0 B13R1.510 CC(=C(C)c1ccc(c(c1)O)O)C 271570a_200000049429_100009813601 [0,0,0,0,0,0|2,0,2]=4 1 B13R1.510 CC(=O)C(O)c1ccc(c(c1)F)F 1458a_100011217530_200000210301 [0,0,0,0,0,0|3,0,1]=4 2 B13R1.510 CC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200000210301 [0,0,0,0,0,0|1,0,1]=2 3 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210206 [0,0,0,0,0,0|2,0,2]=4 4 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210206 [0,0,0,0,0,0|2,0,2]=4 5 B13R1.510 CC(C)C(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210206 [0,0,0,0,0,0|2,0,2]=4 6 B13R1.510 CC(C)C(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210206 [0,0,0,0,0,0|2,0,2]=4 7 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210206 [0,0,0,0,0,0|2,0,2]=4 8 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210206 [0,0,0,0,0,0|2,0,2]=4 9 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210206 [0,0,0,0,0,0|2,0,2]=4 10 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210206 [0,0,0,0,0,0|2,0,2]=4 11 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210206 [0,0,0,0,0,0|1,0,2]=3 12 B13R1.510 Cc1cc(ccc1O)C(=O)C(C)C 1458a_100000685612_100000210206 [0,0,0,0,0,0|2,0,2]=4 13 B13R1.510 Cc1ccc(cc1O)C(=O)C(C)C 1458a_100000233767_100000210206 [0,0,0,0,0,0|2,0,2]=4 14 B13R1.510 [13CH3]C(=O)C(O)c1ccc(c(c1)F)F 1458a_100011217530_200025704644 [0,0,0,0,0,0|3,0,1]=4 15 B13R1.510 [13CH3]C(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200025704644 [0,0,0,0,0,0|1,0,1]=2 16 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C 271570a_100102525489_100009813601 [1,0,0,0,0,0|1,0,2]=4 17 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200000210301 [1,0,0,0,0,0|2,0,1]=4 18 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [1,0,0,0,0,0|2,0,1]=4 19 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200000210301 [1,0,0,0,0,0|2,0,1]=4 20 B12R1.19 CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200000210301 [1,0,0,0,0,0|2,0,1]=4 21 B12R1.19 CC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_200000210301 [1,0,0,0,0,0|2,0,1]=4 22 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [1,0,0,0,0,0|1,0,1]=3 23 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [1,0,0,0,0,0|1,0,1]=3 24 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000070787 [1,0,0,0,0,0|2,0,1]=4 25 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100103153847 [1,0,0,0,0,0|2,0,1]=4 26 B12R1.19 CC(C)Nc1ccc(c(c1)Br)O 34a_100011534360_100000210206 [1,0,0,0,0,0|3,0,0]=4 27 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)O 34a_100000744943_100000210206 [1,0,0,0,0,0|3,0,0]=4 28 B12R1.19 CC(C)Nc1ccc(c(c1)F)O 34a_100011220035_100000210206 [1,0,0,0,0,0|3,0,0]=4 29 B12R1.19 CC(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000210206 [1,0,0,0,0,0|3,0,0]=4 30 B12R1.19 CC(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100000210206 [1,0,0,0,0,0|3,0,0]=4 31 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 34a_100012017398_100000210206 [1,0,0,0,0,0|3,0,0]=4 32 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000210206 [1,0,0,0,0,0|3,0,0]=4 33 B12R1.19 CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000210206 [1,0,0,0,0,0|2,0,0]=3 34 B12R1.19 CC(C)Oc1ccc(c(c1)F)O 271570a_203496583355_200012236954 [1,0,0,0,0,0|3,0,0]=4 35 B12R1.19 CC(C)Sc1ccc(c(c1)Br)O 62a_100000210206_100012361655 [1,0,0,0,0,0|3,0,0]=4 36 B12R1.19 CC(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100000210206 [1,0,0,0,0,0|3,0,0]=4 37 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)O 62a_100000210206_100012360047 [1,0,0,0,0,0|3,0,0]=4 38 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100000210206 [1,0,0,0,0,0|3,0,0]=4 39 B12R1.19 CC(C)Sc1ccc(c(c1)F)O 62a_100000185481_100000210206 [1,0,0,0,0,0|3,0,0]=4 40 B12R1.19 CC(C)Sc1ccc(c(c1)F)O 62a_100000210206_100000185481 [1,0,0,0,0,0|3,0,0]=4 41 B12R1.19 CC(C)Sc1ccc(c(c1)N)O 62a_100000210206_100000752626 [1,0,0,0,0,0|3,0,0]=4 42 B12R1.19 CC(C)Sc1ccc(c(c1)N)O 62a_100000752626_100000210206 [1,0,0,0,0,0|3,0,0]=4 43 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100000210206_100012356990 [1,0,0,0,0,0|3,0,0]=4 44 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100000210206 [1,0,0,0,0,0|3,0,0]=4 45 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100000210206_100011356854 [1,0,0,0,0,0|3,0,0]=4 46 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100000210206 [1,0,0,0,0,0|3,0,0]=4 47 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000210206_100000686035 [1,0,0,0,0,0|3,0,0]=4 48 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000686035_100000210206 [1,0,0,0,0,0|3,0,0]=4 49 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000210206_100000739049 [1,0,0,0,0,0|3,0,0]=4 50 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000739049_100000210206 [1,0,0,0,0,0|3,0,0]=4 51 B12R1.19 CC(C)Sc1ccc(c(c1)O)O 62a_100000210206_100009813601 [1,0,0,0,0,0|2,0,0]=3 52 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [1,0,0,0,0,0|2,0,1]=4 53 B12R1.19 Cc1cc(ccc1O)NC(C)C 34a_100011218179_100000210206 [1,0,0,0,0,0|3,0,0]=4 54 B12R1.19 Cc1cc(ccc1O)NC(C)C 7a_100011218179_100000210206 [1,0,0,0,0,0|3,0,0]=4 55 B12R1.19 Cc1cc(ccc1O)SC(C)C 62a_100000210206_100000186361 [1,0,0,0,0,0|3,0,0]=4 56 B12R1.19 Cc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000082272_200025704644 [1,0,0,0,0,0|2,0,1]=4 57 B12R1.19 Cc1ccc(cc1O)NC(C)C 34a_100000759471_100000210206 [1,0,0,0,0,0|3,0,0]=4 58 B12R1.19 Cc1ccc(cc1O)NC(C)C 7a_100000759471_100000210206 [1,0,0,0,0,0|3,0,0]=4 59 B12R1.19 Cc1ccc(cc1O)OC(C)C 271570a_203496583355_200010081138 [1,0,0,0,0,0|3,0,0]=4 60 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000210206_100000685420 [1,0,0,0,0,0|3,0,0]=4 61 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000685420_100000210206 [1,0,0,0,0,0|3,0,0]=4 62 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200025704644 [1,0,0,0,0,0|2,0,1]=4 63 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200025704644 [1,0,0,0,0,0|2,0,1]=4 64 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200025704644 [1,0,0,0,0,0|2,0,1]=4 65 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [1,0,0,0,0,0|1,0,1]=3 66 B12R1.20 CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_200000210301 [1,0,0,0,0,0|2,0,1]=4 67 B12R1.20 CC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200000210301 [1,0,0,0,0,0|2,0,1]=4 68 B12R1.20 CC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200000210301 [1,0,0,0,0,0|2,0,1]=4 69 B12R1.20 CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200000210301 [1,0,0,0,0,0|1,0,1]=3 70 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_200000210301 [1,0,0,0,0,0|2,0,1]=4 71 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200000210301 [1,0,0,0,0,0|2,0,1]=4 72 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)O 1458a_100000031422_200025704644 [1,0,0,0,0,0|2,0,1]=4 73 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 1458a_100000212099_100000210206 [1,0,0,0,0,0|1,0,2]=4 74 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100011220430 [1,0,0,0,0,0|1,0,2]=4 75 B12R1.20 CC(C)N(C)c1ccc(cc1)O 269982a_100000182112_100000210206 [1,0,0,0,0,0|3,0,0]=4 76 B12R1.20 CC(C)N(C)c1ccc(cc1)O 34a_100000182112_100000210206 [1,0,0,0,0,0|3,0,0]=4 77 B12R1.20 CC(C)S(=O)c1ccc(cc1)O 271570a_203496583355_100010749287 [1,0,0,0,0,0|2,0,1]=4 78 B12R1.20 CC(C)[C@H](N)c1ccc(cc1)O 271570a_203496583355_100102422763 [1,0,0,0,0,0|2,0,0]=3 79 B12R1.20 Cc1ccc(cc1)[C@@H](O)C(=O)[13CH3] 1458a_100009815954_200025704644 [1,0,0,0,0,0|2,0,1]=4 80 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200025704644 [1,0,0,0,0,0|2,0,1]=4 81 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200025704644 [1,0,0,0,0,0|2,0,1]=4 82 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200025704644 [1,0,0,0,0,0|1,0,1]=3 83 B12R1.20 [13CH3]C(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200025704644 [1,0,0,0,0,0|2,0,1]=4 84 B12R1.225 CC(=O)C(O)c1cccc(c1)C 1458a_100011434945_200000210301 [1,0,0,0,0,0|2,0,1]=4 85 B12R1.225 CC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200000210301 [1,0,0,0,0,0|2,0,1]=4 86 B12R1.225 CC(=O)C(O)c1cccc(c1)F 1458a_100011434943_200000210301 [1,0,0,0,0,0|2,0,1]=4 87 B12R1.225 CC(C)C(=O)c1cccc(c1)O 1458a_100000183914_100000210206 [1,0,0,0,0,0|1,0,2]=4 88 B12R1.225 CC(C)C(=O)c1cccc(c1)O 271570a_203496583355_100011350656 [1,0,0,0,0,0|1,0,2]=4 89 B12R1.225 CC(C)N(C)c1cccc(c1)O 2230a_100000756613_100000210206 [1,0,0,0,0,0|3,0,0]=4 90 B12R1.225 CC(C)N(C)c1cccc(c1)O 269982a_100000756613_100000210206 [1,0,0,0,0,0|3,0,0]=4 91 B12R1.225 CC(C)N(C)c1cccc(c1)O 34a_100000756613_100000210206 [1,0,0,0,0,0|3,0,0]=4 92 B12R1.225 Cc1cccc(c1)C(O)C(=O)[13CH3] 1458a_100011434945_200025704644 [1,0,0,0,0,0|2,0,1]=4 93 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200025704644 [1,0,0,0,0,0|2,0,1]=4 94 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)F 1458a_100011434943_200025704644 [1,0,0,0,0,0|2,0,1]=4 95 B12R1.367 CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210202 [1,0,0,0,0,0|1,0,2]=4 96 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210202 [1,0,0,0,0,0|1,0,2]=4 97 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012349626 [1,0,0,0,0,0|1,0,2]=4 98 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210202 [1,0,0,0,0,0|1,0,2]=4 99 B12R1.367 CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210202 [1,0,0,0,0,0|1,0,2]=4 100 B12R1.367 CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210202 [1,0,0,0,0,0|1,0,2]=4 101 B12R1.367 CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210202 [1,0,0,0,0,0|1,0,2]=4 102 B12R1.367 CCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210202 [1,0,0,0,0,0|1,0,2]=4 103 B12R1.367 CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210202 [1,0,0,0,0,0|1,0,2]=4 104 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210202 [1,0,0,0,0,0|1,0,2]=4 105 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011216493 [1,0,0,0,0,0|1,0,2]=4 106 B12R1.367 CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210202 [1,0,0,0,0,0|1,0,2]=4 107 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [1,0,0,0,0,0|0,0,2]=3 108 B12R1.367 CNC(C)c1ccc(c(c1)Br)O 269862a_106832991636_100011772453 [1,0,0,0,0,0|3,0,0]=4 109 B12R1.367 CNC(C)c1ccc(c(c1)C)O 269862a_106832991636_100000188726 [1,0,0,0,0,0|3,0,0]=4 110 B12R1.367 CNC(C)c1ccc(c(c1)Cl)O 269862a_106832991636_100000188625 [1,0,0,0,0,0|3,0,0]=4 111 B12R1.367 CNC(C)c1ccc(c(c1)F)O 269862a_106832991636_100000751691 [1,0,0,0,0,0|3,0,0]=4 112 B12R1.367 CNC(C)c1ccc(c(c1)O)C 269862a_106832991636_100000084092 [1,0,0,0,0,0|3,0,0]=4 113 B12R1.367 CNC(C)c1ccc(c(c1)O)F 269862a_106832991636_100000117923 [1,0,0,0,0,0|3,0,0]=4 114 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100000216328 [1,0,0,0,0,0|1,0,2]=4 115 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012350776 [1,0,0,0,0,0|1,0,2]=4 116 B12R1.367 NCC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100016989600 [1,0,0,0,0,0|1,0,2]=4 117 B12R1.367 O=C(CF)c1ccc(c(c1)O)O 1458a_100000212155_100015361967 [1,0,0,0,0,0|1,0,2]=4 118 B14R1.41 COc1cc(ccc1O)C(=O)C(C)C 1458a_100000687070_100000210206 [0,1,0,0,0,0|1,0,2]=4 119 B14R1.41 COc1cc(ccc1O)C(O)C(=O)C 1458a_100000036414_200000210301 [0,1,0,0,0,0|1,0,1]=3 120 B14R1.41 COc1cc(ccc1O)C(O)C(=O)[13CH3] 1458a_100000036414_200025704644 [0,1,0,0,0,0|1,0,1]=3 121 B14R1.704 Oc1cc(ccc1F)C(O)C(F)(F)F 271570a_203496583355_200011517459 [0,1,0,0,0,0|3,0,0]=4 122 B14R1.1003 C#CC(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000035995 [0,1,0,0,0,0|1,0,2]=4 123 B14R1.1003 CC(C#N)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000703298 [0,1,0,0,0,0|0,0,3]=4 124 B14R1.1003 CCC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100000210202 [0,1,0,0,0,0|1,0,1]=3 125 B14R1.1003 CCC(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000758301 [0,1,0,0,0,0|1,0,2]=4 126 B14R1.1003 CNC(=O)C(O)c1ccc(c(c1)O)O 240690a_100102657272_200000032065 [0,1,0,0,0,0|1,0,1]=3 127 B14R1.1003 O=C(CF)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100015361967 [0,1,0,0,0,0|1,0,1]=3 128 B14R1.3652 COc1ccc(cc1O)C(=O)C(C)C 1458a_100000766810_100000210206 [0,1,0,0,0,0|1,0,2]=4 129 B14R1.6058 CC(C)C(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_100000210206 [0,1,0,0,0,0|1,0,2]=4 130 B14R1.6058 CC(C)C(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000210206 [0,1,0,0,0,0|1,0,2]=4 131 B14R1.15551 CC(C)C(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000210206 [0,1,0,0,0,0|1,0,2]=4 132 B14R1.15551 CC(C)C(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000210206 [0,1,0,0,0,0|1,0,2]=4 133 B14R1.15551 CC(C)C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210206 [0,1,0,0,0,0|1,0,2]=4 134 B14R2.954 C=C(c1ccc(c(c1)O)O)C2CC2 271570a_100010895485_100009813601 [0,0,0,1,0,0|2,0,1]=4 135 B14R1.685 CC(C)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210624 [0,0,0,0,0,1|1,0,2]=4 136 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)Br)O 271570a_100015190218_100012361655 [0,0,0,0,0,1|3,0,0]=4 137 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)Cl)O 271570a_100015190218_100012360047 [0,0,0,0,0,1|3,0,0]=4 138 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)F)O 271570a_100015190218_100000185481 [0,0,0,0,0,1|3,0,0]=4 139 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)N)O 271570a_100015190218_100000752626 [0,0,0,0,0,1|3,0,0]=4 140 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)Br 271570a_100015190218_100012356990 [0,0,0,0,0,1|3,0,0]=4 141 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)Cl 271570a_100015190218_100011356854 [0,0,0,0,0,1|3,0,0]=4 142 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)F 271570a_100015190218_100000686035 [0,0,0,0,0,1|3,0,0]=4 143 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)N 271570a_100015190218_100000739049 [0,0,0,0,0,1|3,0,0]=4 144 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)O 271570a_100015190218_100009813601 [0,0,0,0,0,1|2,0,0]=3 145 B14R1.685 CC(O)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100011218427 [0,0,0,0,0,1|1,0,2]=4 146 B14R1.685 Cc1cc(ccc1O)[C@@H](N)CC(C)C 271570a_100015190218_100000186361 [0,0,0,0,0,1|3,0,0]=4 147 B14R1.685 Cc1ccc(cc1O)[C@@H](N)CC(C)C 271570a_100015190218_100000766334 [0,0,0,0,0,1|3,0,0]=4 148 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)O 62a_100009814033_100009813601 [0,0,0,0,0,1|2,0,1]=4 149 B14R1.686 CC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200000210301 [0,0,0,0,0,1|1,0,1]=3 150 B14R1.686 CC(C)C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210206 [0,0,0,0,0,1|1,0,2]=4 151 B14R1.686 CC(C)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000210198 [0,0,0,0,0,1|1,0,2]=4 152 B14R1.686 CC(C)C(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000210198 [0,0,0,0,0,1|1,0,2]=4 153 B14R1.686 CC(F)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000062450 [0,0,0,0,0,1|1,0,2]=4 154 B14R1.686 CC(F)C(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000062450 [0,0,0,0,0,1|1,0,2]=4 155 B14R1.686 CC(Nc1ccc(c(c1)O)O)C(=O)N 34a_100102946323_100000702099 [0,0,0,0,0,1|2,0,1]=4 156 B14R1.686 CC(Sc1ccc(c(c1)O)O)C(=O)N 62a_100000702099_100009813601 [0,0,0,0,0,1|2,0,1]=4 157 B14R1.686 C[C@@H](O)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000717761 [0,0,0,0,0,1|1,0,2]=4 158 B14R1.686 C[C@H](O)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_217856618621 [0,0,0,0,0,1|1,0,2]=4 159 B14R1.686 NC(=O)C(F)Nc1ccc(c(c1)O)O 34a_100102946323_100009813875 [0,0,0,0,0,1|2,0,1]=4 160 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)O)O 62a_100009813875_100009813601 [0,0,0,0,0,1|2,0,1]=4 161 B14R1.686 [13CH3]C(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200025704644 [0,0,0,0,0,1|1,0,1]=3 162 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [2,0,0,0,0,0|1,0,1]=4 163 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [2,0,0,0,0,0|1,0,1]=4 164 B11R1.20 CC(C)Cc1ccc(cc1)O 271570a_203496583355_100011221366 [2,0,0,0,0,0|1,0,0]=3 165 B11R1.20 CC(C)Nc1ccc(cc1)O 271570a_203496583355_100000219625 [2,0,0,0,0,0|2,0,0]=4 166 B11R1.20 CC(C)Nc1ccc(cc1)O 34a_100000185829_100000210206 [2,0,0,0,0,0|2,0,0]=4 167 B11R1.20 CC(C)Oc1ccc(cc1)O 271570a_203496583355_100000169947 [2,0,0,0,0,0|2,0,0]=4 168 B11R1.20 CC(C)Sc1ccc(cc1)O 271570a_203496583355_100009811894 [2,0,0,0,0,0|2,0,0]=4 169 B11R1.20 CC(C)Sc1ccc(cc1)O 62a_100000210206_100000185759 [2,0,0,0,0,0|2,0,0]=4 170 B11R1.20 CN(C)Cc1ccc(cc1)O 2230a_100000207500_200000210301 [2,0,0,0,0,0|2,0,0]=4 171 B11R1.20 CN(C)Cc1ccc(cc1)O 269982a_100000207500_200000210301 [2,0,0,0,0,0|2,0,0]=4 172 B11R1.20 CN(C)Cc1ccc(cc1)O 271570a_203496583355_100000174694 [2,0,0,0,0,0|2,0,0]=4 173 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 2230a_100000207500_200025704644 [2,0,0,0,0,0|2,0,0]=4 174 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 269982a_100000207500_200025704644 [2,0,0,0,0,0|2,0,0]=4 175 B11R1.20 NC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000162331 [2,0,0,0,0,0|1,0,1]=4 176 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [2,0,0,0,0,0|1,0,1]=4 177 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000070787_100011660834 [2,0,0,0,0,0|1,0,1]=4 178 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000745134_200000210301 [2,0,0,0,0,0|1,0,1]=4 179 B11R1.157 CC(=O)Cc1cccc(c1)O 271570a_203496583355_100000689217 [2,0,0,0,0,0|1,0,1]=4 180 B11R1.157 CC(C)Cc1cccc(c1)O 271570a_203496583355_100010883412 [2,0,0,0,0,0|1,0,0]=3 181 B11R1.157 CC(C)Nc1cccc(c1)O 271570a_203496583355_100000219649 [2,0,0,0,0,0|2,0,0]=4 182 B11R1.157 CC(C)Nc1cccc(c1)O 34a_100000210217_100000210206 [2,0,0,0,0,0|2,0,0]=4 183 B11R1.157 CC(C)Oc1cccc(c1)O 271570a_203496583355_100000170003 [2,0,0,0,0,0|2,0,0]=4 184 B11R1.157 CC(C)Sc1cccc(c1)O 271570a_203496583355_100009815759 [2,0,0,0,0,0|2,0,0]=4 185 B11R1.157 CC(C)Sc1cccc(c1)O 62a_100000210206_100000211634 [2,0,0,0,0,0|2,0,0]=4 186 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100000207540_200000210301 [2,0,0,0,0,0|2,0,0]=4 187 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100102631434_100011660834 [2,0,0,0,0,0|2,0,0]=4 188 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100000207540_200000210301 [2,0,0,0,0,0|2,0,0]=4 189 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100102631434_100000084143 [2,0,0,0,0,0|2,0,0]=4 190 B11R1.157 CN(C)Cc1cccc(c1)O 270004a_100102631434_100000188321 [2,0,0,0,0,0|2,0,0]=4 191 B11R1.157 CN(C)Cc1cccc(c1)O 271570a_203496583355_100000174759 [2,0,0,0,0,0|2,0,0]=4 192 B11R1.157 CN([13CH3])Cc1cccc(c1)O 2230a_100000207540_200025704644 [2,0,0,0,0,0|2,0,0]=4 193 B11R1.157 CN([13CH3])Cc1cccc(c1)O 269982a_100000207540_200025704644 [2,0,0,0,0,0|2,0,0]=4 194 B11R1.157 NC(=O)Cc1cccc(c1)O 271570a_203496583355_100011586816 [2,0,0,0,0,0|1,0,1]=4 195 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)O 1458a_100000745134_200025704644 [2,0,0,0,0,0|1,0,1]=4 196 B11R1.192 CC=Cc1ccc(c(c1)O)O 271570a_100016259895_100009813601 [2,0,0,0,0,0|0,0,2]=4 197 B11R1.192 CCCc1ccc(c(c1)F)O 271570a_203496583355_200010686677 [2,0,0,0,0,0|1,0,0]=3 198 B11R1.192 CCNc1ccc(c(c1)Br)O 34a_100011534360_100000210202 [2,0,0,0,0,0|2,0,0]=4 199 B11R1.192 CCNc1ccc(c(c1)C)O 271570a_203496583355_100015183089 [2,0,0,0,0,0|2,0,0]=4 200 B11R1.192 CCNc1ccc(c(c1)C)O 34a_100011218179_100000210202 [2,0,0,0,0,0|2,0,0]=4 201 B11R1.192 CCNc1ccc(c(c1)C)O 7a_100011218179_100000210202 [2,0,0,0,0,0|2,0,0]=4 202 B11R1.192 CCNc1ccc(c(c1)Cl)O 34a_100000744943_100000210202 [2,0,0,0,0,0|2,0,0]=4 203 B11R1.192 CCNc1ccc(c(c1)F)O 34a_100011220035_100000210202 [2,0,0,0,0,0|2,0,0]=4 204 B11R1.192 CCNc1ccc(c(c1)F)O 7a_100011220035_100000210202 [2,0,0,0,0,0|2,0,0]=4 205 B11R1.192 CCNc1ccc(c(c1)O)C 34a_100000759471_100000210202 [2,0,0,0,0,0|2,0,0]=4 206 B11R1.192 CCNc1ccc(c(c1)O)C 7a_100000759471_100000210202 [2,0,0,0,0,0|2,0,0]=4 207 B11R1.192 CCNc1ccc(c(c1)O)Cl 34a_100011934209_100000210202 [2,0,0,0,0,0|2,0,0]=4 208 B11R1.192 CCNc1ccc(c(c1)O)F 34a_100012017398_100000210202 [2,0,0,0,0,0|2,0,0]=4 209 B11R1.192 CCNc1ccc(c(c1)O)F 7a_100012017398_100000210202 [2,0,0,0,0,0|2,0,0]=4 210 B11R1.192 CCNc1ccc(c(c1)O)O 34a_100102946323_100000210202 [2,0,0,0,0,0|1,0,0]=3 211 B11R1.192 CCOc1ccc(c(c1)C)O 271570a_203496583355_100012344538 [2,0,0,0,0,0|2,0,0]=4 212 B11R1.192 CCOc1ccc(c(c1)F)O 271570a_203496583355_100000692347 [2,0,0,0,0,0|2,0,0]=4 213 B11R1.192 CCOc1ccc(c(c1)O)C 271570a_203496583355_100011099959 [2,0,0,0,0,0|2,0,0]=4 214 B11R1.192 CCSc1ccc(c(c1)Br)O 62a_100000210202_100012361655 [2,0,0,0,0,0|2,0,0]=4 215 B11R1.192 CCSc1ccc(c(c1)Br)O 62a_100012361655_100000210202 [2,0,0,0,0,0|2,0,0]=4 216 B11R1.192 CCSc1ccc(c(c1)C)O 62a_100000210202_100000186361 [2,0,0,0,0,0|2,0,0]=4 217 B11R1.192 CCSc1ccc(c(c1)Cl)O 62a_100000210202_100012360047 [2,0,0,0,0,0|2,0,0]=4 218 B11R1.192 CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210202 [2,0,0,0,0,0|2,0,0]=4 219 B11R1.192 CCSc1ccc(c(c1)F)O 62a_100000185481_100000210202 [2,0,0,0,0,0|2,0,0]=4 220 B11R1.192 CCSc1ccc(c(c1)F)O 62a_100000210202_100000185481 [2,0,0,0,0,0|2,0,0]=4 221 B11R1.192 CCSc1ccc(c(c1)N)O 62a_100000210202_100000752626 [2,0,0,0,0,0|2,0,0]=4 222 B11R1.192 CCSc1ccc(c(c1)N)O 62a_100000752626_100000210202 [2,0,0,0,0,0|2,0,0]=4 223 B11R1.192 CCSc1ccc(c(c1)O)Br 62a_100000210202_100012356990 [2,0,0,0,0,0|2,0,0]=4 224 B11R1.192 CCSc1ccc(c(c1)O)Br 62a_100012356990_100000210202 [2,0,0,0,0,0|2,0,0]=4 225 B11R1.192 CCSc1ccc(c(c1)O)C 62a_100000210202_100000685420 [2,0,0,0,0,0|2,0,0]=4 226 B11R1.192 CCSc1ccc(c(c1)O)C 62a_100000685420_100000210202 [2,0,0,0,0,0|2,0,0]=4 227 B11R1.192 CCSc1ccc(c(c1)O)Cl 62a_100000210202_100011356854 [2,0,0,0,0,0|2,0,0]=4 228 B11R1.192 CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210202 [2,0,0,0,0,0|2,0,0]=4 229 B11R1.192 CCSc1ccc(c(c1)O)F 62a_100000210202_100000686035 [2,0,0,0,0,0|2,0,0]=4 230 B11R1.192 CCSc1ccc(c(c1)O)F 62a_100000686035_100000210202 [2,0,0,0,0,0|2,0,0]=4 231 B11R1.192 CCSc1ccc(c(c1)O)N 62a_100000210202_100000739049 [2,0,0,0,0,0|2,0,0]=4 232 B11R1.192 CCSc1ccc(c(c1)O)N 62a_100000739049_100000210202 [2,0,0,0,0,0|2,0,0]=4 233 B11R1.192 CCSc1ccc(c(c1)O)O 62a_100000210202_100009813601 [2,0,0,0,0,0|1,0,0]=3 234 B11R1.192 CNCc1ccc(c(c1)F)O 34a_100000758358_200000210301 [2,0,0,0,0,0|2,0,0]=4 235 B11R1.192 CNCc1ccc(c(c1)O)Cl 34a_100020636435_200000210301 [2,0,0,0,0,0|2,0,0]=4 236 B11R1.192 CNCc1ccc(c(c1)O)F 34a_100160469508_200000210301 [2,0,0,0,0,0|2,0,0]=4 237 B11R1.192 CNCc1ccc(c(c1)O)O 34a_100000010075_200000210301 [2,0,0,0,0,0|1,0,0]=3 238 B11R1.192 COCc1ccc(c(c1)F)O 271570a_203496583355_100010177442 [2,0,0,0,0,0|2,0,0]=4 239 B11R1.192 COCc1ccc(c(c1)N)O 271570a_203496583355_200013033220 [2,0,0,0,0,0|2,0,0]=4 240 B11R1.192 COCc1ccc(c(c1)O)C 271570a_203496583355_200015395492 [2,0,0,0,0,0|2,0,0]=4 241 B11R1.192 COCc1ccc(c(c1)O)F 271570a_203496583355_200011493689 [2,0,0,0,0,0|2,0,0]=4 242 B11R1.192 OCCc1ccc(c(c1)F)O 271570a_203496583355_100012921202 [2,0,0,0,0,0|2,0,0]=4 243 B11R1.192 Oc1ccc(cc1O)NCF 34a_100102946323_100015361967 [2,0,0,0,0,0|2,0,0]=4 244 B11R1.192 Oc1ccc(cc1O)SCF 62a_100015361967_100009813601 [2,0,0,0,0,0|2,0,0]=4 245 B11R1.192 [13CH3]NCc1ccc(c(c1)F)O 34a_100000758358_200025704644 [2,0,0,0,0,0|2,0,0]=4 246 B11R1.192 [13CH3]NCc1ccc(c(c1)O)Cl 34a_100020636435_200025704644 [2,0,0,0,0,0|2,0,0]=4 247 B11R1.192 [13CH3]NCc1ccc(c(c1)O)F 34a_100160469508_200025704644 [2,0,0,0,0,0|2,0,0]=4 248 B11R1.192 [13CH3]NCc1ccc(c(c1)O)O 34a_100000010075_200025704644 [2,0,0,0,0,0|1,0,0]=3 249 B11R1.22 CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210202 [2,0,0,0,0,0|0,0,2]=4 250 B11R1.22 CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000211647 [2,0,0,0,0,0|0,0,2]=4 251 B11R1.22 CCC(C)c1ccc(cc1)O 271570a_203496583355_100011221364 [2,0,0,0,0,0|1,0,0]=3 252 B11R1.22 CCC(O)c1ccc(cc1)O 271570a_203496583355_100000246506 [2,0,0,0,0,0|0,0,0]=2 253 B11R1.22 CCN(C)c1ccc(cc1)O 2230a_100011337800_200000210301 [2,0,0,0,0,0|2,0,0]=4 254 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100000182112_100000204670 [2,0,0,0,0,0|2,0,0]=4 255 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100011337800_200000210301 [2,0,0,0,0,0|2,0,0]=4 256 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100000182112_100000210202 [2,0,0,0,0,0|2,0,0]=4 257 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100011337800_200000210301 [2,0,0,0,0,0|2,0,0]=4 258 B11R1.22 CCN([13CH3])c1ccc(cc1)O 2230a_100011337800_200025704644 [2,0,0,0,0,0|2,0,0]=4 259 B11R1.22 CCN([13CH3])c1ccc(cc1)O 269982a_100011337800_200025704644 [2,0,0,0,0,0|2,0,0]=4 260 B11R1.22 CCN([13CH3])c1ccc(cc1)O 34a_100011337800_200025704644 [2,0,0,0,0,0|2,0,0]=4 261 B11R1.22 CC[C@H](N)c1ccc(cc1)O 271570a_203496583355_100025736560 [2,0,0,0,0,0|1,0,0]=3 262 B11R1.22 CNC(C)c1ccc(cc1)O 271570a_203496583355_100000231103 [2,0,0,0,0,0|2,0,0]=4 263 B11R1.22 CN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_200000210301 [2,0,0,0,0,0|2,0,0]=4 264 B11R1.22 COC(C)c1ccc(cc1)O 271570a_203496583355_100010254937 [2,0,0,0,0,0|2,0,0]=4 265 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)O 2230a_100161106496_200025704644 [2,0,0,0,0,0|2,0,0]=4 266 B11R1.22 NC(CO)c1ccc(cc1)O 271570a_203496583355_100000734186 [2,0,0,0,0,0|2,0,0]=4 267 B11R1.22 NCC(=O)c1ccc(cc1)O 271570a_203496583355_100000017248 [2,0,0,0,0,0|0,0,2]=4 268 B11R1.22 NCC(O)c1ccc(cc1)O 271570a_203496583355_100020626992 [2,0,0,0,0,0|0,0,0]=2 269 B11R1.22 OCC(O)c1ccc(cc1)O 271570a_203496583355_200012355997 [2,0,0,0,0,0|1,0,0]=3 270 B11R1.36 CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_200000210301 [2,0,0,0,0,0|1,0,1]=4 271 B11R1.36 [13CH3]C(=O)[C@H](O)c1ccccc1 1458a_100000684486_200025704644 [2,0,0,0,0,0|1,0,1]=4 272 B11R1.23 CC(N[13CH3])c1cccc(c1)O 2230a_100000740644_200025704644 [2,0,0,0,0,0|2,0,0]=4 273 B11R1.23 CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210202 [2,0,0,0,0,0|0,0,2]=4 274 B11R1.23 CCC(=O)c1cccc(c1)O 271570a_203496583355_100000211677 [2,0,0,0,0,0|0,0,2]=4 275 B11R1.23 CCC(O)c1cccc(c1)O 271570a_203496583355_200013212081 [2,0,0,0,0,0|0,0,0]=2 276 B11R1.23 CCN(C)c1cccc(c1)O 2230a_100000717746_200000210301 [2,0,0,0,0,0|2,0,0]=4 277 B11R1.23 CCN(C)c1cccc(c1)O 2230a_100000756613_100000210202 [2,0,0,0,0,0|2,0,0]=4 278 B11R1.23 CCN(C)c1cccc(c1)O 269982a_100000717746_200000210301 [2,0,0,0,0,0|2,0,0]=4 279 B11R1.23 CCN(C)c1cccc(c1)O 269982a_100000756613_100000204670 [2,0,0,0,0,0|2,0,0]=4 280 B11R1.23 CCN(C)c1cccc(c1)O 34a_100000717746_200000210301 [2,0,0,0,0,0|2,0,0]=4 281 B11R1.23 CCN(C)c1cccc(c1)O 34a_100000756613_100000210202 [2,0,0,0,0,0|2,0,0]=4 282 B11R1.23 CCN([13CH3])c1cccc(c1)O 2230a_100000717746_200025704644 [2,0,0,0,0,0|2,0,0]=4 283 B11R1.23 CCN([13CH3])c1cccc(c1)O 269982a_100000717746_200025704644 [2,0,0,0,0,0|2,0,0]=4 284 B11R1.23 CCN([13CH3])c1cccc(c1)O 34a_100000717746_200025704644 [2,0,0,0,0,0|2,0,0]=4 285 B11R1.23 CC[C@H](N)c1cccc(c1)O 271570a_203496583355_100102422761 [2,0,0,0,0,0|1,0,0]=3 286 B11R1.23 CNC(C)c1cccc(c1)O 2230a_100000740644_200000210301 [2,0,0,0,0,0|2,0,0]=4 287 B11R1.23 CNC(C)c1cccc(c1)O 269862a_106832991636_100000211620 [2,0,0,0,0,0|2,0,0]=4 288 B11R1.23 CNC(C)c1cccc(c1)O 271570a_203496583355_100025717457 [2,0,0,0,0,0|2,0,0]=4 289 B11R1.23 NC(CO)c1cccc(c1)O 271570a_203496583355_100000690078 [2,0,0,0,0,0|2,0,0]=4 290 B11R1.23 NCC(=O)c1cccc(c1)O 271570a_203496583355_100020587001 [2,0,0,0,0,0|0,0,2]=4 291 B11R1.21 C=C(C)c1ccc(c(c1)O)O 271570a_100000694244_100009813601 [2,0,0,0,0,0|1,0,1]=4 292 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [2,0,0,0,0,0|0,0,2]=4 293 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [2,0,0,0,0,0|0,0,2]=4 294 B11R1.21 CC(C)c1ccc(c(c1)Br)O 271570a_203496583355_200010212211 [2,0,0,0,0,0|2,0,0]=4 295 B11R1.21 CC(C)c1ccc(c(c1)O)N 271570a_203496583355_100011218581 [2,0,0,0,0,0|2,0,0]=4 296 B11R1.21 CC(O)c1ccc(c(c1)O)F 271570a_203496583355_100011191524 [2,0,0,0,0,0|1,0,0]=3 297 B11R1.21 C[C@H](N)c1ccc(c(c1)F)O 271570a_203496583355_100134618348 [2,0,0,0,0,0|2,0,0]=4 298 B11R1.21 C[C@H](N)c1ccc(c(c1)O)F 271570a_203496583355_100000753309 [2,0,0,0,0,0|2,0,0]=4 299 B11R1.21 NC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012344895 [2,0,0,0,0,0|0,0,2]=4 300 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [2,0,0,0,0,0|0,0,2]=4 301 B13R1.35 CC(C)Sc1ccc(c(c1)O)CO 62a_100000071718_100000210206 [1,1,0,0,0,0|2,0,0]=4 302 B13R1.35 CC(C)Sc1ccc(c(c1)O)CO 62a_100000210206_100000071718 [1,1,0,0,0,0|2,0,0]=4 303 B13R1.35 COc1ccc(cc1O)CC(=O)C 1458a_100000049095_200000210301 [1,1,0,0,0,0|1,0,1]=4 304 B13R1.35 COc1ccc(cc1O)CC(=O)C 271570a_203496583355_100011493462 [1,1,0,0,0,0|1,0,1]=4 305 B13R1.35 COc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000049095_200025704644 [1,1,0,0,0,0|1,0,1]=4 306 B13R1.35 COc1ccc(cc1O)CN(C)C 2230a_100000188468_200000210301 [1,1,0,0,0,0|2,0,0]=4 307 B13R1.35 COc1ccc(cc1O)CN(C)C 269982a_100000188468_200000210301 [1,1,0,0,0,0|2,0,0]=4 308 B13R1.35 COc1ccc(cc1O)CN(C)[13CH3] 2230a_100000188468_200025704644 [1,1,0,0,0,0|2,0,0]=4 309 B13R1.35 COc1ccc(cc1O)CN(C)[13CH3] 269982a_100000188468_200025704644 [1,1,0,0,0,0|2,0,0]=4 310 B13R1.35 COc1ccc(cc1O)NC(C)C 34a_100000211920_100000210206 [1,1,0,0,0,0|2,0,0]=4 311 B13R1.35 COc1ccc(cc1O)SC(C)C 62a_100000210206_100009816560 [1,1,0,0,0,0|2,0,0]=4 312 B13R1.52 CC(C)Sc1ccc(c(c1)CO)O 62a_100000184703_100000210206 [1,1,0,0,0,0|2,0,0]=4 313 B13R1.52 CC(C)Sc1ccc(c(c1)CO)O 62a_100000210206_100000184703 [1,1,0,0,0,0|2,0,0]=4 314 B13R1.52 COc1cc(ccc1O)CC(=O)C 1458a_100000032101_200000210301 [1,1,0,0,0,0|1,0,1]=4 315 B13R1.52 COc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000032101_200025704644 [1,1,0,0,0,0|1,0,1]=4 316 B13R1.52 COc1cc(ccc1O)NC(C)C 34a_100000726020_100000210206 [1,1,0,0,0,0|2,0,0]=4 317 B13R1.52 COc1cc(ccc1O)SC(C)C 62a_100000210206_100000694246 [1,1,0,0,0,0|2,0,0]=4 318 B13R1.518 CC(C)(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000210625 [1,1,0,0,0,0|2,0,0]=4 319 B13R1.518 CC(C)(C)Sc1ccc(c(c1)O)O 62a_100000211941_100009813601 [1,1,0,0,0,0|2,0,0]=4 320 B13R1.2879 C#CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_200000035995 [1,1,0,0,0,0|2,0,0]=4 321 B13R1.2879 C#CC(C)Sc1ccc(c(c1)O)O 62a_200000035995_100009813601 [1,1,0,0,0,0|2,0,0]=4 322 B13R1.2879 C=CC(C)Sc1ccc(c(c1)O)O 62a_100011215867_100009813601 [1,1,0,0,0,0|2,0,0]=4 323 B13R1.2879 CC(C#N)Sc1ccc(c(c1)O)O 62a_100000703298_100009813601 [1,1,0,0,0,0|1,0,1]=4 324 B13R1.2879 CC(CO)Nc1ccc(c(c1)O)O 34a_100102946323_100012180447 [1,1,0,0,0,0|2,0,0]=4 325 B13R1.2879 CC(CO)Sc1ccc(c(c1)O)O 62a_100012180447_100009813601 [1,1,0,0,0,0|2,0,0]=4 326 B13R1.2879 CCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210202 [1,1,0,0,0,0|1,0,1]=4 327 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100011215416 [1,1,0,0,0,0|2,0,0]=4 328 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)O 62a_100000758301_100009813601 [1,1,0,0,0,0|2,0,0]=4 329 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)O 527a_100102657272_100000031429 [1,1,0,0,0,0|1,0,1]=4 330 B13R1.2879 CNC(C)Cc1ccc(c(c1)Cl)Cl 270004a_106832991635_100011586667 [1,1,0,0,0,0|2,0,0]=4 331 B13R1.2879 COC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010222482 [1,1,0,0,0,0|1,0,1]=4 332 B13R1.2879 COC(C)Sc1ccc(c(c1)O)O 62a_100009879195_100009813601 [1,1,0,0,0,0|2,0,0]=4 333 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)O)O 62a_100016084084_100009813601 [1,1,0,0,0,0|2,0,0]=4 334 B13R1.2879 O=C(CF)Cc1ccc(c(c1)O)O 1458a_100000031429_100015361967 [1,1,0,0,0,0|1,0,1]=4 335 B13R1.3528 CC(C)Oc1ccc(c(c1F)O)O 271570a_203496583355_202127810487 [1,1,0,0,0,0|2,0,0]=4 336 B13R1.3763 CC(C)Sc1cc(c(c(c1)F)O)O 62a_100000210206_100010114375 [1,1,0,0,0,0|2,0,0]=4 337 B13R1.3763 CC(C)Sc1cc(c(c(c1)O)O)O 62a_100000210206_100010658518 [1,1,0,0,0,0|2,0,0]=4 338 B13R1.21 CCC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000210202 [1,1,0,0,0,0|1,0,1]=4 339 B13R1.21 CNC(=O)C(O)c1ccc(cc1)O 240690a_100102657272_100011215213 [1,1,0,0,0,0|1,0,1]=4 340 B13R1.21 CNC(C)C(=O)c1ccc(cc1)O 2230a_106832991635_200010205864 [1,1,0,0,0,0|0,0,2]=4 341 B13R1.21 CNC(C)C(=O)c1ccc(cc1)O 34a_100102657272_200010205864 [1,1,0,0,0,0|0,0,2]=4 342 B13R1.21 CNC(C)C(=O)c1ccc(cc1)O 7a_106832991635_200010205864 [1,1,0,0,0,0|0,0,2]=4 343 B13R1.21 CN[C@H](C)[C@@H](O)c1ccc(cc1)Cl 2230a_200009830414_200000210301 [1,1,0,0,0,0|1,0,0]=3 344 B13R1.21 CN[C@H](C)[C@@H](O)c1ccc(cc1)Cl 34a_200009830414_200000210301 [1,1,0,0,0,0|1,0,0]=3 345 B13R1.21 C[C@@H](N[13CH3])[C@@H](O)c1ccc(cc1)Cl 2230a_200009830414_200025704644 [1,1,0,0,0,0|1,0,0]=3 346 B13R1.21 C[C@@H](N[13CH3])[C@@H](O)c1ccc(cc1)Cl 34a_200009830414_200025704644 [1,1,0,0,0,0|1,0,0]=3 347 B13R1.21 O=C(CF)C(O)c1ccc(cc1)O 1458a_100011215213_100015361967 [1,1,0,0,0,0|1,0,1]=4 348 B13R1.36 COc1ccc(cc1)C(O)C(=O)C 1458a_100011218652_200000210301 [1,1,0,0,0,0|1,0,1]=4 349 B13R1.36 COc1ccc(cc1)C(O)C(=O)[13CH3] 1458a_100011218652_200025704644 [1,1,0,0,0,0|1,0,1]=4 350 B13R1.525 Oc1ccc(cc1)[C@H](O)C(F)(F)F 271570a_203496583355_100010192173 [1,1,0,0,0,0|2,0,0]=4 351 B13R1.706 CC(C)C(C#N)c1ccc(cc1)O 271570a_203496583355_100000698803 [1,1,0,0,0,0|2,0,0]=4 352 B13R1.706 CO[C@@H](c1ccc(cc1)Cl)[C@@H](C)N 34a_200009830414_200000210301 [1,1,0,0,0,0|1,0,0]=3 353 B13R1.706 C[C@@H](N)[C@@H](O[13CH3])c1ccc(cc1)Cl 34a_200009830414_200025704644 [1,1,0,0,0,0|1,0,0]=3 354 B13R1.3492 Oc1cccc(c1)C(O)C(F)(F)F 271570a_203496583355_100000766643 [1,1,0,0,0,0|2,0,0]=4 355 B13R1.49 CCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210202 [1,1,0,0,0,0|0,0,2]=4 356 B13R1.331 CCC(NC)c1ccc(c(c1)Cl)O 269862a_106832991636_100011218862 [1,1,0,0,0,0|2,0,0]=4 357 B13R1.466 CCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210303 [1,1,0,0,0,0|0,0,2]=4 358 B13R1.466 CCNC(C)c1ccc(c(c1)Br)O 269862a_100015525214_100011772453 [1,1,0,0,0,0|2,0,0]=4 359 B13R1.466 CCNC(C)c1ccc(c(c1)C)O 269862a_100015525214_100000188726 [1,1,0,0,0,0|2,0,0]=4 360 B13R1.466 CCNC(C)c1ccc(c(c1)Cl)O 269862a_100015525214_100000188625 [1,1,0,0,0,0|2,0,0]=4 361 B13R1.466 CCNC(C)c1ccc(c(c1)F)O 269862a_100015525214_100000751691 [1,1,0,0,0,0|2,0,0]=4 362 B13R1.466 CCNC(C)c1ccc(c(c1)O)C 269862a_100015525214_100000084092 [1,1,0,0,0,0|2,0,0]=4 363 B13R1.466 CCNC(C)c1ccc(c(c1)O)F 269862a_100015525214_100000117923 [1,1,0,0,0,0|2,0,0]=4 364 B13R1.466 CCOC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100009812659 [1,1,0,0,0,0|0,0,2]=4 365 B13R1.466 CCOC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012355281 [1,1,0,0,0,0|0,0,2]=4 366 B13R1.466 CNCC(=O)c1ccc(c(c1)O)O 7a_106832991635_100000183813 [1,1,0,0,0,0|0,0,2]=4 367 B13R1.466 CNCC(O)c1ccc(c(c1)O)O 34a_100000106456_200000210301 [1,1,0,0,0,0|0,0,0]=2 368 B13R1.466 CNC[C@@H](O)c1ccc(c(c1)F)F 2230a_106832991635_100000761251 [1,1,0,0,0,0|2,0,0]=4 369 B13R1.466 CNC[C@@H](O)c1ccc(c(c1)F)F 34a_100102657272_100000761251 [1,1,0,0,0,0|2,0,0]=4 370 B13R1.466 CNC[C@@H](O)c1ccc(c(c1)F)F 7a_106832991635_100000761251 [1,1,0,0,0,0|2,0,0]=4 371 B13R1.466 COC[C@@H](O)c1ccc(c(c1)F)F 34a_100138415774_100000761251 [1,1,0,0,0,0|2,0,0]=4 372 B13R1.466 CSCC(=O)c1ccc(c(c1)O)O 62a_200000210301_100000183813 [1,1,0,0,0,0|0,0,2]=4 373 B13R1.466 CSC[C@@H](O)c1ccc(c(c1)F)F 62a_100000761251_200000210301 [1,1,0,0,0,0|2,0,0]=4 374 B13R1.466 CSC[C@@H](O)c1ccc(c(c1)F)F 62a_200000210301_100000761251 [1,1,0,0,0,0|2,0,0]=4 375 B13R1.466 O=C(CCF)c1ccc(c(c1)O)O 1458a_100000212155_100011217306 [1,1,0,0,0,0|0,0,2]=4 376 B13R1.466 O=C(CCO)c1ccc(c(c1)O)O 1458a_100000212155_100000211926 [1,1,0,0,0,0|0,0,2]=4 377 B13R1.466 [13CH3]NCC(O)c1ccc(c(c1)O)O 34a_100000106456_200025704644 [1,1,0,0,0,0|0,0,0]=2 378 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)O)O 62a_200025704644_100000183813 [1,1,0,0,0,0|0,0,2]=4 379 B13R1.466 [13CH3]SC[C@@H](O)c1ccc(c(c1)F)F 62a_100000761251_200025704644 [1,1,0,0,0,0|2,0,0]=4 380 B13R1.466 [13CH3]SC[C@@H](O)c1ccc(c(c1)F)F 62a_200025704644_100000761251 [1,1,0,0,0,0|2,0,0]=4 381 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_100000210202 [1,1,0,0,0,0|0,0,2]=4 382 B13R1.1808 CCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000210202 [1,1,0,0,0,0|0,0,2]=4 383 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000210202 [1,1,0,0,0,0|0,0,2]=4 384 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000210202 [1,1,0,0,0,0|0,0,2]=4 385 B13R1.2678 CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210202 [1,1,0,0,0,0|0,0,2]=4 386 B13R1.3088 CCC(=O)c1ccc(c(c1)O)OC 1458a_100000766810_100000210202 [1,1,0,0,0,0|0,0,2]=4 387 B13R1.3088 CNC(C)c1ccc(c(c1)O)OC 269862a_106832991636_100000732934 [1,1,0,0,0,0|2,0,0]=4 388 B15R1.890 CC(C)C(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100000210206 [0,1,0,0,0,1|1,0,0]=3 389 B15R1.890 CN(C)C(=O)C(O)c1ccc(c(c1)O)O 240690a_100102631434_200000032065 [0,1,0,0,0,1|2,0,0]=4 390 B15R1.3776 CC(C)C[C@H](N)c1ccc(c(c1)O)CO 271570a_100015190218_100000071718 [0,1,0,0,0,1|2,0,0]=4 391 B15R1.3776 COc1ccc(cc1O)[C@@H](N)CC(C)C 271570a_100015190218_100009816560 [0,1,0,0,0,1|2,0,0]=4 392 B15R1.4037 CC(C)C[C@H](N)c1ccc(c(c1)CO)O 271570a_100015190218_100000184703 [0,1,0,0,0,1|2,0,0]=4 393 B15R1.4037 COc1cc(ccc1O)[C@@H](N)CC(C)C 271570a_100015190218_100000694246 [0,1,0,0,0,1|2,0,0]=4 394 B15R1.5521 CCC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_100000210202 [0,1,0,0,0,1|1,0,1]=4 395 B15R1.5521 O=C(CF)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_100015361967 [0,1,0,0,0,1|1,0,1]=4 396 B15R1.4029 CCC(=O)C(O)c1ccc(c(c1)OC)O 1458a_100000036414_100000210202 [0,2,0,0,0,0|1,0,1]=4 397 B15R1.4029 CNC(=O)C(O)c1ccc(c(c1)OC)O 240690a_100102657272_100000036414 [0,2,0,0,0,0|1,0,1]=4 398 B15R1.4029 COc1cc(ccc1O)C(O)C(=O)CF 1458a_100000036414_100015361967 [0,2,0,0,0,0|1,0,1]=4 399 B15R1.3956 C#CCC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100000184674 [0,2,0,0,0,0|1,0,1]=4 400 B15R1.3956 C=CCC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100000210623 [0,2,0,0,0,0|1,0,1]=4 401 B15R1.3956 CCCC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100000210303 [0,2,0,0,0,0|1,0,1]=4 402 B15R1.3956 CCNC(=O)C(O)c1ccc(c(c1)O)O 240690a_100015525214_200000032065 [0,2,0,0,0,0|1,0,1]=4 403 B15R1.3956 N#CCC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100011214920 [0,2,0,0,0,0|1,0,1]=4 404 B15R1.3956 O=C(CCF)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100011217306 [0,2,0,0,0,0|1,0,1]=4 405 B15R1.3956 O=C(CCO)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100000211926 [0,2,0,0,0,0|1,0,1]=4 406 B13R2.521 Oc1ccc(cc1O)NC2CC2 34a_100102946323_100000211595 [1,0,0,1,0,0|2,0,0]=4 407 B13R2.520 Oc1ccc(cc1)C(O)C2CC2 271570a_203496583355_100000756592 [1,0,0,1,0,0|1,0,0]=3 408 B15R2.4239 CC(=O)C(O)c1ccc2c(c1)OCO2 1458a_200011216465_200000210301 [0,1,0,1,0,0|1,0,1]=4 409 B15R2.4239 [13CH3]C(=O)C(O)c1ccc2c(c1)OCO2 1458a_200011216465_200025704644 [0,1,0,1,0,0|1,0,1]=4 410 B13R1.511 C=C(C)CNc1ccc(c(c1)O)O 34a_100102946323_100000748629 [1,0,0,0,0,1|1,0,1]=4 411 B13R1.511 C=C(C)CSc1ccc(c(c1)O)O 62a_100000748629_100009813601 [1,0,0,0,0,1|1,0,1]=4 412 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200000210301 [1,0,0,0,0,1|1,0,1]=4 413 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000070787_200010393615 [1,0,0,0,0,1|1,0,1]=4 414 B13R1.511 CC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100015343762 [1,0,0,0,0,1|1,0,1]=4 415 B13R1.511 CC(C)C=Cc1ccc(c(c1)O)O 271570a_100016257149_100009813601 [1,0,0,0,0,1|1,0,1]=4 416 B13R1.511 CC(C)CNc1ccc(c(c1)Br)O 34a_100011534360_100000210624 [1,0,0,0,0,1|2,0,0]=4 417 B13R1.511 CC(C)CNc1ccc(c(c1)Cl)O 34a_100000744943_100000210624 [1,0,0,0,0,1|2,0,0]=4 418 B13R1.511 CC(C)CNc1ccc(c(c1)F)O 34a_100011220035_100000210624 [1,0,0,0,0,1|2,0,0]=4 419 B13R1.511 CC(C)CNc1ccc(c(c1)F)O 7a_100011220035_100000210760 [1,0,0,0,0,1|2,0,0]=4 420 B13R1.511 CC(C)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000210624 [1,0,0,0,0,1|2,0,0]=4 421 B13R1.511 CC(C)CNc1ccc(c(c1)O)F 34a_100012017398_100000210624 [1,0,0,0,0,1|2,0,0]=4 422 B13R1.511 CC(C)CNc1ccc(c(c1)O)F 7a_100012017398_100000210760 [1,0,0,0,0,1|2,0,0]=4 423 B13R1.511 CC(C)CNc1ccc(c(c1)O)O 34a_100102946323_100000210624 [1,0,0,0,0,1|1,0,0]=3 424 B13R1.511 CC(C)COc1ccc(c(c1)Br)O 271570a_203496583355_201991077984 [1,0,0,0,0,1|2,0,0]=4 425 B13R1.511 CC(C)CSc1ccc(c(c1)Br)O 62a_100000210624_100012361655 [1,0,0,0,0,1|2,0,0]=4 426 B13R1.511 CC(C)CSc1ccc(c(c1)Br)O 62a_100012361655_100000210760 [1,0,0,0,0,1|2,0,0]=4 427 B13R1.511 CC(C)CSc1ccc(c(c1)Cl)O 62a_100000210624_100012360047 [1,0,0,0,0,1|2,0,0]=4 428 B13R1.511 CC(C)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000210760 [1,0,0,0,0,1|2,0,0]=4 429 B13R1.511 CC(C)CSc1ccc(c(c1)F)O 62a_100000185481_100000210760 [1,0,0,0,0,1|2,0,0]=4 430 B13R1.511 CC(C)CSc1ccc(c(c1)F)O 62a_100000210624_100000185481 [1,0,0,0,0,1|2,0,0]=4 431 B13R1.511 CC(C)CSc1ccc(c(c1)N)O 62a_100000210624_100000752626 [1,0,0,0,0,1|2,0,0]=4 432 B13R1.511 CC(C)CSc1ccc(c(c1)N)O 62a_100000752626_100000210760 [1,0,0,0,0,1|2,0,0]=4 433 B13R1.511 CC(C)CSc1ccc(c(c1)O)Br 62a_100000210624_100012356990 [1,0,0,0,0,1|2,0,0]=4 434 B13R1.511 CC(C)CSc1ccc(c(c1)O)Br 62a_100012356990_100000210760 [1,0,0,0,0,1|2,0,0]=4 435 B13R1.511 CC(C)CSc1ccc(c(c1)O)Cl 62a_100000210624_100011356854 [1,0,0,0,0,1|2,0,0]=4 436 B13R1.511 CC(C)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000210760 [1,0,0,0,0,1|2,0,0]=4 437 B13R1.511 CC(C)CSc1ccc(c(c1)O)F 62a_100000210624_100000686035 [1,0,0,0,0,1|2,0,0]=4 438 B13R1.511 CC(C)CSc1ccc(c(c1)O)F 62a_100000686035_100000210760 [1,0,0,0,0,1|2,0,0]=4 439 B13R1.511 CC(C)CSc1ccc(c(c1)O)N 62a_100000210624_100000739049 [1,0,0,0,0,1|2,0,0]=4 440 B13R1.511 CC(C)CSc1ccc(c(c1)O)N 62a_100000739049_100000210760 [1,0,0,0,0,1|2,0,0]=4 441 B13R1.511 CC(C)CSc1ccc(c(c1)O)O 62a_100000210624_100009813601 [1,0,0,0,0,1|1,0,0]=3 442 B13R1.511 CC(C)NCc1ccc(c(c1)F)O 34a_100000758358_100000210206 [1,0,0,0,0,1|2,0,0]=4 443 B13R1.511 CC(C)NCc1ccc(c(c1)O)Cl 34a_100020636435_100000210206 [1,0,0,0,0,1|2,0,0]=4 444 B13R1.511 CC(C)NCc1ccc(c(c1)O)F 34a_100160469508_100000210206 [1,0,0,0,0,1|2,0,0]=4 445 B13R1.511 CC(C)NCc1ccc(c(c1)O)O 34a_100000010075_100000210206 [1,0,0,0,0,1|1,0,0]=3 446 B13R1.511 CC(O)C=Cc1ccc(c(c1)O)O 271570a_200011019289_100009813601 [1,0,0,0,0,1|1,0,1]=4 447 B13R1.511 CC(O)CNc1ccc(c(c1)Br)O 34a_100011534360_100011218427 [1,0,0,0,0,1|2,0,0]=4 448 B13R1.511 CC(O)CNc1ccc(c(c1)Cl)O 34a_100000744943_100011218427 [1,0,0,0,0,1|2,0,0]=4 449 B13R1.511 CC(O)CNc1ccc(c(c1)F)O 34a_100011220035_100011218427 [1,0,0,0,0,1|2,0,0]=4 450 B13R1.511 CC(O)CNc1ccc(c(c1)F)O 7a_100011220035_100011218427 [1,0,0,0,0,1|2,0,0]=4 451 B13R1.511 CC(O)CNc1ccc(c(c1)O)Cl 34a_100011934209_100011218427 [1,0,0,0,0,1|2,0,0]=4 452 B13R1.511 CC(O)CNc1ccc(c(c1)O)F 34a_100012017398_100011218427 [1,0,0,0,0,1|2,0,0]=4 453 B13R1.511 CC(O)CNc1ccc(c(c1)O)F 7a_100012017398_100011218427 [1,0,0,0,0,1|2,0,0]=4 454 B13R1.511 CC(O)CNc1ccc(c(c1)O)O 34a_100102946323_100011218427 [1,0,0,0,0,1|1,0,0]=3 455 B13R1.511 CC(O)CSc1ccc(c(c1)Br)O 62a_100011218427_100012361655 [1,0,0,0,0,1|2,0,0]=4 456 B13R1.511 CC(O)CSc1ccc(c(c1)Br)O 62a_100012361655_100011218427 [1,0,0,0,0,1|2,0,0]=4 457 B13R1.511 CC(O)CSc1ccc(c(c1)Cl)O 62a_100011218427_100012360047 [1,0,0,0,0,1|2,0,0]=4 458 B13R1.511 CC(O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100011218427 [1,0,0,0,0,1|2,0,0]=4 459 B13R1.511 CC(O)CSc1ccc(c(c1)F)O 62a_100000185481_100011218427 [1,0,0,0,0,1|2,0,0]=4 460 B13R1.511 CC(O)CSc1ccc(c(c1)F)O 62a_100011218427_100000185481 [1,0,0,0,0,1|2,0,0]=4 461 B13R1.511 CC(O)CSc1ccc(c(c1)N)O 62a_100000752626_100011218427 [1,0,0,0,0,1|2,0,0]=4 462 B13R1.511 CC(O)CSc1ccc(c(c1)N)O 62a_100011218427_100000752626 [1,0,0,0,0,1|2,0,0]=4 463 B13R1.511 CC(O)CSc1ccc(c(c1)O)Br 62a_100011218427_100012356990 [1,0,0,0,0,1|2,0,0]=4 464 B13R1.511 CC(O)CSc1ccc(c(c1)O)Br 62a_100012356990_100011218427 [1,0,0,0,0,1|2,0,0]=4 465 B13R1.511 CC(O)CSc1ccc(c(c1)O)Cl 62a_100011218427_100011356854 [1,0,0,0,0,1|2,0,0]=4 466 B13R1.511 CC(O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100011218427 [1,0,0,0,0,1|2,0,0]=4 467 B13R1.511 CC(O)CSc1ccc(c(c1)O)F 62a_100000686035_100011218427 [1,0,0,0,0,1|2,0,0]=4 468 B13R1.511 CC(O)CSc1ccc(c(c1)O)F 62a_100011218427_100000686035 [1,0,0,0,0,1|2,0,0]=4 469 B13R1.511 CC(O)CSc1ccc(c(c1)O)N 62a_100000739049_100011218427 [1,0,0,0,0,1|2,0,0]=4 470 B13R1.511 CC(O)CSc1ccc(c(c1)O)N 62a_100011218427_100000739049 [1,0,0,0,0,1|2,0,0]=4 471 B13R1.511 CC(O)CSc1ccc(c(c1)O)O 62a_100011218427_100009813601 [1,0,0,0,0,1|1,0,0]=3 472 B13R1.511 CN(C)CCc1ccc(c(c1)O)O 269982a_100102631434_200010393615 [1,0,0,0,0,1|2,0,0]=4 473 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)Br)O 34a_100011534360_100009817552 [1,0,0,0,0,1|2,0,0]=4 474 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)Cl)O 34a_100000744943_100009817552 [1,0,0,0,0,1|2,0,0]=4 475 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)F)O 34a_100011220035_100009817552 [1,0,0,0,0,1|2,0,0]=4 476 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)F)O 7a_100011220035_100009817552 [1,0,0,0,0,1|2,0,0]=4 477 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)O)Cl 34a_100011934209_100009817552 [1,0,0,0,0,1|2,0,0]=4 478 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)O)F 34a_100012017398_100009817552 [1,0,0,0,0,1|2,0,0]=4 479 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)O)F 7a_100012017398_100009817552 [1,0,0,0,0,1|2,0,0]=4 480 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)O)O 34a_100102946323_100009817552 [1,0,0,0,0,1|1,0,0]=3 481 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)Br)O 62a_100009817552_100012361655 [1,0,0,0,0,1|2,0,0]=4 482 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)Br)O 62a_100012361655_100009817552 [1,0,0,0,0,1|2,0,0]=4 483 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)Cl)O 62a_100009817552_100012360047 [1,0,0,0,0,1|2,0,0]=4 484 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100009817552 [1,0,0,0,0,1|2,0,0]=4 485 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)F)O 62a_100000185481_100009817552 [1,0,0,0,0,1|2,0,0]=4 486 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)F)O 62a_100009817552_100000185481 [1,0,0,0,0,1|2,0,0]=4 487 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)N)O 62a_100000752626_100009817552 [1,0,0,0,0,1|2,0,0]=4 488 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)N)O 62a_100009817552_100000752626 [1,0,0,0,0,1|2,0,0]=4 489 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)Br 62a_100009817552_100012356990 [1,0,0,0,0,1|2,0,0]=4 490 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)Br 62a_100012356990_100009817552 [1,0,0,0,0,1|2,0,0]=4 491 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)Cl 62a_100009817552_100011356854 [1,0,0,0,0,1|2,0,0]=4 492 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100009817552 [1,0,0,0,0,1|2,0,0]=4 493 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)F 62a_100000686035_100009817552 [1,0,0,0,0,1|2,0,0]=4 494 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)F 62a_100009817552_100000686035 [1,0,0,0,0,1|2,0,0]=4 495 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)N 62a_100000739049_100009817552 [1,0,0,0,0,1|2,0,0]=4 496 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)N 62a_100009817552_100000739049 [1,0,0,0,0,1|2,0,0]=4 497 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)O 62a_100009817552_100009813601 [1,0,0,0,0,1|1,0,0]=3 498 B13R1.511 Cc1cc(ccc1O)NCC(C)C 34a_100011218179_100000210624 [1,0,0,0,0,1|2,0,0]=4 499 B13R1.511 Cc1cc(ccc1O)NCC(C)C 7a_100011218179_100000210760 [1,0,0,0,0,1|2,0,0]=4 500 B13R1.511 Cc1cc(ccc1O)NCC(C)O 34a_100011218179_100011218427 [1,0,0,0,0,1|2,0,0]=4 501 B13R1.511 Cc1cc(ccc1O)NCC(C)O 7a_100011218179_100011218427 [1,0,0,0,0,1|2,0,0]=4 502 B13R1.511 Cc1cc(ccc1O)NC[C@@H](C)O 34a_100011218179_100009817552 [1,0,0,0,0,1|2,0,0]=4 503 B13R1.511 Cc1cc(ccc1O)NC[C@@H](C)O 7a_100011218179_100009817552 [1,0,0,0,0,1|2,0,0]=4 504 B13R1.511 Cc1cc(ccc1O)SCC(C)C 62a_100000210624_100000186361 [1,0,0,0,0,1|2,0,0]=4 505 B13R1.511 Cc1cc(ccc1O)SCC(C)O 62a_100011218427_100000186361 [1,0,0,0,0,1|2,0,0]=4 506 B13R1.511 Cc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100000186361 [1,0,0,0,0,1|2,0,0]=4 507 B13R1.511 Cc1ccc(cc1O)NCC(C)C 34a_100000759471_100000210624 [1,0,0,0,0,1|2,0,0]=4 508 B13R1.511 Cc1ccc(cc1O)NCC(C)C 7a_100000759471_100000210760 [1,0,0,0,0,1|2,0,0]=4 509 B13R1.511 Cc1ccc(cc1O)NCC(C)O 34a_100000759471_100011218427 [1,0,0,0,0,1|2,0,0]=4 510 B13R1.511 Cc1ccc(cc1O)NCC(C)O 7a_100000759471_100011218427 [1,0,0,0,0,1|2,0,0]=4 511 B13R1.511 Cc1ccc(cc1O)NC[C@@H](C)O 34a_100000759471_100009817552 [1,0,0,0,0,1|2,0,0]=4 512 B13R1.511 Cc1ccc(cc1O)NC[C@@H](C)O 7a_100000759471_100009817552 [1,0,0,0,0,1|2,0,0]=4 513 B13R1.511 Cc1ccc(cc1O)SCC(C)C 62a_100000210624_100000685420 [1,0,0,0,0,1|2,0,0]=4 514 B13R1.511 Cc1ccc(cc1O)SCC(C)C 62a_100000685420_100000210760 [1,0,0,0,0,1|2,0,0]=4 515 B13R1.511 Cc1ccc(cc1O)SCC(C)O 62a_100000685420_100011218427 [1,0,0,0,0,1|2,0,0]=4 516 B13R1.511 Cc1ccc(cc1O)SCC(C)O 62a_100011218427_100000685420 [1,0,0,0,0,1|2,0,0]=4 517 B13R1.511 Cc1ccc(cc1O)SC[C@@H](C)O 62a_100000685420_100009817552 [1,0,0,0,0,1|2,0,0]=4 518 B13R1.511 Cc1ccc(cc1O)SC[C@@H](C)O 62a_100009817552_100000685420 [1,0,0,0,0,1|2,0,0]=4 519 B13R1.511 NC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000187820 [1,0,0,0,0,1|1,0,1]=4 520 B13R1.511 NC(=O)CSc1ccc(c(c1)O)O 62a_100000747473_100009813601 [1,0,0,0,0,1|1,0,1]=4 521 B13R1.511 Oc1ccc(cc1O)NCC(F)F 34a_100102946323_100011934356 [1,0,0,0,0,1|2,0,0]=4 522 B13R1.511 Oc1ccc(cc1O)SCC(F)F 62a_100011934356_100009813601 [1,0,0,0,0,1|2,0,0]=4 523 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200025704644 [1,0,0,0,0,1|1,0,1]=4 524 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)O 271570a_100015190218_100000185759 [1,0,0,0,0,1|2,0,0]=4 525 B13R1.132 CC(C)N[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210206 [1,0,0,0,0,1|2,0,0]=4 526 B13R1.132 CN(C)CC(O)c1ccc(cc1)O 2230a_100016988945_200000210301 [1,0,0,0,0,1|2,0,0]=4 527 B13R1.132 CN(C)CC(O)c1ccc(cc1)O 269982a_100016988945_200000210301 [1,0,0,0,0,1|2,0,0]=4 528 B13R1.132 CN([13CH3])CC(O)c1ccc(cc1)O 2230a_100016988945_200025704644 [1,0,0,0,0,1|2,0,0]=4 529 B13R1.132 CN([13CH3])CC(O)c1ccc(cc1)O 269982a_100016988945_200025704644 [1,0,0,0,0,1|2,0,0]=4 530 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200000210301 [1,0,0,0,0,1|1,0,1]=4 531 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200025704644 [1,0,0,0,0,1|1,0,1]=4 532 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)O 271570a_100015190218_100000211634 [1,0,0,0,0,1|2,0,0]=4 533 B13R1.147 CC(C)NC(C)c1cccc(c1)O 2230a_100000740644_100000210206 [1,0,0,0,0,1|2,0,0]=4 534 B13R1.147 CN(C)C[C@H](O)c1cccc(c1)O 2230a_100009815823_200000210301 [1,0,0,0,0,1|2,0,0]=4 535 B13R1.147 CN(C)C[C@H](O)c1cccc(c1)O 269982a_100009815823_200000210301 [1,0,0,0,0,1|2,0,0]=4 536 B13R1.147 CN([13CH3])C[C@H](O)c1cccc(c1)O 2230a_100009815823_200025704644 [1,0,0,0,0,1|2,0,0]=4 537 B13R1.147 CN([13CH3])C[C@H](O)c1cccc(c1)O 269982a_100009815823_200025704644 [1,0,0,0,0,1|2,0,0]=4 538 B15R1.883 CC(C)CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000731052 [0,0,0,0,0,2|2,0,0]=4 539 B15R1.883 CC(C)CC(C)Sc1ccc(c(c1)O)O 62a_100000731052_100009813601 [0,0,0,0,0,2|2,0,0]=4 540 B15R1.889 CC(=O)NCC(O)c1ccc(c(c1)O)O 527a_100000106456_100103153847 [0,0,0,0,0,2|1,0,1]=4 541 B15R1.889 CC(C)NCC(O)c1ccc(c(c1)O)O 34a_100000106456_100000210206 [0,0,0,0,0,2|1,0,0]=3