c1)F)O 62a_100000185481_200015260668 [2,0,0,0,0,0|2,0,0]=4 504 B12R1.385 O=CCSc1ccc(c(c1)F)O 62a_200015260668_100000185481 [2,0,0,0,0,0|2,0,0]=4 505 B12R1.385 O=CCSc1ccc(c(c1)O)Br 62a_100012356990_200015260668 [2,0,0,0,0,0|2,0,0]=4 506 B12R1.385 O=CCSc1ccc(c(c1)O)Br 62a_200015260668_100012356990 [2,0,0,0,0,0|2,0,0]=4 507 B12R1.385 O=CCSc1ccc(c(c1)O)Cl 62a_100011356854_200015260668 [2,0,0,0,0,0|2,0,0]=4 508 B12R1.385 O=CCSc1ccc(c(c1)O)Cl 62a_200015260668_100011356854 [2,0,0,0,0,0|2,0,0]=4 509 B12R1.385 O=CCSc1ccc(c(c1)O)F 62a_100000686035_200015260668 [2,0,0,0,0,0|2,0,0]=4 510 B12R1.385 O=CCSc1ccc(c(c1)O)F 62a_200015260668_100000686035 [2,0,0,0,0,0|2,0,0]=4 511 B12R1.385 O=CCSc1ccc(c(c1)O)O 62a_200015260668_100009813601 [2,0,0,0,0,0|1,0,0]=3 512 B12R1.385 OCCNc1ccc(c(c1)O)O 34a_100102946323_100000211926 [2,0,0,0,0,0|1,0,1]=4 513 B12R1.385 OCCSc1ccc(c(c1)O)O 62a_100000211926_100009813601 [2,0,0,0,0,0|1,0,1]=4 514 B12R1.385 [13CH3]NCCc1ccc(c(c1)O)O 34a_100000210387_200025704644 [2,0,0,0,0,0|2,0,0]=4 515 B12R1.385 [13CH3]SCCc1ccc(c(c1)O)O 62a_200025704644_200010393615 [2,0,0,0,0,0|2,0,0]=4 516 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [2,0,0,0,0,0|1,0,1]=4 517 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [2,0,0,0,0,0|1,0,1]=4 518 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [2,0,0,0,0,0|1,0,1]=4 519 B14R1.3 COc1ccc(cc1)C[C@H](N)C(=O)N 34a_100011423149_200000210301 [1,1,0,0,0,0|1,0,0]=3 520 B14R1.3 [13CH3]Oc1ccc(cc1)C[C@H](N)C(=O)N 34a_100011423149_200025704644 [1,1,0,0,0,0|1,0,0]=3 521 B14R1.134 CCC(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_100000210202 [1,1,0,0,0,0|2,0,0]=4 522 B14R1.134 CN(Cc1ccc(cc1)O)C(=O)CO 240690a_100000207500_100000210174 [1,1,0,0,0,0|2,0,0]=4 523 B14R1.134 CN(Cc1ccc(cc1)O)C(=O)CO 527a_100000207500_100000210174 [1,1,0,0,0,0|2,0,0]=4 524 B14R1.134 CNC(=O)C(O)Cc1ccc(cc1)O 240690a_100102657272_100015278814 [1,1,0,0,0,0|2,0,0]=4 525 B14R1.134 COC(=O)C(C)Nc1ccc(cc1)O 34a_100000185829_100000211248 [1,1,0,0,0,0|2,0,0]=4 526 B14R1.134 COC(=O)C(C)Sc1ccc(cc1)O 62a_100000211248_100000185759 [1,1,0,0,0,0|2,0,0]=4 527 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(cc1)O 271570a_203496583355_100032004906 [1,1,0,0,0,0|0,0,0]=2 528 B14R1.134 COC(=O)[C@H](N)Cc1ccc(cc1)O 271570a_203496583355_100150708851 [1,1,0,0,0,0|0,0,0]=2 529 B14R1.134 O=C(CF)C(O)Cc1ccc(cc1)O 1458a_100015278814_100015361967 [1,1,0,0,0,0|2,0,0]=4 530 B14R1.536 CNC(Cc1ccc(cc1)Cl)C(=O)C 34a_100102657272_200009990494 [1,1,0,0,0,0|2,0,0]=4 531 B14R1.536 CNC(Cc1ccc(cc1)Cl)C(=O)C 7a_106832991635_200009990494 [1,1,0,0,0,0|2,0,0]=4 532 B14R1.536 CN[C@@H](Cc1ccc(cc1)O)C(=O)N 2230a_100011423149_200000210301 [1,1,0,0,0,0|1,0,0]=3 533 B14R1.536 CN[C@@H](Cc1ccc(cc1)O)C(=O)N 34a_100011423149_200000210301 [1,1,0,0,0,0|1,0,0]=3 534 B14R1.536 [13CH3]N[C@@H](Cc1ccc(cc1)O)C(=O)N 2230a_100011423149_200025704644 [1,1,0,0,0,0|1,0,0]=3 535 B14R1.536 [13CH3]N[C@@H](Cc1ccc(cc1)O)C(=O)N 34a_100011423149_200025704644 [1,1,0,0,0,0|1,0,0]=3 536 B14R1.75 COc1cccc(c1)CC(O)C(=O)C 1458a_100000693103_200000210301 [1,1,0,0,0,0|2,0,0]=4 537 B14R1.75 COc1cccc(c1)CC(O)C(=O)[13CH3] 1458a_100000693103_200025704644 [1,1,0,0,0,0|2,0,0]=4 538 B14R1.135 CN(Cc1cccc(c1)O)C(=O)CO 240690a_100000207540_100000210174 [1,1,0,0,0,0|2,0,0]=4 539 B14R1.135 CN(Cc1cccc(c1)O)C(=O)CO 527a_100000207540_100000210174 [1,1,0,0,0,0|2,0,0]=4 540 B14R1.135 COC(=O)C(C)Nc1cccc(c1)O 34a_100000210217_100000211248 [1,1,0,0,0,0|2,0,0]=4 541 B14R1.135 COC(=O)C(C)Sc1cccc(c1)O 62a_100000211248_100000211634 [1,1,0,0,0,0|2,0,0]=4 542 B14R1.135 COC(=O)C(N)Cc1cccc(c1)O 271570a_203496583355_100102946621 [1,1,0,0,0,0|0,0,0]=2 543 B14R1.542 CNC(Cc1cccc(c1)Cl)C(=O)C 34a_100102657272_200009990483 [1,1,0,0,0,0|2,0,0]=4 544 B14R1.542 CNC(Cc1cccc(c1)Cl)C(=O)C 7a_106832991635_200009990483 [1,1,0,0,0,0|2,0,0]=4 545 B14R1.542 CNC(Cc1cccc(c1)Cl)C(=O)O 269956a_100000685206_200000210301 [1,1,0,0,0,0|1,0,0]=3 546 B14R1.542 CNC(Cc1cccc(c1)F)C(=O)O 269956a_100102707141_200000210301 [1,1,0,0,0,0|1,0,0]=3 547 B14R1.542 [13CH3]NC(Cc1cccc(c1)Cl)C(=O)O 269956a_100000685206_200025704644 [1,1,0,0,0,0|1,0,0]=3 548 B14R1.542 [13CH3]NC(Cc1cccc(c1)F)C(=O)O 269956a_100102707141_200025704644 [1,1,0,0,0,0|1,0,0]=3 549 B14R1.42 COc1cc(ccc1C)CCC(=O)C 1458a_200000066385_200000210301 [1,1,0,0,0,0|2,0,0]=4 550 B14R1.42 COc1cc(ccc1C)CCC(=O)[13CH3] 1458a_200000066385_200025704644 [1,1,0,0,0,0|2,0,0]=4 551 B14R1.42 COc1cc(ccc1F)CCC(=O)C 1458a_100009849056_200000210301 [1,1,0,0,0,0|2,0,0]=4 552 B14R1.42 COc1cc(ccc1F)CCC(=O)[13CH3] 1458a_100009849056_200025704644 [1,1,0,0,0,0|2,0,0]=4 553 B14R1.42 COc1cc(ccc1O)CCC(=O)C 1458a_100000070787_100010741665 [1,1,0,0,0,0|1,0,0]=3 554 B14R1.42 COc1cc(ccc1O)CCC(=O)C 1458a_100011216321_200000210301 [1,1,0,0,0,0|1,0,0]=3 555 B14R1.42 COc1cc(ccc1O)CCC(=O)[13CH3] 1458a_100011216321_200025704644 [1,1,0,0,0,0|1,0,0]=3 556 B14R1.42 COc1cc(ccc1O)CNC(=O)C 11a_100000185554_100015343762 [1,1,0,0,0,0|2,0,0]=4 557 B14R1.42 COc1cc(ccc1O)CNC(=O)C 240690a_100000185554_100015343762 [1,1,0,0,0,0|2,0,0]=4 558 B14R1.42 COc1cc(ccc1O)CNC(=O)C 527a_100000185554_100103153847 [1,1,0,0,0,0|2,0,0]=4 559 B14R1.42 COc1cc(ccc1O)NCC(=O)N 34a_100000726020_100000187820 [1,1,0,0,0,0|2,0,0]=4 560 B14R1.42 COc1cc(ccc1O)NCC(=O)[O-] 34a_100000726020_100020667443 [1,1,0,0,0,0|1,0,1]=4 561 B14R1.42 COc1cc(ccc1O)SCC(=O)N 62a_100000747473_100000694246 [1,1,0,0,0,0|2,0,0]=4 562 B14R1.42 COc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000694246 [1,1,0,0,0,0|1,0,1]=4 563 B14R1.42 NC(=O)CSc1ccc(c(c1)CO)O 62a_100000184703_100000747473 [1,1,0,0,0,0|2,0,0]=4 564 B14R1.42 NC(=O)CSc1ccc(c(c1)CO)O 62a_100000747473_100000184703 [1,1,0,0,0,0|2,0,0]=4 565 B14R1.42 O=C([O-])CSc1ccc(c(c1)CO)O 62a_100000184703_100020667443 [1,1,0,0,0,0|1,0,1]=4 566 B14R1.42 O=C([O-])CSc1ccc(c(c1)CO)O 62a_100020667443_100000184703 [1,1,0,0,0,0|1,0,1]=4 567 B14R1.685 CC(=O)CC(=O)c1ccc(c(c1)O)O 1458a_100000070787_100000183813 [1,1,0,0,0,0|1,0,1]=4 568 B14R1.685 NC(=O)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000187820 [1,1,0,0,0,0|1,0,1]=4 569 B14R1.685 O=C([O-])CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100020667443 [1,1,0,0,0,0|0,0,2]=4 570 B14R1.833 C#CC(=O)CCc1ccc(c(c1)O)O 1458a_100000211873_200010393615 [1,1,0,0,0,0|1,0,0]=3 571 B14R1.833 C=CC(=O)CCc1ccc(c(c1)O)O 1458a_100000185746_200010393615 [1,1,0,0,0,0|1,0,0]=3 572 B14R1.833 C=CC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_200121576911 [1,1,0,0,0,0|2,0,0]=4 573 B14R1.833 CCC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_100000210202 [1,1,0,0,0,0|1,0,0]=3 574 B14R1.833 CCC(=O)CCc1ccc(c(c1)O)O 1458a_100000210414_200010393615 [1,1,0,0,0,0|1,0,0]=3 575 B14R1.833 CCC(=O)CSc1ccc(c(c1)O)O 62a_100000747405_100009813601 [1,1,0,0,0,0|2,0,0]=4 576 B14R1.833 CCC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100000210414 [1,1,0,0,0,0|2,0,0]=4 577 B14R1.833 CNC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000183359 [1,1,0,0,0,0|2,0,0]=4 578 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)O 62a_100000183359_100009813601 [1,1,0,0,0,0|2,0,0]=4 579 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 2708a_100000010075_106832991635 [1,1,0,0,0,0|2,0,0]=4 580 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 273464a_100000010075_100102657272 [1,1,0,0,0,0|2,0,0]=4 581 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 273464a_100102657272_100000010075 [1,1,0,0,0,0|2,0,0]=4 582 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 512a_106832991638_100000010075 [1,1,0,0,0,0|2,0,0]=4 583 B14R1.833 COC(=O)CNc1ccc(c(c1)Br)O 34a_100011534360_100000747449 [1,1,0,0,0,0|2,0,0]=4 584 B14R1.833 COC(=O)CNc1ccc(c(c1)C)O 34a_100011218179_100000747449 [1,1,0,0,0,0|2,0,0]=4 585 B14R1.833 COC(=O)CNc1ccc(c(c1)C)O 7a_100011218179_100000747449 [1,1,0,0,0,0|2,0,0]=4 586 B14R1.833 COC(=O)CNc1ccc(c(c1)Cl)O 34a_100000744943_100000747449 [1,1,0,0,0,0|2,0,0]=4 587 B14R1.833 COC(=O)CNc1ccc(c(c1)F)O 34a_100011220035_100000747449 [1,1,0,0,0,0|2,0,0]=4 588 B14R1.833 COC(=O)CNc1ccc(c(c1)F)O 7a_100011220035_100000747449 [1,1,0,0,0,0|2,0,0]=4 589 B14R1.833 COC(=O)CNc1ccc(c(c1)O)C 34a_100000759471_100000747449 [1,1,0,0,0,0|2,0,0]=4 590 B14R1.833 COC(=O)CNc1ccc(c(c1)O)C 7a_100000759471_100000747449 [1,1,0,0,0,0|2,0,0]=4 591 B14R1.833 COC(=O)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000747449 [1,1,0,0,0,0|2,0,0]=4 592 B14R1.833 COC(=O)CNc1ccc(c(c1)O)F 34a_100012017398_100000747449 [1,1,0,0,0,0|2,0,0]=4 593 B14R1.833 COC(=O)CNc1ccc(c(c1)O)F 7a_100012017398_100000747449 [1,1,0,0,0,0|2,0,0]=4 594 B14R1.833 COC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000747449 [1,1,0,0,0,0|1,0,0]=3 595 B14R1.833 COC(=O)COc1ccc(c(c1)N)O 271570a_203496583355_200010369463 [1,1,0,0,0,0|2,0,0]=4 596 B14R1.833 COC(=O)CSc1ccc(c(c1)Br)O 62a_100000747449_100012361655 [1,1,0,0,0,0|2,0,0]=4 597 B14R1.833 COC(=O)CSc1ccc(c(c1)Br)O 62a_100012361655_100000747449 [1,1,0,0,0,0|2,0,0]=4 598 B14R1.833 COC(=O)CSc1ccc(c(c1)C)O 62a_100000747449_100000186361 [1,1,0,0,0,0|2,0,0]=4 599 B14R1.833 COC(=O)CSc1ccc(c(c1)Cl)O 62a_100000747449_100012360047 [1,1,0,0,0,0|2,0,0]=4 600 B14R1.833 COC(=O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000747449 [1,1,0,0,0,0|2,0,0]=4 601 B14R1.833 COC(=O)CSc1ccc(c(c1)F)O 62a_100000185481_100000747449 [1,1,0,0,0,0|2,0,0]=4 602 B14R1.833 COC(=O)CSc1ccc(c(c1)F)O 62a_100000747449_100000185481 [1,1,0,0,0,0|2,0,0]=4 603 B14R1.833 COC(=O)CSc1ccc(c(c1)N)O 62a_100000747449_100000752626 [1,1,0,0,0,0|2,0,0]=4 604 B14R1.833 COC(=O)CSc1ccc(c(c1)N)O 62a_100000752626_100000747449 [1,1,0,0,0,0|2,0,0]=4 605 B14R1.833 COC(=O)CSc1ccc(c(c1)O)Br 62a_100000747449_100012356990 [1,1,0,0,0,0|2,0,0]=4 606 B14R1.833 COC(=O)CSc1ccc(c(c1)O)Br 62a_100012356990_100000747449 [1,1,0,0,0,0|2,0,0]=4 607 B14R1.833 COC(=O)CSc1ccc(c(c1)O)C 62a_100000685420_100000747449 [1,1,0,0,0,0|2,0,0]=4 608 B14R1.833 COC(=O)CSc1ccc(c(c1)O)C 62a_100000747449_100000685420 [1,1,0,0,0,0|2,0,0]=4 609 B14R1.833 COC(=O)CSc1ccc(c(c1)O)Cl 62a_100000747449_100011356854 [1,1,0,0,0,0|2,0,0]=4 610 B14R1.833 COC(=O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000747449 [1,1,0,0,0,0|2,0,0]=4 611 B14R1.833 COC(=O)CSc1ccc(c(c1)O)F 62a_100000686035_100000747449 [1,1,0,0,0,0|2,0,0]=4 612 B14R1.833 COC(=O)CSc1ccc(c(c1)O)F 62a_100000747449_100000686035 [1,1,0,0,0,0|2,0,0]=4 613 B14R1.833 COC(=O)CSc1ccc(c(c1)O)N 62a_100000739049_100000747449 [1,1,0,0,0,0|2,0,0]=4 614 B14R1.833 COC(=O)CSc1ccc(c(c1)O)N 62a_100000747449_100000739049 [1,1,0,0,0,0|2,0,0]=4 615 B14R1.833 COC(=O)CSc1ccc(c(c1)O)O 62a_100000747449_100009813601 [1,1,0,0,0,0|1,0,0]=3 616 B14R1.833 O=C(CF)CCc1ccc(c(c1)O)O 1458a_100000042615_100015361967 [1,1,0,0,0,0|1,0,0]=3 617 B14R1.833 O=C(CO)CCc1ccc(c(c1)Cl)Cl 1458a_100000210174_100011713676 [1,1,0,0,0,0|2,0,0]=4 618 B14R1.833 O=C(CO)CCc1ccc(c(c1)Cl)F 1458a_100000210174_100012361305 [1,1,0,0,0,0|2,0,0]=4 619 B14R1.833 O=C(CO)CCc1ccc(c(c1)F)F 1458a_100000210174_100000690553 [1,1,0,0,0,0|2,0,0]=4 620 B14R1.833 O=C(CO)CCc1ccc(c(c1)O)O 1458a_100000210174_200010393615 [1,1,0,0,0,0|0,0,0]=2 621 B14R1.833 O=C(CO)NCc1ccc(c(c1)F)O 240690a_100000758358_100000210174 [1,1,0,0,0,0|2,0,0]=4 622 B14R1.833 O=C(CO)NCc1ccc(c(c1)F)O 527a_100000758358_100000210174 [1,1,0,0,0,0|2,0,0]=4 623 B14R1.833 O=C(CO)NCc1ccc(c(c1)O)Cl 240690a_100020636435_100000210174 [1,1,0,0,0,0|2,0,0]=4 624 B14R1.833 O=C(CO)NCc1ccc(c(c1)O)Cl 527a_100020636435_100000210174 [1,1,0,0,0,0|2,0,0]=4 625 B14R1.833 O=C(CO)NCc1ccc(c(c1)O)F 240690a_100160469508_100000210174 [1,1,0,0,0,0|2,0,0]=4 626 B14R1.833 O=C(CO)NCc1ccc(c(c1)O)F 527a_100160469508_100000210174 [1,1,0,0,0,0|2,0,0]=4 627 B14R1.833 O=C(CO)NCc1ccc(c(c1)O)O 240690a_100000010075_100000210174 [1,1,0,0,0,0|1,0,0]=3 628 B14R1.3653 COc1ccc(cc1Br)CCC(=O)C 1458a_100000736731_200000210301 [1,1,0,0,0,0|2,0,0]=4 629 B14R1.3653 COc1ccc(cc1Br)CCC(=O)[13CH3] 1458a_100000736731_200025704644 [1,1,0,0,0,0|2,0,0]=4 630 B14R1.3653 COc1ccc(cc1C)CCC(=O)C 1458a_100011616661_200000210301 [1,1,0,0,0,0|2,0,0]=4 631 B14R1.3653 COc1ccc(cc1C)CCC(=O)[13CH3] 1458a_100011616661_200025704644 [1,1,0,0,0,0|2,0,0]=4 632 B14R1.3653 COc1ccc(cc1Cl)CCC(=O)C 1458a_100000735577_200000210301 [1,1,0,0,0,0|2,0,0]=4 633 B14R1.3653 COc1ccc(cc1Cl)CCC(=O)[13CH3] 1458a_100000735577_200025704644 [1,1,0,0,0,0|2,0,0]=4 634 B14R1.3653 COc1ccc(cc1F)CCC(=O)C 1458a_100000234888_200000210301 [1,1,0,0,0,0|2,0,0]=4 635 B14R1.3653 COc1ccc(cc1F)CCC(=O)[13CH3] 1458a_100000234888_200025704644 [1,1,0,0,0,0|2,0,0]=4 636 B14R1.3653 COc1ccc(cc1O)CCC(=O)C 1458a_100000746301_200000210301 [1,1,0,0,0,0|1,0,0]=3 637 B14R1.3653 COc1ccc(cc1O)CCC(=O)[13CH3] 1458a_100000746301_200025704644 [1,1,0,0,0,0|1,0,0]=3 638 B14R1.3653 COc1ccc(cc1O)CNC(=O)C 240690a_100000740000_100015343762 [1,1,0,0,0,0|2,0,0]=4 639 B14R1.3653 COc1ccc(cc1O)CNC(=O)C 527a_100000740000_100103153847 [1,1,0,0,0,0|2,0,0]=4 640 B14R1.3653 COc1ccc(cc1O)NCC(=O)N 34a_100000211920_100000187820 [1,1,0,0,0,0|2,0,0]=4 641 B14R1.3653 COc1ccc(cc1O)NCC(=O)[O-] 34a_100000211920_100020667443 [1,1,0,0,0,0|1,0,1]=4 642 B14R1.3653 COc1ccc(cc1O)SCC(=O)N 62a_100000747473_100009816560 [1,1,0,0,0,0|2,0,0]=4 643 B14R1.3653 COc1ccc(cc1O)SCC(=O)[O-] 62a_100020667443_100009816560 [1,1,0,0,0,0|1,0,1]=4 644 B14R1.3653 NC(=O)CSc1ccc(c(c1)O)CO 62a_100000071718_100000747473 [1,1,0,0,0,0|2,0,0]=4 645 B14R1.3653 NC(=O)CSc1ccc(c(c1)O)CO 62a_100000747473_100000071718 [1,1,0,0,0,0|2,0,0]=4 646 B14R1.3653 O=C([O-])CSc1ccc(c(c1)O)CO 62a_100000071718_100020667443 [1,1,0,0,0,0|1,0,1]=4 647 B14R1.3653 O=C([O-])CSc1ccc(c(c1)O)CO 62a_100020667443_100000071718 [1,1,0,0,0,0|1,0,1]=4 648 B14R1.15552 CC(=O)CCc1cc(c(c(c1)Br)O)Br 1458a_100009814134_200000210301 [1,1,0,0,0,0|2,0,0]=4 649 B14R1.15552 CC(=O)CCc1cc(c(c(c1)I)O)I 1458a_200000072802_200000210301 [1,1,0,0,0,0|2,0,0]=4 650 B14R1.15552 NC(=O)CSc1cc(c(c(c1)F)O)O 62a_100000747473_100010114375 [1,1,0,0,0,0|2,0,0]=4 651 B14R1.15552 NC(=O)CSc1cc(c(c(c1)O)O)O 62a_100000747473_100010658518 [1,1,0,0,0,0|2,0,0]=4 652 B14R1.15552 O=C([O-])CSc1cc(c(c(c1)F)O)O 62a_100020667443_100010114375 [1,1,0,0,0,0|1,0,1]=4 653 B14R1.15552 O=C([O-])CSc1cc(c(c(c1)O)O)O 62a_100020667443_100010658518 [1,1,0,0,0,0|1,0,1]=4 654 B14R1.15552 [13CH3]C(=O)CCc1cc(c(c(c1)Br)O)Br 1458a_100009814134_200025704644 [1,1,0,0,0,0|2,0,0]=4 655 B14R1.15552 [13CH3]C(=O)CCc1cc(c(c(c1)I)O)I 1458a_200000072802_200025704644 [1,1,0,0,0,0|2,0,0]=4 656 B14R1.4398 O=CC(C=O)Nc1ccc(c(c1)O)O 34a_100102946323_100000736813 [1,1,0,0,0,0|2,0,0]=4 657 B14R1.4398 O=CC(C=O)Sc1ccc(c(c1)O)O 62a_100000736813_100009813601 [1,1,0,0,0,0|2,0,0]=4 658 B14R1.41 COc1cc(ccc1O)C(O)C(=O)C 1458a_100000036414_200000210301 [0,1,0,0,1,0|2,0,0]=4 659 B14R1.41 COc1cc(ccc1O)C(O)C(=O)[13CH3] 1458a_100000036414_200025704644 [0,1,0,0,1,0|2,0,0]=4 660 B14R1.1032 CNC(C(=O)O)c1ccc(c(c1)C)F 269956a_200011615215_200000210301 [0,1,0,0,1,0|2,0,0]=4 661 B14R1.1032 CNC(C(=O)O)c1ccc(c(c1)Cl)Cl 269956a_100000761552_200000210301 [0,1,0,0,1,0|2,0,0]=4 662 B14R1.1032 CNC(C(=O)O)c1ccc(c(c1)Cl)F 269956a_100011934136_200000210301 [0,1,0,0,1,0|2,0,0]=4 663 B14R1.1032 CNC(C(=O)O)c1ccc(c(c1)F)Cl 269956a_100000695227_200000210301 [0,1,0,0,1,0|2,0,0]=4 664 B14R1.1032 Cc1cc(ccc1F)C(N[13CH3])C(=O)O 269956a_200011615215_200025704644 [0,1,0,0,1,0|2,0,0]=4 665 B14R1.1032 [13CH3]NC(C(=O)O)c1ccc(c(c1)Cl)Cl 269956a_100000761552_200025704644 [0,1,0,0,1,0|2,0,0]=4 666 B14R1.1032 [13CH3]NC(C(=O)O)c1ccc(c(c1)Cl)F 269956a_100011934136_200025704644 [0,1,0,0,1,0|2,0,0]=4 667 B14R1.1032 [13CH3]NC(C(=O)O)c1ccc(c(c1)F)Cl 269956a_100000695227_200025704644 [0,1,0,0,1,0|2,0,0]=4 668 B16R1.776 CN[C@@H](CC(=O)O)Cc1ccc(c(c1)F)F 269956a_100000017298_200000210301 [0,1,0,0,0,1|2,0,0]=4 669 B16R1.776 [13CH3]N[C@@H](CC(=O)O)Cc1ccc(c(c1)F)F 269956a_100000017298_200025704644 [0,1,0,0,0,1|2,0,0]=4 670 B16R1.17229 COC(=O)CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000747449 [0,1,0,0,0,1|1,0,1]=4 671 B16R1.17229 COC(=O)CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100009817358 [0,1,0,0,0,1|2,0,0]=4 672 B16R1.17229 COC(=O)CC(C)Sc1ccc(c(c1)O)O 62a_100009817358_100009813601 [0,1,0,0,0,1|2,0,0]=4 673 B16R1.2640 C=C(CNc1ccc(c(c1)O)O)C(=O)OC 34a_100102946323_100009813391 [0,1,0,0,0,1|1,0,1]=4 674 B16R1.2640 C=C(CSc1ccc(c(c1)O)O)C(=O)OC 62a_100009813391_100009813601 [0,1,0,0,0,1|1,0,1]=4 675 B16R1.2640 CNC(=O)C(C)NCc1ccc(c(c1)O)O 34a_100000010075_100000731044 [0,1,0,0,0,1|2,0,0]=4 676 B16R1.2640 CNC(=O)C(F)NCc1ccc(c(c1)O)O 34a_100000010075_100009813575 [0,1,0,0,0,1|2,0,0]=4 677 B16R1.2640 COC(=O)C(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100011610305 [0,1,0,0,0,1|1,0,1]=4 678 B16R1.2640 COC(=O)C(=O)CSc1ccc(c(c1)O)O 62a_100011610305_100009813601 [0,1,0,0,0,1|1,0,1]=4 679 B16R1.2640 COC(=O)C(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100000024059 [0,1,0,0,0,1|1,0,1]=4 680 B16R1.2640 COC(=O)C(C)CNc1ccc(c(c1)Br)O 34a_100011534360_100000698445 [0,1,0,0,0,1|2,0,0]=4 681 B16R1.2640 COC(=O)C(C)CNc1ccc(c(c1)C)O 34a_100011218179_100000698445 [0,1,0,0,0,1|2,0,0]=4 682 B16R1.2640 COC(=O)C(C)CNc1ccc(c(c1)Cl)O 34a_100000744943_100000698445 [0,1,0,0,0,1|2,0,0]=4 683 B16R1.2640 COC(=O)C(C)CNc1ccc(c(c1)F)O 34a_100011220035_100000698445 [0,1,0,0,0,1|2,0,0]=4 684 B16R1.2640 COC(=O)C(C)CNc1ccc(c(c1)O)C 34a_100000759471_100000698445 [0,1,0,0,0,1|2,0,0]=4 685 B16R1.2640 COC(=O)C(C)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000698445 [0,1,0,0,0,1|2,0,0]=4 686 B16R1.2640 COC(=O)C(C)CNc1ccc(c(c1)O)F 34a_100012017398_100000698445 [0,1,0,0,0,1|2,0,0]=4 687 B16R1.2640 COC(=O)C(C)CNc1ccc(c(c1)O)O 34a_100102946323_100000698445 [0,1,0,0,0,1|1,0,0]=3 688 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)Br)O 62a_100000698445_100012361655 [0,1,0,0,0,1|2,0,0]=4 689 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)Br)O 62a_100012361655_100000698445 [0,1,0,0,0,1|2,0,0]=4 690 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)C)O 62a_100000698445_100000186361 [0,1,0,0,0,1|2,0,0]=4 691 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)Cl)O 62a_100000698445_100012360047 [0,1,0,0,0,1|2,0,0]=4 692 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000698445 [0,1,0,0,0,1|2,0,0]=4 693 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)F)O 62a_100000185481_100000698445 [0,1,0,0,0,1|2,0,0]=4 694 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)F)O 62a_100000698445_100000185481 [0,1,0,0,0,1|2,0,0]=4 695 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)N)O 62a_100000698445_100000752626 [0,1,0,0,0,1|2,0,0]=4 696 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)N)O 62a_100000752626_100000698445 [0,1,0,0,0,1|2,0,0]=4 697 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)O)Br 62a_100000698445_100012356990 [0,1,0,0,0,1|2,0,0]=4 698 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)O)Br 62a_100012356990_100000698445 [0,1,0,0,0,1|2,0,0]=4 699 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)O)C 62a_100000685420_100000698445 [0,1,0,0,0,1|2,0,0]=4 700 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)O)C 62a_100000698445_100000685420 [0,1,0,0,0,1|2,0,0]=4 701 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)O)Cl 62a_100000698445_100011356854 [0,1,0,0,0,1|2,0,0]=4 702 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000698445 [0,1,0,0,0,1|2,0,0]=4 703 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)O)F 62a_100000686035_100000698445 [0,1,0,0,0,1|2,0,0]=4 704 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)O)F 62a_100000698445_100000686035 [0,1,0,0,0,1|2,0,0]=4 705 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)O)N 62a_100000698445_100000739049 [0,1,0,0,0,1|2,0,0]=4 706 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)O)N 62a_100000739049_100000698445 [0,1,0,0,0,1|2,0,0]=4 707 B16R1.2640 COC(=O)C(C)CSc1ccc(c(c1)O)O 62a_100000698445_100009813601 [0,1,0,0,0,1|1,0,0]=3 708 B16R1.2640 COC(=O)C(C)NCc1ccc(c(c1)F)O 34a_100000758358_100000211248 [0,1,0,0,0,1|2,0,0]=4 709 B16R1.2640 COC(=O)C(C)NCc1ccc(c(c1)O)Cl 34a_100020636435_100000211248 [0,1,0,0,0,1|2,0,0]=4 710 B16R1.2640 COC(=O)C(C)NCc1ccc(c(c1)O)F 34a_100160469508_100000211248 [0,1,0,0,0,1|2,0,0]=4 711 B16R1.2640 COC(=O)C(C)NCc1ccc(c(c1)O)O 34a_100000010075_100000211248 [0,1,0,0,0,1|1,0,0]=3 712 B16R1.4287 COc1ccc(cc1Br)CN[C@@H](C)C(=O)O 269956a_100000743915_200011397701 [0,1,0,0,0,1|2,0,0]=4 713 B16R1.4287 COc1ccc(cc1C)CN[C@@H](C)C(=O)O 269956a_100000743915_200011290836 [0,1,0,0,0,1|2,0,0]=4 714 B16R1.4287 COc1ccc(cc1Cl)CN[C@@H](C)C(=O)O 269956a_100000743915_100000693707 [0,1,0,0,0,1|2,0,0]=4 715 B16R1.4287 COc1ccc(cc1F)CN[C@@H](C)C(=O)O 269956a_100000743915_100000189595 [0,1,0,0,0,1|2,0,0]=4 716 B16R1.4287 COc1ccc(cc1O)CNC(C)C(=O)N 34a_100000740000_100000702099 [0,1,0,0,0,1|2,0,0]=4 717 B16R1.4287 COc1ccc(cc1O)CNC(F)C(=O)N 34a_100000740000_100009813875 [0,1,0,0,0,1|2,0,0]=4 718 B16R1.4287 COc1ccc(cc1O)CNC(F)C(=O)[O-] 34a_100000740000_100020610796 [0,1,0,0,0,1|1,0,1]=4 719 B16R1.4710 COc1cc(ccc1Br)CN[C@@H](C)C(=O)O 269956a_100000743915_100010110085 [0,1,0,0,0,1|2,0,0]=4 720 B16R1.4710 COc1cc(ccc1Cl)CN[C@@H](C)C(=O)O 269956a_100000743915_200010214485 [0,1,0,0,0,1|2,0,0]=4 721 B16R1.4710 COc1cc(ccc1F)CN[C@@H](C)C(=O)O 269956a_100000743915_100012349856 [0,1,0,0,0,1|2,0,0]=4 722 B16R1.4710 COc1cc(ccc1O)CNC(C)C(=O)N 34a_100000185554_100000702099 [0,1,0,0,0,1|2,0,0]=4 723 B16R1.4710 COc1cc(ccc1O)CNC(F)C(=O)N 34a_100000185554_100009813875 [0,1,0,0,0,1|2,0,0]=4 724 B16R1.4710 COc1cc(ccc1O)CNC(F)C(=O)[O-] 34a_100000185554_100020610796 [0,1,0,0,0,1|1,0,1]=4 725 B16R1.4710 C[C@H](NCc1ccc(c(c1)C=O)O)C(=O)O 269956a_100000743915_100000008128 [0,1,0,0,0,1|1,0,1]=4 726 B16R1.6630 CCC(NCc1ccc(c(c1)O)O)C(=O)N 34a_100000010075_100000750255 [0,1,0,0,0,1|2,0,0]=4 727 B16R1.16606 CC(C)(CNc1ccc(c(c1)O)O)C(=O)N 34a_100102946323_200009895572 [0,1,0,0,0,1|2,0,0]=4 728 B16R1.16606 CC(C)(CSc1ccc(c(c1)O)O)C(=O)N 62a_200009895572_100009813601 [0,1,0,0,0,1|2,0,0]=4 729 B16R1.16606 CC(C)(NCc1ccc(c(c1)O)O)C(=O)N 34a_100000010075_100000702505 [0,1,0,0,0,1|2,0,0]=4 730 B16R1.16606 O=C([O-])C(F)(F)NCc1ccc(c(c1)O)O 34a_100000010075_100020612412 [0,1,0,0,0,1|1,0,1]=4 731 B16R1.1617 CCNC(Cc1ccc(c(c1)Cl)F)C(=O)O 269956a_103549770568_100000210202 [0,2,0,0,0,0|2,0,0]=4 732 B16R1.1617 CCN[C@@H](Cc1ccc(c(c1)Cl)Cl)C(=O)O 269956a_100011737835_100000210202 [0,2,0,0,0,0|2,0,0]=4 733 B16R1.1617 CCN[C@@H](Cc1ccc(c(c1)F)F)C(=O)O 269956a_100011737850_100000210202 [0,2,0,0,0,0|2,0,0]=4 734 B16R1.1617 CNCC(Cc1ccc(c(c1)Cl)Cl)C(=O)O 269956a_100010005911_200000210301 [0,2,0,0,0,0|2,0,0]=4 735 B16R1.1617 O=C(O)C(Cc1ccc(c(c1)Cl)F)NCF 269956a_103549770568_100015361967 [0,2,0,0,0,0|2,0,0]=4 736 B16R1.1617 O=C(O)[C@H](Cc1ccc(c(c1)Cl)Cl)NCF 269956a_100011737835_100015361967 [0,2,0,0,0,0|2,0,0]=4 737 B16R1.1617 O=C(O)[C@H](Cc1ccc(c(c1)F)F)NCF 269956a_100011737850_100015361967 [0,2,0,0,0,0|2,0,0]=4 738 B16R1.1617 [13CH3]NCC(Cc1ccc(c(c1)Cl)Cl)C(=O)O 269956a_100010005911_200025704644 [0,2,0,0,0,0|2,0,0]=4 739 B16R1.2962 CNC(Cc1cc(c(c(c1)F)F)F)C(=O)O 269956a_100011217459_200000210301 [0,2,0,0,0,0|2,0,0]=4 740 B16R1.2962 CN[C@@H](Cc1cc(c(c(c1)Cl)O)Cl)C(=O)O 269956a_200016989187_200000210301 [0,2,0,0,0,0|1,0,0]=3 741 B16R1.2962 [13CH3]NC(Cc1cc(c(c(c1)F)F)F)C(=O)O 269956a_100011217459_200025704644 [0,2,0,0,0,0|2,0,0]=4 742 B16R1.2962 [13CH3]N[C@@H](Cc1cc(c(c(c1)Cl)O)Cl)C(=O)O 269956a_200016989187_200025704644 [0,2,0,0,0,0|1,0,0]=3 743 B16R1.3336 CCC(Nc1ccc(c(c1)O)O)C(=O)OC 34a_100102946323_100000235869 [0,2,0,0,0,0|2,0,0]=4 744 B16R1.3336 CCC(Sc1ccc(c(c1)O)O)C(=O)OC 62a_100000235869_100009813601 [0,2,0,0,0,0|2,0,0]=4 745 B16R1.3336 COC(=O)C(C=O)Nc1ccc(c(c1)O)O 34a_100102946323_100000046368 [0,2,0,0,0,0|2,0,0]=4 746 B16R1.3336 COC(=O)C(C=O)Sc1ccc(c(c1)O)O 62a_100000046368_100009813601 [0,2,0,0,0,0|2,0,0]=4 747 B16R1.3336 COC(=O)C(CO)Nc1ccc(c(c1)O)O 34a_100102946323_100012276630 [0,2,0,0,0,0|2,0,0]=4 748 B16R1.3336 COC(=O)C(CO)Sc1ccc(c(c1)O)O 62a_100012276630_100009813601 [0,2,0,0,0,0|2,0,0]=4 749 B16R1.3336 COC(=O)C(Nc1ccc(c(c1)O)O)OC 34a_100102946323_100000101307 [0,2,0,0,0,0|2,0,0]=4 750 B16R1.3336 COC(=O)C(OC)Sc1ccc(c(c1)O)O 62a_100000101307_100009813601 [0,2,0,0,0,0|2,0,0]=4 751 B16R1.67833 CN[C@@H](Cc1cc(c(cc1F)F)F)C(=O)O 269956a_200012351374_200000210301 [0,2,0,0,0,0|2,0,0]=4 752 B16R1.67833 [13CH3]N[C@@H](Cc1cc(c(cc1F)F)F)C(=O)O 269956a_200012351374_200025704644 [0,2,0,0,0,0|2,0,0]=4 753 B16R1.67834 CNC(Cc1ccc(c(c1F)F)F)C(=O)O 269956a_100010140333_200000210301 [0,2,0,0,0,0|2,0,0]=4 754 B16R1.67834 [13CH3]NC(Cc1ccc(c(c1F)F)F)C(=O)O 269956a_100010140333_200025704644 [0,2,0,0,0,0|2,0,0]=4 755 B16R1.5433 COC(=O)C(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000211248 [0,2,0,0,0,0|1,0,1]=4 756 B16R1.4294 COC(=O)C(C)Nc1ccc(c(c1)O)OC 34a_100000211920_100000211248 [0,2,0,0,0,0|2,0,0]=4 757 B16R1.4294 COC(=O)C(C)Sc1ccc(c(c1)O)CO 62a_100000071718_100000211248 [0,2,0,0,0,0|2,0,0]=4 758 B16R1.4294 COC(=O)C(C)Sc1ccc(c(c1)O)CO 62a_100000211248_100000071718 [0,2,0,0,0,0|2,0,0]=4 759 B16R1.4294 COC(=O)C(C)Sc1ccc(c(c1)O)OC 62a_100000211248_100009816560 [0,2,0,0,0,0|2,0,0]=4 760 B16R1.4294 COc1ccc(cc1O)CN(C)C(=O)CO 240690a_100000188468_100000210174 [0,2,0,0,0,0|2,0,0]=4 761 B16R1.4294 COc1ccc(cc1O)CN(C)C(=O)CO 527a_100000188468_100000210174 [0,2,0,0,0,0|2,0,0]=4 762 B16R1.4730 COC(=O)C(C)Nc1ccc(c(c1)OC)O 34a_100000726020_100000211248 [0,2,0,0,0,0|2,0,0]=4 763 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)CO)O 62a_100000184703_100000211248 [0,2,0,0,0,0|2,0,0]=4 764 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)CO)O 62a_100000211248_100000184703 [0,2,0,0,0,0|2,0,0]=4 765 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)OC)O 62a_100000211248_100000694246 [0,2,0,0,0,0|2,0,0]=4 766 B16R1.1627 COC(=O)C(C)Sc1cc(c(c(c1)F)O)O 62a_100000211248_100010114375 [0,2,0,0,0,0|2,0,0]=4 767 B16R1.1627 COC(=O)C(C)Sc1cc(c(c(c1)O)O)O 62a_100000211248_100010658518 [0,2,0,0,0,0|2,0,0]=4 768 B16R1.4970 C#CCC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_100000184674 [0,2,0,0,0,0|2,0,0]=4 769 B16R1.4970 C=CCC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_100000210623 [0,2,0,0,0,0|2,0,0]=4 770 B16R1.4970 CCCC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_100000210303 [0,2,0,0,0,0|2,0,0]=4 771 B16R1.4970 CCOC(=O)C(C)Nc1ccc(c(c1)O)O 34a_100102946323_100011216346 [0,2,0,0,0,0|2,0,0]=4 772 B16R1.4970 CCOC(=O)C(C)Sc1ccc(c(c1)O)O 62a_100011216346_100009813601 [0,2,0,0,0,0|2,0,0]=4 773 B16R1.4970 CCOC(=O)C(F)Nc1ccc(c(c1)O)O 34a_100102946323_100000760018 [0,2,0,0,0,0|2,0,0]=4 774 B16R1.4970 CCOC(=O)C(F)Sc1ccc(c(c1)O)O 62a_100000760018_100009813601 [0,2,0,0,0,0|2,0,0]=4 775 B16R1.4970 CN(Cc1ccc(c(c1)O)O)C(=O)CCO 240690a_100020587154_100011216618 [0,2,0,0,0,0|2,0,0]=4 776 B16R1.4970 COCC(=O)N(C)Cc1ccc(c(c1)O)O 240690a_100020587154_100000210968 [0,2,0,0,0,0|2,0,0]=4 777 B16R1.4970 N#CCC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_100011214920 [0,2,0,0,0,0|2,0,0]=4 778 B16R1.4970 O=C(CCF)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_100011217306 [0,2,0,0,0,0|2,0,0]=4 779 B16R1.4970 O=C(CCO)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_100000211926 [0,2,0,0,0,0|1,0,0]=3 780 B16R1.76178 COC(=O)C(C)(C)Sc1ccc(c(c1)O)O 62a_100000689032_100009813601 [0,2,0,0,0,0|2,0,0]=4 781 B16R1.76178 COC(=O)C(C)(F)Nc1ccc(c(c1)O)O 34a_100102946323_200009867631 [0,2,0,0,0,0|2,0,0]=4 782 B16R1.76178 COC(=O)C(C)(F)Sc1ccc(c(c1)O)O 62a_200009867631_100009813601 [0,2,0,0,0,0|2,0,0]=4 783 B16R1.76178 COC(=O)C(F)(F)Nc1ccc(c(c1)O)O 34a_100102946323_100000211177 [0,2,0,0,0,0|2,0,0]=4 784 B16R1.76178 COC(=O)C(F)(F)Sc1ccc(c(c1)O)O 62a_100000211177_100009813601 [0,2,0,0,0,0|2,0,0]=4 785 B16R2.11380 O=C1OCC(O1)Nc2ccc(c(c2)O)O 34a_100102946323_100000032252 [0,0,0,1,0,1|2,0,0]=4 786 B16R2.1089 O=C1CCC1NCc2ccc(c(c2)O)O 34a_100000010075_100009892977 [0,0,0,1,0,1|2,0,0]=4 787 B16R2.4011 O=C1OCCC1Nc2ccc(c(c2)O)O 34a_100102946323_100000211211 [0,1,0,1,0,0|2,0,0]=4 788 B16R2.4011 O=C1OCCC1Sc2ccc(c(c2)O)O 62a_100000211211_100009813601 [0,1,0,1,0,0|2,0,0]=4 789 B16R2.6257 CC(=O)C(C)Cc1ccc2c(c1)OCO2 1458a_100000062412_200000210301 [0,1,0,1,0,0|2,0,0]=4 790 B16R2.6257 CC(Cc1ccc2c(c1)OCO2)C(=O)[13CH3] 1458a_100000062412_200025704644 [0,1,0,1,0,0|2,0,0]=4 791 B12R1.20 CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_200000210301 [1,0,0,0,1,0|2,0,0]=4 792 B12R1.20 CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200000210301 [1,0,0,0,1,0|2,0,0]=4 793 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)O 1458a_100000031422_200025704644 [1,0,0,0,1,0|2,0,0]=4 794 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200025704644 [1,0,0,0,1,0|2,0,0]=4 795 B14R1.679 CC(NCc1ccc(cc1)O)C(=O)N 34a_100000185549_100000702099 [1,0,0,0,0,1|2,0,0]=4 796 B14R1.679 C[C@H](NCc1ccc(cc1)Br)C(=O)O 269956a_100000743915_100011217064 [1,0,0,0,0,1|2,0,0]=4 797 B14R1.679 C[C@H](NCc1ccc(cc1)Cl)C(=O)O 269956a_100000743915_100000187161 [1,0,0,0,0,1|2,0,0]=4 798 B14R1.679 C[C@H](NCc1ccc(cc1)F)C(=O)O 269956a_100000743915_100000198546 [1,0,0,0,0,1|2,0,0]=4 799 B14R1.679 C[C@H](NCc1ccc(cc1)I)C(=O)O 269956a_100000743915_100000189116 [1,0,0,0,0,1|2,0,0]=4 800 B14R1.679 Cc1ccc(cc1)CN[C@@H](C)C(=O)O 269956a_100000743915_100000210814 [1,0,0,0,0,1|2,0,0]=4 801 B14R1.679 NC(=O)C(F)NCc1ccc(cc1)O 34a_100000185549_100009813875 [1,0,0,0,0,1|2,0,0]=4 802 B14R1.679 O=C([O-])C(F)NCc1ccc(cc1)O 34a_100000185549_100020610796 [1,0,0,0,0,1|1,0,1]=4 803 B14R1.698 CC(=O)NC(C)Cc1ccc(cc1)O 240690a_100102634573_100015343762 [1,0,0,0,0,1|2,0,0]=4 804 B14R1.698 CC(=O)NC(C)Cc1ccc(cc1)O 527a_100102634573_100103153847 [1,0,0,0,0,1|2,0,0]=4 805 B14R1.5956 CC(=O)C(C)NCc1cccc(c1)O 2230a_100000743036_100009814033 [1,0,0,0,0,1|2,0,0]=4 806 B14R1.5956 CC(=O)C(C)OCc1cccc(c1)O 34a_100000212229_100011660834 [1,0,0,0,0,1|2,0,0]=4 807 B14R1.5956 CC(=O)C(C)SCc1cccc(c1)O 62a_100009814033_100011660834 [1,0,0,0,0,1|2,0,0]=4 808 B14R1.5956 CC(=O)C(C)SCc1cccc(c1)O 62a_100011660834_100009814033 [1,0,0,0,0,1|2,0,0]=4 809 B14R1.5956 CC(NCc1cccc(c1)O)C(=O)N 2230a_100000743036_100000702099 [1,0,0,0,0,1|2,0,0]=4 810 B14R1.5956 CC(NCc1cccc(c1)O)C(=O)N 34a_100000743036_100000702099 [1,0,0,0,0,1|2,0,0]=4 811 B14R1.5956 CC(SCc1cccc(c1)O)C(=O)N 62a_100000702099_100011660834 [1,0,0,0,0,1|2,0,0]=4 812 B14R1.5956 CC(SCc1cccc(c1)O)C(=O)N 62a_100011660834_100000702099 [1,0,0,0,0,1|2,0,0]=4 813 B14R1.5956 C[C@@H](NCc1cccc(c1)O)C(=O)N 2230a_100000119354_100011660834 [1,0,0,0,0,1|2,0,0]=4 814 B14R1.5956 C[C@@H](NCc1cccc(c1)O)C(=O)N 270004a_100000119354_100000188321 [1,0,0,0,0,1|2,0,0]=4 815 B14R1.5956 C[C@@H](NCc1cccc(c1)O)C(=O)N 34a_100000119354_100011660834 [1,0,0,0,0,1|2,0,0]=4 816 B14R1.5956 C[C@@H](OCc1cccc(c1)O)C(=O)N 34a_100000731257_100011660834 [1,0,0,0,0,1|2,0,0]=4 817 B14R1.5956 C[C@@H](OCc1cccc(c1)O)C(=O)N 7a_100000731257_100000084143 [1,0,0,0,0,1|2,0,0]=4 818 B14R1.5956 C[C@H](NCc1cccc(c1)Br)C(=O)O 269956a_100000743915_100000211773 [1,0,0,0,0,1|2,0,0]=4 819 B14R1.5956 C[C@H](NCc1cccc(c1)Cl)C(=O)O 269956a_100000743915_100000187163 [1,0,0,0,0,1|2,0,0]=4 820 B14R1.5956 C[C@H](NCc1cccc(c1)F)C(=O)O 269956a_100000743915_100000230114 [1,0,0,0,0,1|2,0,0]=4 821 B14R1.5956 C[C@H](NCc1cccc(c1)I)C(=O)O 269956a_100000743915_100011218688 [1,0,0,0,0,1|2,0,0]=4 822 B14R1.5956 C[C@H](NCc1cccc(c1)O)C(=O)O 269956a_100000743915_100011660834 [1,0,0,0,0,1|1,0,0]=3 823 B14R1.5956 C[C@H](OCc1cccc(c1)O)C(=O)[O-] 7a_217856618621_100000084143 [1,0,0,0,0,1|1,0,1]=4 824 B14R1.5956 Cc1cccc(c1)CN[C@@H](C)C(=O)O 269956a_100000743915_100000005736 [1,0,0,0,0,1|2,0,0]=4 825 B14R1.5956 NC(=O)C(F)NCc1cccc(c1)O 2230a_100000743036_100009813875 [1,0,0,0,0,1|2,0,0]=4 826 B14R1.5956 NC(=O)C(F)NCc1cccc(c1)O 34a_100000743036_100009813875 [1,0,0,0,0,1|2,0,0]=4 827 B14R1.5956 NC(=O)C(F)SCc1cccc(c1)O 62a_100009813875_100011660834 [1,0,0,0,0,1|2,0,0]=4 828 B14R1.5956 NC(=O)C(F)SCc1cccc(c1)O 62a_100011660834_100009813875 [1,0,0,0,0,1|2,0,0]=4 829 B14R1.5956 O=C([O-])C(F)NCc1cccc(c1)O 34a_100000743036_100020610796 [1,0,0,0,0,1|1,0,1]=4 830 B14R1.5956 O=C([O-])C(F)SCc1cccc(c1)O 62a_100011660834_100020610796 [1,0,0,0,0,1|1,0,1]=4 831 B14R1.5956 O=C([O-])C(F)SCc1cccc(c1)O 62a_100020610796_100011660834 [1,0,0,0,0,1|1,0,1]=4 832 B14R1.5978 CN(CC(=O)O)Cc1cccc(c1)O 269956a_100000746989_100011660834 [1,0,0,0,0,1|2,0,0]=4 833 B14R1.687 C=C(C)CCNc1ccc(c(c1)O)O 34a_100102946323_100000730704 [1,0,0,0,0,1|2,0,0]=4 834 B14R1.687 C=C(C)CCSc1ccc(c(c1)O)O 62a_100000730704_100009813601 [1,0,0,0,0,1|2,0,0]=4 835 B14R1.687 C=C(C)CNCc1ccc(c(c1)O)O 34a_100000010075_100000748629 [1,0,0,0,0,1|2,0,0]=4 836 B14R1.687 C=C(F)CNCc1ccc(c(c1)O)O 34a_100000010075_100009893438 [1,0,0,0,0,1|2,0,0]=4 837 B14R1.687 CC(=O)CCNc1ccc(c(c1)C)O 7a_100011218179_100000053229 [1,0,0,0,0,1|2,0,0]=4 838 B14R1.687 CC(=O)CCNc1ccc(c(c1)F)O 7a_100011220035_100000053229 [1,0,0,0,0,1|2,0,0]=4 839 B14R1.687 CC(=O)CCNc1ccc(c(c1)O)C 7a_100000759471_100000053229 [1,0,0,0,0,1|2,0,0]=4 840 B14R1.687 CC(=O)CCNc1ccc(c(c1)O)F 7a_100012017398_100000053229 [1,0,0,0,0,1|2,0,0]=4 841 B14R1.687 CC(=O)CCSc1ccc(c(c1)Br)O 62a_100000053229_100012361655 [1,0,0,0,0,1|2,0,0]=4 842 B14R1.687 CC(=O)CCSc1ccc(c(c1)Br)O 62a_100012361655_100000053229 [1,0,0,0,0,1|2,0,0]=4 843 B14R1.687 CC(=O)CCSc1ccc(c(c1)C)O 62a_100000053229_100000186361 [1,0,0,0,0,1|2,0,0]=4 844 B14R1.687 CC(=O)CCSc1ccc(c(c1)Cl)O 62a_100000053229_100012360047 [1,0,0,0,0,1|2,0,0]=4 845 B14R1.687 CC(=O)CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000053229 [1,0,0,0,0,1|2,0,0]=4 846 B14R1.687 CC(=O)CCSc1ccc(c(c1)F)O 62a_100000053229_100000185481 [1,0,0,0,0,1|2,0,0]=4 847 B14R1.687 CC(=O)CCSc1ccc(c(c1)F)O 62a_100000185481_100000053229 [1,0,0,0,0,1|2,0,0]=4 848 B14R1.687 CC(=O)CCSc1ccc(c(c1)N)O 62a_100000053229_100000752626 [1,0,0,0,0,1|2,0,0]=4 849 B14R1.687 CC(=O)CCSc1ccc(c(c1)N)O 62a_100000752626_100000053229 [1,0,0,0,0,1|2,0,0]=4 850 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)Br 62a_100000053229_100012356990 [1,0,0,0,0,1|2,0,0]=4 851 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)Br 62a_100012356990_100000053229 [1,0,0,0,0,1|2,0,0]=4 852 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)C 62a_100000053229_100000685420 [1,0,0,0,0,1|2,0,0]=4 853 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)C 62a_100000685420_100000053229 [1,0,0,0,0,1|2,0,0]=4 854 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)Cl 62a_100000053229_100011356854 [1,0,0,0,0,1|2,0,0]=4 855 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000053229 [1,0,0,0,0,1|2,0,0]=4 856 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)F 62a_100000053229_100000686035 [1,0,0,0,0,1|2,0,0]=4 857 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)F 62a_100000686035_100000053229 [1,0,0,0,0,1|2,0,0]=4 858 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)N 62a_100000053229_100000739049 [1,0,0,0,0,1|2,0,0]=4 859 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)N 62a_100000739049_100000053229 [1,0,0,0,0,1|2,0,0]=4 860 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)O 62a_100000053229_100009813601 [1,0,0,0,0,1|1,0,0]=3 861 B14R1.687 CC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100015343762 [1,0,0,0,0,1|1,0,0]=3 862 B14R1.687 CC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100103153847 [1,0,0,0,0,1|1,0,0]=3 863 B14R1.687 CC(=O)OCNc1ccc(c(c1)O)O 34a_100102946323_100009813279 [1,0,0,0,0,1|2,0,0]=4 864 B14R1.687 CC(=O)OCSc1ccc(c(c1)O)O 62a_100000076356_100009813601 [1,0,0,0,0,1|2,0,0]=4 865 B14R1.687 CC(O)CCNc1ccc(c(c1)O)O 34a_100102946323_100012276601 [1,0,0,0,0,1|1,0,1]=4 866 B14R1.687 CC(O)CCSc1ccc(c(c1)O)O 62a_100012276601_100009813601 [1,0,0,0,0,1|1,0,1]=4 867 B14R1.687 CC(O)CNCc1ccc(c(c1)O)O 34a_100000010075_100011218427 [1,0,0,0,0,1|1,0,1]=4 868 B14R1.687 C[C@@H](O)CNCc1ccc(c(c1)O)O 34a_100000010075_100009817552 [1,0,0,0,0,1|1,0,1]=4 869 B14R1.687 Cc1cc(ccc1Br)CNCC(=O)O 269956a_100016091260_100000727479 [1,0,0,0,0,1|2,0,0]=4 870 B14R1.687 Cc1cc(ccc1Cl)CNCC(=O)O 269956a_100016091260_100012184735 [1,0,0,0,0,1|2,0,0]=4 871 B14R1.687 Cc1cc(ccc1F)CNCC(=O)O 269956a_100016091260_100011216667 [1,0,0,0,0,1|2,0,0]=4 872 B14R1.687 Cc1cc(ccc1O)NCCC(=O)N 34a_100011218179_100000731001 [1,0,0,0,0,1|2,0,0]=4 873 B14R1.687 Cc1cc(ccc1O)NCCC(=O)N 7a_100011218179_100000744528 [1,0,0,0,0,1|2,0,0]=4 874 B14R1.687 Cc1cc(ccc1O)SCCC(=O)N 62a_100000744528_100000186361 [1,0,0,0,0,1|2,0,0]=4 875 B14R1.687 Cc1ccc(cc1Br)CNCC(=O)O 269956a_100016091260_100012232412 [1,0,0,0,0,1|2,0,0]=4 876 B14R1.687 Cc1ccc(cc1C)CNCC(=O)O 269956a_100016091260_100000742320 [1,0,0,0,0,1|2,0,0]=4 877 B14R1.687 Cc1ccc(cc1Cl)CNCC(=O)O 269956a_100016091260_100011823929 [1,0,0,0,0,1|2,0,0]=4 878 B14R1.687 Cc1ccc(cc1F)CNCC(=O)O 269956a_100016091260_100011217369 [1,0,0,0,0,1|2,0,0]=4 879 B14R1.687 Cc1ccc(cc1I)CNCC(=O)O 269956a_100016091260_100010206137 [1,0,0,0,0,1|2,0,0]=4 880 B14R1.687 Cc1ccc(cc1O)NCCC(=O)N 34a_100000759471_100000731001 [1,0,0,0,0,1|2,0,0]=4 881 B14R1.687 Cc1ccc(cc1O)NCCC(=O)N 7a_100000759471_100000744528 [1,0,0,0,0,1|2,0,0]=4 882 B14R1.687 Cc1ccc(cc1O)SCCC(=O)N 62a_100000685420_100000744528 [1,0,0,0,0,1|2,0,0]=4 883 B14R1.687 Cc1ccc(cc1O)SCCC(=O)N 62a_100000744528_100000685420 [1,0,0,0,0,1|2,0,0]=4 884 B14R1.687 NC(=O)CCNc1ccc(c(c1)Br)O 34a_100011534360_100000731001 [1,0,0,0,0,1|2,0,0]=4 885 B14R1.687 NC(=O)CCNc1ccc(c(c1)Cl)O 34a_100000744943_100000731001 [1,0,0,0,0,1|2,0,0]=4 886 B14R1.687 NC(=O)CCNc1ccc(c(c1)F)O 34a_100011220035_100000731001 [1,0,0,0,0,1|2,0,0]=4 887 B14R1.687 NC(=O)CCNc1ccc(c(c1)F)O 7a_100011220035_100000744528 [1,0,0,0,0,1|2,0,0]=4 888 B14R1.687 NC(=O)CCNc1ccc(c(c1)O)Cl 34a_100011934209_100000731001 [1,0,0,0,0,1|2,0,0]=4 889 B14R1.687 NC(=O)CCNc1ccc(c(c1)O)F 34a_100012017398_100000731001 [1,0,0,0,0,1|2,0,0]=4 890 B14R1.687 NC(=O)CCNc1ccc(c(c1)O)F 7a_100012017398_100000744528 [1,0,0,0,0,1|2,0,0]=4 891 B14R1.687 NC(=O)CCNc1ccc(c(c1)O)O 34a_100102946323_100000731001 [1,0,0,0,0,1|1,0,0]=3 892 B14R1.687 NC(=O)CCSc1ccc(c(c1)Br)O 62a_100000744528_100012361655 [1,0,0,0,0,1|2,0,0]=4 893 B14R1.687 NC(=O)CCSc1ccc(c(c1)Br)O 62a_100012361655_100000744528 [1,0,0,0,0,1|2,0,0]=4 894 B14R1.687 NC(=O)CCSc1ccc(c(c1)Cl)O 62a_100000744528_100012360047 [1,0,0,0,0,1|2,0,0]=4 895 B14R1.687 NC(=O)CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000744528 [1,0,0,0,0,1|2,0,0]=4 896 B14R1.687 NC(=O)CCSc1ccc(c(c1)F)O 62a_100000185481_100000744528 [1,0,0,0,0,1|2,0,0]=4 897 B14R1.687 NC(=O)CCSc1ccc(c(c1)F)O 62a_100000744528_100000185481 [1,0,0,0,0,1|2,0,0]=4 898 B14R1.687 NC(=O)CCSc1ccc(c(c1)N)O 62a_100000744528_100000752626 [1,0,0,0,0,1|2,0,0]=4 899 B14R1.687 NC(=O)CCSc1ccc(c(c1)N)O 62a_100000752626_100000744528 [1,0,0,0,0,1|2,0,0]=4 900 B14R1.687 NC(=O)CCSc1ccc(c(c1)O)Br 62a_100000744528_100012356990 [1,0,0,0,0,1|2,0,0]=4 901 B14R1.687 NC(=O)CCSc1ccc(c(c1)O)Br 62a_100012356990_100000744528 [1,0,0,0,0,1|2,0,0]=4 902 B14R1.687 NC(=O)CCSc1ccc(c(c1)O)Cl 62a_100000744528_100011356854 [1,0,0,0,0,1|2,0,0]=4 903 B14R1.687 NC(=O)CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000744528 [1,0,0,0,0,1|2,0,0]=4 904 B14R1.687 NC(=O)CCSc1ccc(c(c1)O)F 62a_100000686035_100000744528 [1,0,0,0,0,1|2,0,0]=4 905 B14R1.687 NC(=O)CCSc1ccc(c(c1)O)F 62a_100000744528_100000686035 [1,0,0,0,0,1|2,0,0]=4 906 B14R1.687 NC(=O)CCSc1ccc(c(c1)O)N 62a_100000739049_100000744528 [1,0,0,0,0,1|2,0,0]=4 907 B14R1.687 NC(=O)CCSc1ccc(c(c1)O)N 62a_100000744528_100000739049 [1,0,0,0,0,1|2,0,0]=4 908 B14R1.687 NC(=O)CCSc1ccc(c(c1)O)O 62a_100000744528_100009813601 [1,0,0,0,0,1|1,0,0]=3 909 B14R1.687 NC(=O)CNCc1ccc(c(c1)F)O 34a_100000758358_100000187820 [1,0,0,0,0,1|2,0,0]=4 910 B14R1.687 NC(=O)CNCc1ccc(c(c1)O)Cl 34a_100020636435_100000187820 [1,0,0,0,0,1|2,0,0]=4 911 B14R1.687 NC(=O)CNCc1ccc(c(c1)O)F 34a_100160469508_100000187820 [1,0,0,0,0,1|2,0,0]=4 912 B14R1.687 NC(=O)CNCc1ccc(c(c1)O)O 34a_100000010075_100000187820 [1,0,0,0,0,1|1,0,0]=3 913 B14R1.687 O=C(O)CNCc1cc(=O)c(co1)O 269956a_100016091260_100000010605 [1,0,0,0,0,1|1,0,1]=4 914 B14R1.687 O=C(O)CNCc1ccc(c(c1)Br)Br 269956a_100016091260_100012353900 [1,0,0,0,0,1|2,0,0]=4 915 B14R1.687 O=C(O)CNCc1ccc(c(c1)Br)Cl 269956a_100016091260_100012353894 [1,0,0,0,0,1|2,0,0]=4 916 B14R1.687 O=C(O)CNCc1ccc(c(c1)Br)F 269956a_100016091260_100000743011 [1,0,0,0,0,1|2,0,0]=4 917 B14R1.687 O=C(O)CNCc1ccc(c(c1)Cl)Br 269956a_100016091260_100012353895 [1,0,0,0,0,1|2,0,0]=4 918 B14R1.687 O=C(O)CNCc1ccc(c(c1)Cl)Cl 269956a_100016091260_100000188800 [1,0,0,0,0,1|2,0,0]=4 919 B14R1.687 O=C(O)CNCc1ccc(c(c1)Cl)F 269956a_100016091260_100000717365 [1,0,0,0,0,1|2,0,0]=4 920 B14R1.687 O=C(O)CNCc1ccc(c(c1)Cl)I 269956a_100016091260_100012349665 [1,0,0,0,0,1|2,0,0]=4 921 B14R1.687 O=C(O)CNCc1ccc(c(c1)F)Br 269956a_100016091260_100000767054 [1,0,0,0,0,1|2,0,0]=4 922 B14R1.687 O=C(O)CNCc1ccc(c(c1)F)Cl 269956a_100016091260_100000716492 [1,0,0,0,0,1|2,0,0]=4 923 B14R1.687 O=C(O)CNCc1ccc(c(c1)F)F 269956a_100016091260_100000757363 [1,0,0,0,0,1|2,0,0]=4 924 B14R1.687 O=C(O)CNCc1ccc(c(c1)F)I 269956a_100016091260_100010149604 [1,0,0,0,0,1|2,0,0]=4 925 B14R1.687 O=C(O)CNCc1ccc(c(c1)I)Br 269956a_100016091260_100010146616 [1,0,0,0,0,1|2,0,0]=4 926 B14R1.687 O=C(O)CNCc1ccc(c(c1)I)F 269956a_100016091260_100010188208 [1,0,0,0,0,1|2,0,0]=4 927 B14R1.687 O=C([O-])CNCc1ccc(c(c1)F)O 34a_100000758358_100020667443 [1,0,0,0,0,1|1,0,1]=4 928 B14R1.687 O=C([O-])CNCc1ccc(c(c1)O)Cl 34a_100020636435_100020667443 [1,0,0,0,0,1|1,0,1]=4 929 B14R1.687 O=C([O-])CNCc1ccc(c(c1)O)F 34a_100160469508_100020667443 [1,0,0,0,0,1|1,0,1]=4 930 B14R1.687 O=C([O-])CNCc1ccc(c(c1)O)O 34a_100000010075_100020667443 [1,0,0,0,0,1|0,0,1]=3 931 B14R1.687 O=[N+]([O-])CNCc1ccc(c(c1)O)O 34a_100000010075_100000761209 [1,0,0,0,0,1|1,0,1]=4 932 B16R1.16534 CN(CCc1ccc(c(c1)O)O)CC(=O)O 269956a_100000746989_200010393615 [0,0,0,0,0,2|2,0,0]=4 933 B16R1.1037 CC(=O)C(C)SCCc1ccc(c(c1)O)O 62a_100009814033_200010393615 [0,0,0,0,0,2|2,0,0]=4 934 B16R1.1037 CC(NCCc1ccc(c(c1)O)O)C(=O)N 34a_100000210387_100000702099 [0,0,0,0,0,2|2,0,0]=4 935 B16R1.1037 CC(SCCc1ccc(c(c1)O)O)C(=O)N 62a_100000702099_200010393615 [0,0,0,0,0,2|2,0,0]=4 936 B16R1.1037 C[C@@H](OCCc1ccc(c(c1)O)O)C(=O)N 7a_100000731257_200010393615 [0,0,0,0,0,2|2,0,0]=4 937 B16R1.1037 C[C@H](NCCc1ccc(c(c1)O)O)C(=O)O 269956a_100000743915_200010393615 [0,0,0,0,0,2|1,0,0]=3 938 B16R1.1037 C[C@H](OCCc1ccc(c(c1)O)O)C(=O)[O-] 7a_217856618621_200010393615 [0,0,0,0,0,2|1,0,1]=4 939 B16R1.1037 NC(=O)C(F)NCCc1ccc(c(c1)O)O 34a_100000210387_100009813875 [0,0,0,0,0,2|2,0,0]=4 940 B16R1.1037 NC(=O)C(F)SCCc1ccc(c(c1)O)O 62a_100009813875_200010393615 [0,0,0,0,0,2|2,0,0]=4 941 B16R1.1037 O=C([O-])C(F)NCCc1ccc(c(c1)O)O 34a_100000210387_100020610796 [0,0,0,0,0,2|1,0,1]=4 942 B16R1.1037 O=C([O-])C(F)SCCc1ccc(c(c1)O)O 62a_100020610796_200010393615 [0,0,0,0,0,2|1,0,1]=4