0 B11R1.159 C=C(C)c1cccc(c1Br)O 271570a_100000694244_100010187914 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.159 C=C(C)c1cccc(c1C)Br 271570a_100000694244_100012353703 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.159 C=C(C)c1cccc(c1C)C 271570a_100000694244_100011214922 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.159 C=C(C)c1cccc(c1C)Cl 271570a_100000694244_100000726075 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.159 C=C(C)c1cccc(c1C)F 271570a_100000694244_100011216893 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.159 C=C(C)c1cccc(c1C)N 271570a_100000694244_100000761887 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.159 C=C(C)c1cccc(c1C)O 271570a_100000694244_100012002258 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.159 C=C(C)c1cccc(c1Cl)Br 271570a_100000694244_100010142854 [0,0,0,0,0,0|4,0,0]=4 8 B11R1.159 C=C(C)c1cccc(c1Cl)C 271570a_100000694244_200012352035 [0,0,0,0,0,0|4,0,0]=4 9 B11R1.159 C=C(C)c1cccc(c1Cl)Cl 271570a_100000694244_100011215384 [0,0,0,0,0,0|4,0,0]=4 10 B11R1.159 C=C(C)c1cccc(c1Cl)F 271570a_100000694244_200010234923 [0,0,0,0,0,0|4,0,0]=4 11 B11R1.159 C=C(C)c1cccc(c1Cl)O 271570a_100000694244_100000049636 [0,0,0,0,0,0|3,0,0]=3 12 B11R1.159 C=C(C)c1cccc(c1F)Br 271570a_100000694244_100000702267 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.159 C=C(C)c1cccc(c1F)C 271570a_100000694244_100000717567 [0,0,0,0,0,0|4,0,0]=4 14 B11R1.159 C=C(C)c1cccc(c1F)Cl 271570a_100000694244_100011217346 [0,0,0,0,0,0|4,0,0]=4 15 B11R1.159 C=C(C)c1cccc(c1F)F 271570a_100000694244_100000694657 [0,0,0,0,0,0|4,0,0]=4 16 B11R1.159 C=C(C)c1cccc(c1F)N 271570a_100000694244_100011935091 [0,0,0,0,0,0|4,0,0]=4 17 B11R1.159 C=C(C)c1cccc(c1F)O 271570a_100000694244_100009817021 [0,0,0,0,0,0|3,0,0]=3 18 B11R1.159 C=C(C)c1cccc(c1N)Br 271570a_100000694244_100010146558 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.159 C=C(C)c1cccc(c1N)C 271570a_100000694244_100011834072 [0,0,0,0,0,0|3,0,0]=3 20 B11R1.159 C=C(C)c1cccc(c1N)Cl 271570a_100000694244_100010190421 [0,0,0,0,0,0|3,0,0]=3 21 B11R1.159 C=C(C)c1cccc(c1N)F 271570a_100000694244_100000042321 [0,0,0,0,0,0|3,0,0]=3 22 B11R1.159 C=C(C)c1cccc(c1N)N 271570a_100000694244_100015191791 [0,0,0,0,0,0|3,0,0]=3 23 B11R1.159 C=C(C)c1cccc(c1N)O 271570a_100000694244_100011934926 [0,0,0,0,0,0|2,0,0]=2 24 B11R1.159 C=C(C)c1cccc(c1O)Br 271570a_100000694244_100010084509 [0,0,0,0,0,0|4,0,0]=4 25 B11R1.159 C=C(C)c1cccc(c1O)C 271570a_100000694244_100009817157 [0,0,0,0,0,0|4,0,0]=4 26 B11R1.159 C=C(C)c1cccc(c1O)Cl 271570a_100000694244_100010202889 [0,0,0,0,0,0|4,0,0]=4 27 B11R1.159 C=C(C)c1cccc(c1O)F 271570a_100000694244_100009813666 [0,0,0,0,0,0|4,0,0]=4 28 B11R1.159 C=C(C)c1cccc(c1O)N 271570a_100000694244_100011934915 [0,0,0,0,0,0|4,0,0]=4 29 B11R1.159 C=C(C)c1cccc(c1O)O 271570a_100000694244_100009815950 [0,0,0,0,0,0|3,0,0]=3 30 B11R1.159 C=C(C)c1ccnc(c1C)O 271570a_100000694244_100009858498 [0,0,0,0,0,0|4,0,0]=4 31 B11R1.159 C=C(C)c1ccnc(c1N)C 271570a_100000694244_100009885578 [0,0,0,0,0,0|4,0,0]=4 32 B11R1.159 C=C(C)c1ccnc(c1N)N 271570a_100000694244_100000124095 [0,0,0,0,0,0|4,0,0]=4 33 B11R1.159 C=C(C)c1cncc(c1N)Br 271570a_100000694244_100011290786 [0,0,0,0,0,0|4,0,0]=4 34 B11R1.159 C=C(C)c1cncc(c1N)C 271570a_100000694244_100009818025 [0,0,0,0,0,0|4,0,0]=4 35 B11R1.159 C=C(C)c1cncc(c1N)Cl 271570a_100000694244_100000684942 [0,0,0,0,0,0|4,0,0]=4 36 B11R1.159 C=C(C)c1cncc(c1N)F 271570a_100000694244_100009880649 [0,0,0,0,0,0|4,0,0]=4 37 B11R1.159 C=C(C)c1cncc(c1N)N 271570a_100000694244_100000694774 [0,0,0,0,0,0|4,0,0]=4 38 B11R1.159 C=C(C)c1nccc(c1F)O 271570a_100000694244_100009876375 [0,0,0,0,0,0|4,0,0]=4 39 B11R1.159 C=C(C)c1nccc(c1N)C 271570a_100000694244_100000763560 [0,0,0,0,0,0|4,0,0]=4 40 B11R1.159 C=C(C)c1nccc(c1N)N 271570a_100000694244_100000085203 [0,0,0,0,0,0|4,0,0]=4 41 B11R1.159 C=C(C)c1nccc(c1N)O 271570a_100000694244_100000128729 [0,0,0,0,0,0|3,0,0]=3 42 B11R1.159 C=C(C)c1ncnc(c1N)O 271570a_100000694244_100011795086 [0,0,0,0,0,0|4,0,0]=4 43 B11R1.159 CC(=O)c1cccc(c1Br)Br 1458a_100012360534_200000210301 [0,0,0,0,0,0|3,0,0]=3 44 B11R1.159 CC(=O)c1cccc(c1Br)C 1458a_100000692419_200000210301 [0,0,0,0,0,0|3,0,0]=3 45 B11R1.159 CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_200000210301 [0,0,0,0,0,0|3,0,0]=3 46 B11R1.159 CC(=O)c1cccc(c1Br)F 1458a_100011217547_200000210301 [0,0,0,0,0,0|3,0,0]=3 47 B11R1.159 CC(=O)c1cccc(c1Br)I 1458a_100010232522_200000210301 [0,0,0,0,0,0|3,0,0]=3 48 B11R1.159 CC(=O)c1cccc(c1Br)O 1458a_100010230362_200000210301 [0,0,0,0,0,0|2,0,0]=2 49 B11R1.159 CC(=O)c1cccc(c1C)Br 1458a_100000760464_200000210301 [0,0,0,0,0,0|3,0,0]=3 50 B11R1.159 CC(=O)c1cccc(c1C)C 1458a_100000183679_200000210301 [0,0,0,0,0,0|3,0,0]=3 51 B11R1.159 CC(=O)c1cccc(c1C)Cl 1458a_100000690184_200000210301 [0,0,0,0,0,0|3,0,0]=3 52 B11R1.159 CC(=O)c1cccc(c1C)F 1458a_100011218272_200000210301 [0,0,0,0,0,0|3,0,0]=3 53 B11R1.159 CC(=O)c1cccc(c1C)I 1458a_100000751865_200000210301 [0,0,0,0,0,0|3,0,0]=3 54 B11R1.159 CC(=O)c1cccc(c1C)O 1458a_100000766327_200000210301 [0,0,0,0,0,0|2,0,0]=2 55 B11R1.159 CC(=O)c1cccc(c1C)O 271570a_203496583355_100012706834 [0,0,0,0,0,0|2,0,0]=2 56 B11R1.159 CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_200000210301 [0,0,0,0,0,0|3,0,0]=3 57 B11R1.159 CC(=O)c1cccc(c1Cl)C 1458a_100000693142_200000210301 [0,0,0,0,0,0|3,0,0]=3 58 B11R1.159 CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200000210301 [0,0,0,0,0,0|3,0,0]=3 59 B11R1.159 CC(=O)c1cccc(c1Cl)F 1458a_100000759904_200000210301 [0,0,0,0,0,0|3,0,0]=3 60 B11R1.159 CC(=O)c1cccc(c1Cl)I 1458a_100010176783_200000210301 [0,0,0,0,0,0|3,0,0]=3 61 B11R1.159 CC(=O)c1cccc(c1Cl)O 1458a_100000092362_200000210301 [0,0,0,0,0,0|2,0,0]=2 62 B11R1.159 CC(=O)c1cccc(c1F)Br 1458a_100000756403_200000210301 [0,0,0,0,0,0|3,0,0]=3 63 B11R1.159 CC(=O)c1cccc(c1F)C 1458a_100000766181_200000210301 [0,0,0,0,0,0|3,0,0]=3 64 B11R1.159 CC(=O)c1cccc(c1F)Cl 1458a_100000688816_200000210301 [0,0,0,0,0,0|3,0,0]=3 65 B11R1.159 CC(=O)c1cccc(c1F)F 1458a_100000748134_200000210301 [0,0,0,0,0,0|3,0,0]=3 66 B11R1.159 CC(=O)c1cccc(c1F)I 1458a_100010185205_200000210301 [0,0,0,0,0,0|3,0,0]=3 67 B11R1.159 CC(=O)c1cccc(c1F)O 1458a_100000037433_200000210301 [0,0,0,0,0,0|2,0,0]=2 68 B11R1.159 CC(=O)c1cccc(c1F)O 271570a_203496583355_100012355707 [0,0,0,0,0,0|2,0,0]=2 69 B11R1.159 CC(=O)c1cccc(c1I)Br 1458a_100000688019_200000210301 [0,0,0,0,0,0|3,0,0]=3 70 B11R1.159 CC(=O)c1cccc(c1I)C 1458a_100000739377_200000210301 [0,0,0,0,0,0|3,0,0]=3 71 B11R1.159 CC(=O)c1cccc(c1I)Cl 1458a_100010176784_200000210301 [0,0,0,0,0,0|3,0,0]=3 72 B11R1.159 CC(=O)c1cccc(c1I)F 1458a_100000690930_200000210301 [0,0,0,0,0,0|3,0,0]=3 73 B11R1.159 CC(=O)c1cccc(c1I)O 1458a_100010084636_200000210301 [0,0,0,0,0,0|2,0,0]=2 74 B11R1.159 CC(=O)c1cccc(c1O)Br 1458a_100000752940_200000210301 [0,0,0,0,0,0|3,0,0]=3 75 B11R1.159 CC(=O)c1cccc(c1O)C 1458a_100000183896_200000210301 [0,0,0,0,0,0|3,0,0]=3 76 B11R1.159 CC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000210301 [0,0,0,0,0,0|3,0,0]=3 77 B11R1.159 CC(=O)c1cccc(c1O)F 1458a_100011217230_200000210301 [0,0,0,0,0,0|3,0,0]=3 78 B11R1.159 CC(=O)c1cccc(c1O)F 271570a_203496583355_100012362612 [0,0,0,0,0,0|3,0,0]=3 79 B11R1.159 CC(=O)c1cccc(c1O)O 1458a_100000690420_200000210301 [0,0,0,0,0,0|2,0,0]=2 80 B11R1.159 CC(=O)c1cccc(c1O)O 271570a_203496583355_100009815558 [0,0,0,0,0,0|2,0,0]=2 81 B11R1.159 CC(=O)c1ccnc(c1N)O 271570a_203496583355_200000063496 [0,0,0,0,0,0|2,0,0]=2 82 B11R1.159 CC(=O)c1nccc(c1F)O 271570a_203496583355_100010729024 [0,0,0,0,0,0|3,0,0]=3 83 B11R1.159 CC(C)c1cccc(c1N)O 271570a_203496583355_100010571509 [0,0,0,0,0,0|2,0,1]=3 84 B11R1.159 CC(O)c1cccc(c1F)O 271570a_203496583355_200012356376 [0,0,0,0,0,0|2,0,1]=3 85 B11R1.159 Cc1c(cccc1B(O)O)O 271570a_203496583355_100000724322 [0,0,0,0,0,0|2,0,1]=3 86 B11R1.159 Cc1c(cccc1C(=O)N)O 271570a_203496583355_200012298201 [0,0,0,0,0,0|2,0,0]=2 87 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Br 1458a_100000760464_200025704644 [0,0,0,0,0,0|3,0,0]=3 88 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Cl 1458a_100000690184_200025704644 [0,0,0,0,0,0|3,0,0]=3 89 B11R1.159 Cc1c(cccc1C(=O)[13CH3])F 1458a_100011218272_200025704644 [0,0,0,0,0,0|3,0,0]=3 90 B11R1.159 Cc1c(cccc1C(=O)[13CH3])I 1458a_100000751865_200025704644 [0,0,0,0,0,0|3,0,0]=3 91 B11R1.159 Cc1c(cccc1C(=O)[13CH3])O 1458a_100000766327_200025704644 [0,0,0,0,0,0|2,0,0]=2 92 B11R1.159 Cc1cccc(c1Br)C(=O)[13CH3] 1458a_100000692419_200025704644 [0,0,0,0,0,0|3,0,0]=3 93 B11R1.159 Cc1cccc(c1C)C(=O)[13CH3] 1458a_100000183679_200025704644 [0,0,0,0,0,0|3,0,0]=3 94 B11R1.159 Cc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000693142_200025704644 [0,0,0,0,0,0|3,0,0]=3 95 B11R1.159 Cc1cccc(c1F)C(=O)[13CH3] 1458a_100000766181_200025704644 [0,0,0,0,0,0|3,0,0]=3 96 B11R1.159 Cc1cccc(c1I)C(=O)[13CH3] 1458a_100000739377_200025704644 [0,0,0,0,0,0|3,0,0]=3 97 B11R1.159 Cc1cccc(c1O)C(=O)N 271570a_203496583355_200011409216 [0,0,0,0,0,0|3,0,0]=3 98 B11R1.159 Cc1cccc(c1O)C(=O)[13CH3] 1458a_100000183896_200025704644 [0,0,0,0,0,0|3,0,0]=3 99 B11R1.159 NC(=O)c1cccc(c1F)O 271570a_203496583355_100012351131 [0,0,0,0,0,0|2,0,0]=2 100 B11R1.159 NC(=O)c1cccc(c1N)O 271570a_203496583355_100010144993 [0,0,0,0,0,0|1,0,0]=1 101 B11R1.159 NC(=O)c1cccc(c1O)F 271570a_203496583355_200012351544 [0,0,0,0,0,0|3,0,0]=3 102 B11R1.159 NC(=O)c1ccnc(c1N)O 271570a_203496583355_100000080204 [0,0,0,0,0,0|2,0,0]=2 103 B11R1.159 OB(O)c1cccc(c1F)O 271570a_203496583355_100011934463 [0,0,0,0,0,0|2,0,1]=3 104 B11R1.159 OB(O)c1ccnc(c1F)O 271570a_203496583355_200010157539 [0,0,0,0,0,0|3,0,1]=4 105 B11R1.159 Oc1cccc(c1F)C(F)F 271570a_203496583355_100010189892 [0,0,0,0,0,0|3,0,1]=4 106 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Br 1458a_100012360534_200025704644 [0,0,0,0,0,0|3,0,0]=3 107 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Cl 1458a_100012339722_200025704644 [0,0,0,0,0,0|3,0,0]=3 108 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)F 1458a_100011217547_200025704644 [0,0,0,0,0,0|3,0,0]=3 109 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)I 1458a_100010232522_200025704644 [0,0,0,0,0,0|3,0,0]=3 110 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)O 1458a_100010230362_200025704644 [0,0,0,0,0,0|2,0,0]=2 111 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Br 1458a_100000760540_200025704644 [0,0,0,0,0,0|3,0,0]=3 112 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200025704644 [0,0,0,0,0,0|3,0,0]=3 113 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)F 1458a_100000759904_200025704644 [0,0,0,0,0,0|3,0,0]=3 114 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)I 1458a_100010176783_200025704644 [0,0,0,0,0,0|3,0,0]=3 115 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)O 1458a_100000092362_200025704644 [0,0,0,0,0,0|2,0,0]=2 116 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Br 1458a_100000756403_200025704644 [0,0,0,0,0,0|3,0,0]=3 117 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Cl 1458a_100000688816_200025704644 [0,0,0,0,0,0|3,0,0]=3 118 B11R1.159 [13CH3]C(=O)c1cccc(c1F)F 1458a_100000748134_200025704644 [0,0,0,0,0,0|3,0,0]=3 119 B11R1.159 [13CH3]C(=O)c1cccc(c1F)I 1458a_100010185205_200025704644 [0,0,0,0,0,0|3,0,0]=3 120 B11R1.159 [13CH3]C(=O)c1cccc(c1F)O 1458a_100000037433_200025704644 [0,0,0,0,0,0|2,0,0]=2 121 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Br 1458a_100000688019_200025704644 [0,0,0,0,0,0|3,0,0]=3 122 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Cl 1458a_100010176784_200025704644 [0,0,0,0,0,0|3,0,0]=3 123 B11R1.159 [13CH3]C(=O)c1cccc(c1I)F 1458a_100000690930_200025704644 [0,0,0,0,0,0|3,0,0]=3 124 B11R1.159 [13CH3]C(=O)c1cccc(c1I)O 1458a_100010084636_200025704644 [0,0,0,0,0,0|2,0,0]=2 125 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Br 1458a_100000752940_200025704644 [0,0,0,0,0,0|3,0,0]=3 126 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Cl 1458a_100000742801_200025704644 [0,0,0,0,0,0|3,0,0]=3 127 B11R1.159 [13CH3]C(=O)c1cccc(c1O)F 1458a_100011217230_200025704644 [0,0,0,0,0,0|3,0,0]=3 128 B11R1.159 [13CH3]C(=O)c1cccc(c1O)O 1458a_100000690420_200025704644 [0,0,0,0,0,0|2,0,0]=2 129 B10R1.2 C=Cc1cccc(c1Br)O 271570a_100011290941_100010187914 [1,0,0,0,0,0|2,0,0]=3 130 B10R1.2 C=Cc1cccc(c1C)Br 271570a_100011290941_100012353703 [1,0,0,0,0,0|3,0,0]=4 131 B10R1.2 C=Cc1cccc(c1C)C 271570a_100011290941_100011214922 [1,0,0,0,0,0|3,0,0]=4 132 B10R1.2 C=Cc1cccc(c1C)Cl 271570a_100011290941_100000726075 [1,0,0,0,0,0|3,0,0]=4 133 B10R1.2 C=Cc1cccc(c1C)F 271570a_100011290941_100011216893 [1,0,0,0,0,0|3,0,0]=4 134 B10R1.2 C=Cc1cccc(c1C)N 271570a_100011290941_100000761887 [1,0,0,0,0,0|3,0,0]=4 135 B10R1.2 C=Cc1cccc(c1C)O 271570a_100011290941_100012002258 [1,0,0,0,0,0|2,0,0]=3 136 B10R1.2 C=Cc1cccc(c1Cl)Br 271570a_100011290941_100010142854 [1,0,0,0,0,0|3,0,0]=4 137 B10R1.2 C=Cc1cccc(c1Cl)C 271570a_100011290941_200012352035 [1,0,0,0,0,0|3,0,0]=4 138 B10R1.2 C=Cc1cccc(c1Cl)Cl 271570a_100011290941_100011215384 [1,0,0,0,0,0|3,0,0]=4 139 B10R1.2 C=Cc1cccc(c1Cl)F 271570a_100011290941_200010234923 [1,0,0,0,0,0|3,0,0]=4 140 B10R1.2 C=Cc1cccc(c1Cl)O 271570a_100011290941_100000049636 [1,0,0,0,0,0|2,0,0]=3 141 B10R1.2 C=Cc1cccc(c1F)Br 271570a_100011290941_100000702267 [1,0,0,0,0,0|3,0,0]=4 142 B10R1.2 C=Cc1cccc(c1F)C 271570a_100011290941_100000717567 [1,0,0,0,0,0|3,0,0]=4 143 B10R1.2 C=Cc1cccc(c1F)Cl 271570a_100011290941_100011217346 [1,0,0,0,0,0|3,0,0]=4 144 B10R1.2 C=Cc1cccc(c1F)F 271570a_100011290941_100000694657 [1,0,0,0,0,0|3,0,0]=4 145 B10R1.2 C=Cc1cccc(c1F)N 271570a_100011290941_100011935091 [1,0,0,0,0,0|3,0,0]=4 146 B10R1.2 C=Cc1cccc(c1F)O 271570a_100011290941_100009817021 [1,0,0,0,0,0|2,0,0]=3 147 B10R1.2 C=Cc1cccc(c1N)Br 271570a_100011290941_100010146558 [1,0,0,0,0,0|2,0,0]=3 148 B10R1.2 C=Cc1cccc(c1N)C 271570a_100011290941_100011834072 [1,0,0,0,0,0|2,0,0]=3 149 B10R1.2 C=Cc1cccc(c1N)Cl 271570a_100011290941_100010190421 [1,0,0,0,0,0|2,0,0]=3 150 B10R1.2 C=Cc1cccc(c1N)F 271570a_100011290941_100000042321 [1,0,0,0,0,0|2,0,0]=3 151 B10R1.2 C=Cc1cccc(c1N)N 271570a_100011290941_100015191791 [1,0,0,0,0,0|2,0,0]=3 152 B10R1.2 C=Cc1cccc(c1N)O 271570a_100011290941_100011934926 [1,0,0,0,0,0|1,0,0]=2 153 B10R1.2 C=Cc1cccc(c1O)Br 271570a_100011290941_100010084509 [1,0,0,0,0,0|3,0,0]=4 154 B10R1.2 C=Cc1cccc(c1O)C 271570a_100011290941_100009817157 [1,0,0,0,0,0|3,0,0]=4 155 B10R1.2 C=Cc1cccc(c1O)Cl 271570a_100011290941_100010202889 [1,0,0,0,0,0|3,0,0]=4 156 B10R1.2 C=Cc1cccc(c1O)F 271570a_100011290941_100009813666 [1,0,0,0,0,0|3,0,0]=4 157 B10R1.2 C=Cc1cccc(c1O)N 271570a_100011290941_100011934915 [1,0,0,0,0,0|3,0,0]=4 158 B10R1.2 C=Cc1cccc(c1O)O 271570a_100011290941_100009815950 [1,0,0,0,0,0|2,0,0]=3 159 B10R1.2 C=Cc1ccnc(c1C)O 271570a_100011290941_100009858498 [1,0,0,0,0,0|3,0,0]=4 160 B10R1.2 C=Cc1ccnc(c1N)C 271570a_100011290941_100009885578 [1,0,0,0,0,0|3,0,0]=4 161 B10R1.2 C=Cc1ccnc(c1N)N 271570a_100011290941_100000124095 [1,0,0,0,0,0|3,0,0]=4 162 B10R1.2 C=Cc1cncc(c1N)Br 271570a_100011290941_100011290786 [1,0,0,0,0,0|3,0,0]=4 163 B10R1.2 C=Cc1cncc(c1N)C 271570a_100011290941_100009818025 [1,0,0,0,0,0|3,0,0]=4 164 B10R1.2 C=Cc1cncc(c1N)Cl 271570a_100011290941_100000684942 [1,0,0,0,0,0|3,0,0]=4 165 B10R1.2 C=Cc1cncc(c1N)F 271570a_100011290941_100009880649 [1,0,0,0,0,0|3,0,0]=4 166 B10R1.2 C=Cc1cncc(c1N)N 271570a_100011290941_100000694774 [1,0,0,0,0,0|3,0,0]=4 167 B10R1.2 C=Cc1nccc(c1F)O 271570a_100011290941_100009876375 [1,0,0,0,0,0|3,0,0]=4 168 B10R1.2 C=Cc1nccc(c1N)C 271570a_100011290941_100000763560 [1,0,0,0,0,0|3,0,0]=4 169 B10R1.2 C=Cc1nccc(c1N)N 271570a_100011290941_100000085203 [1,0,0,0,0,0|3,0,0]=4 170 B10R1.2 C=Cc1nccc(c1N)O 271570a_100011290941_100000128729 [1,0,0,0,0,0|2,0,0]=3 171 B10R1.2 C=Cc1ncnc(c1N)O 271570a_100011290941_100011795086 [1,0,0,0,0,0|3,0,0]=4 172 B10R1.2 CCc1cccc(c1O)O 271570a_203496583355_200010001580 [1,0,0,0,0,0|2,0,1]=4 173 B10R1.2 CNc1cccc(c1Br)O 34a_100012183704_200000210301 [1,0,0,0,0,0|3,0,0]=4 174 B10R1.2 CNc1cccc(c1Br)O 7a_100012183704_200000210301 [1,0,0,0,0,0|3,0,0]=4 175 B10R1.2 CNc1cccc(c1C)O 34a_100011216573_200000210301 [1,0,0,0,0,0|3,0,0]=4 176 B10R1.2 CNc1cccc(c1C)O 7a_100011216573_200000210301 [1,0,0,0,0,0|3,0,0]=4 177 B10R1.2 CNc1cccc(c1Cl)O 34a_100012002038_200000210301 [1,0,0,0,0,0|3,0,0]=4 178 B10R1.2 CNc1cccc(c1Cl)O 7a_100012002038_200000210301 [1,0,0,0,0,0|3,0,0]=4 179 B10R1.2 CNc1cccc(c1N)O 271570a_203496583355_100000695761 [1,0,0,0,0,0|2,0,0]=3 180 B10R1.2 CNc1ccnc(c1N)O 271570a_203496583355_200000076579 [1,0,0,0,0,0|3,0,0]=4 181 B10R1.2 COc1cccc(c1C)O 271570a_203496583355_100010002647 [1,0,0,0,0,0|3,0,0]=4 182 B10R1.2 COc1cccc(c1Cl)O 271570a_203496583355_100010147677 [1,0,0,0,0,0|3,0,0]=4 183 B10R1.2 COc1cccc(c1F)O 271570a_203496583355_100010185846 [1,0,0,0,0,0|3,0,0]=4 184 B10R1.2 COc1cccc(c1N)Br 34a_100011934926_200000210301 [1,0,0,0,0,0|3,0,0]=4 185 B10R1.2 COc1cccc(c1N)Br 7a_100011934926_200000210301 [1,0,0,0,0,0|3,0,0]=4 186 B10R1.2 COc1cccc(c1N)C 34a_100000743429_200000210301 [1,0,0,0,0,0|3,0,0]=4 187 B10R1.2 COc1cccc(c1N)C 7a_100000743429_200000210301 [1,0,0,0,0,0|3,0,0]=4 188 B10R1.2 COc1cccc(c1N)Cl 34a_100012022510_200000210301 [1,0,0,0,0,0|3,0,0]=4 189 B10R1.2 COc1cccc(c1N)Cl 7a_100012022510_200000210301 [1,0,0,0,0,0|3,0,0]=4 190 B10R1.2 COc1cccc(c1N)F 34a_100020591140_200000210301 [1,0,0,0,0,0|3,0,0]=4 191 B10R1.2 COc1cccc(c1N)F 7a_100020591140_200000210301 [1,0,0,0,0,0|3,0,0]=4 192 B10R1.2 COc1cccc(c1N)I 34a_200000049512_200000210301 [1,0,0,0,0,0|3,0,0]=4 193 B10R1.2 COc1cccc(c1N)I 7a_200000049512_200000210301 [1,0,0,0,0,0|3,0,0]=4 194 B10R1.2 COc1cccc(c1N)N 34a_100000033209_200000210301 [1,0,0,0,0,0|3,0,0]=4 195 B10R1.2 COc1cccc(c1N)O 271570a_203496583355_100000708083 [1,0,0,0,0,0|2,0,0]=3 196 B10R1.2 COc1cccc(c1O)O 271570a_203496583355_100000686866 [1,0,0,0,0,0|3,0,0]=4 197 B10R1.2 COc1cccc(c1O)O 271570a_203496583355_100010202623 [1,0,0,0,0,0|3,0,0]=4 198 B10R1.2 COc1ccnc(c1N)O 271570a_203496583355_100000100113 [1,0,0,0,0,0|3,0,0]=4 199 B10R1.2 CSc1cccc(c1Br)O 62a_100010187914_200000210301 [1,0,0,0,0,0|3,0,0]=4 200 B10R1.2 CSc1cccc(c1Br)O 62a_200000210301_100010187914 [1,0,0,0,0,0|3,0,0]=4 201 B10R1.2 CSc1cccc(c1C)O 62a_100012002258_200000210301 [1,0,0,0,0,0|3,0,0]=4 202 B10R1.2 CSc1cccc(c1C)O 62a_200000210301_100012002258 [1,0,0,0,0,0|3,0,0]=4 203 B10R1.2 CSc1cccc(c1Cl)O 62a_200000210301_100000049636 [1,0,0,0,0,0|3,0,0]=4 204 B10R1.2 CSc1cccc(c1F)O 62a_100009817021_200000210301 [1,0,0,0,0,0|3,0,0]=4 205 B10R1.2 CSc1cccc(c1F)O 62a_200000210301_100009817021 [1,0,0,0,0,0|3,0,0]=4 206 B10R1.2 CSc1cccc(c1N)Br 62a_100010146558_200000210301 [1,0,0,0,0,0|3,0,0]=4 207 B10R1.2 CSc1cccc(c1N)Br 62a_200000210301_100010146558 [1,0,0,0,0,0|3,0,0]=4 208 B10R1.2 CSc1cccc(c1N)C 62a_100011834072_200000210301 [1,0,0,0,0,0|3,0,0]=4 209 B10R1.2 CSc1cccc(c1N)C 62a_200000210301_100011834072 [1,0,0,0,0,0|3,0,0]=4 210 B10R1.2 CSc1cccc(c1N)Cl 62a_100010190421_200000210301 [1,0,0,0,0,0|3,0,0]=4 211 B10R1.2 CSc1cccc(c1N)Cl 62a_200000210301_100010190421 [1,0,0,0,0,0|3,0,0]=4 212 B10R1.2 CSc1cccc(c1N)F 62a_100000042321_200000210301 [1,0,0,0,0,0|3,0,0]=4 213 B10R1.2 CSc1cccc(c1N)F 62a_200000210301_100000042321 [1,0,0,0,0,0|3,0,0]=4 214 B10R1.2 CSc1cccc(c1N)N 62a_100015191791_200000210301 [1,0,0,0,0,0|3,0,0]=4 215 B10R1.2 CSc1cccc(c1N)O 62a_200000210301_100011934926 [1,0,0,0,0,0|2,0,0]=3 216 B10R1.2 CSc1cccc(c1O)O 62a_200000210301_100009815950 [1,0,0,0,0,0|3,0,0]=4 217 B10R1.2 Cc1c(cccc1C#N)O 271570a_203496583355_100000721996 [1,0,0,0,0,0|2,0,1]=4 218 B10R1.2 Cc1c(cccc1C=O)O 271570a_203496583355_100012179384 [1,0,0,0,0,0|1,0,0]=2 219 B10R1.2 Cc1c(cccc1CN)O 271570a_203496583355_100000724210 [1,0,0,0,0,0|2,0,1]=4 220 B10R1.2 Cc1c(cccc1CO)O 271570a_203496583355_100000694458 [1,0,0,0,0,0|1,0,1]=3 221 B10R1.2 Cc1c(cccc1N[13CH3])O 34a_100011216573_200025704644 [1,0,0,0,0,0|3,0,0]=4 222 B10R1.2 Cc1c(cccc1N[13CH3])O 7a_100011216573_200025704644 [1,0,0,0,0,0|3,0,0]=4 223 B10R1.2 Cc1c(cccc1S[13CH3])O 62a_100012002258_200025704644 [1,0,0,0,0,0|3,0,0]=4 224 B10R1.2 Cc1c(cccc1S[13CH3])O 62a_200025704644_100012002258 [1,0,0,0,0,0|3,0,0]=4 225 B10R1.2 Cc1c(ccnc1O)C=O 271570a_203496583355_100000096011 [1,0,0,0,0,0|2,0,0]=3 226 B10R1.2 Cc1c(cncc1C=O)O 271570a_203496583355_100010214934 [1,0,0,0,0,0|2,0,0]=3 227 B10R1.2 Cc1cccc(c1N)O[13CH3] 34a_100000743429_200025704644 [1,0,0,0,0,0|3,0,0]=4 228 B10R1.2 Cc1cccc(c1N)O[13CH3] 7a_100000743429_200025704644 [1,0,0,0,0,0|3,0,0]=4 229 B10R1.2 Cc1cccc(c1N)S[13CH3] 62a_100011834072_200025704644 [1,0,0,0,0,0|3,0,0]=4 230 B10R1.2 Cc1cccc(c1N)S[13CH3] 62a_200025704644_100011834072 [1,0,0,0,0,0|3,0,0]=4 231 B10R1.2 Cc1cccc(c1O)CO 271570a_203496583355_100011659289 [1,0,0,0,0,0|2,0,1]=4 232 B10R1.2 N#Cc1cccc(c1F)O 271570a_203496583355_100011934600 [1,0,0,0,0,0|2,0,1]=4 233 B10R1.2 N#Cc1cccc(c1N)O 271570a_203496583355_100000690598 [1,0,0,0,0,0|1,0,1]=3 234 B10R1.2 N#Cc1cccc(c1O)O 271570a_203496583355_100009817103 [1,0,0,0,0,0|2,0,1]=4 235 B10R1.2 N#Cc1cccc(c1O)O 271570a_203496583355_100009818990 [1,0,0,0,0,0|2,0,1]=4 236 B10R1.2 N#Cc1ccnc(c1N)O 271570a_203496583355_200000144456 [1,0,0,0,0,0|2,0,1]=4 237 B10R1.2 NCc1cccc(c1F)O 271570a_203496583355_100015189953 [1,0,0,0,0,0|2,0,1]=4 238 B10R1.2 Nc1c(cccc1C=O)O 271570a_203496583355_100010144990 [1,0,0,0,0,0|0,0,0]=1 239 B10R1.2 Nc1c(cccc1CO)O 271570a_203496583355_100012349457 [1,0,0,0,0,0|0,0,1]=2 240 B10R1.2 Nc1c(cncc1CO)O 271570a_203496583355_200010988789 [1,0,0,0,0,0|1,0,1]=3 241 B10R1.2 O=Cc1cccc(c1F)O 271570a_203496583355_100000766533 [1,0,0,0,0,0|1,0,0]=2 242 B10R1.2 O=Cc1cccc(c1O)F 271570a_203496583355_100011998484 [1,0,0,0,0,0|2,0,0]=3 243 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100000737635 [1,0,0,0,0,0|1,0,0]=2 244 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100009816417 [1,0,0,0,0,0|1,0,0]=2 245 B10R1.2 O=Cc1ccnc(c1F)O 271570a_203496583355_100010064874 [1,0,0,0,0,0|2,0,0]=3 246 B10R1.2 O=Cc1ccnc(c1O)F 271570a_203496583355_100009856171 [1,0,0,0,0,0|3,0,0]=4 247 B10R1.2 O=Cc1nccc(c1F)O 271570a_203496583355_100015713984 [1,0,0,0,0,0|2,0,0]=3 248 B10R1.2 OCc1cccc(c1Br)O 271570a_203496583355_100010240205 [1,0,0,0,0,0|1,0,1]=3 249 B10R1.2 OCc1cccc(c1F)O 271570a_203496583355_100011935076 [1,0,0,0,0,0|1,0,1]=3 250 B10R1.2 OCc1cccc(c1O)Br 271570a_203496583355_100010146604 [1,0,0,0,0,0|2,0,1]=4 251 B10R1.2 OCc1cccc(c1O)F 271570a_203496583355_100000692438 [1,0,0,0,0,0|2,0,1]=4 252 B10R1.2 OCc1ccnc(c1F)O 271570a_203496583355_100000101314 [1,0,0,0,0,0|2,0,1]=4 253 B10R1.2 [13CH3]Nc1cccc(c1Br)O 34a_100012183704_200025704644 [1,0,0,0,0,0|3,0,0]=4 254 B10R1.2 [13CH3]Nc1cccc(c1Br)O 7a_100012183704_200025704644 [1,0,0,0,0,0|3,0,0]=4 255 B10R1.2 [13CH3]Nc1cccc(c1Cl)O 34a_100012002038_200025704644 [1,0,0,0,0,0|3,0,0]=4 256 B10R1.2 [13CH3]Nc1cccc(c1Cl)O 7a_100012002038_200025704644 [1,0,0,0,0,0|3,0,0]=4 257 B10R1.2 [13CH3]Oc1cccc(c1N)Br 34a_100011934926_200025704644 [1,0,0,0,0,0|3,0,0]=4 258 B10R1.2 [13CH3]Oc1cccc(c1N)Br 7a_100011934926_200025704644 [1,0,0,0,0,0|3,0,0]=4 259 B10R1.2 [13CH3]Oc1cccc(c1N)Cl 34a_100012022510_200025704644 [1,0,0,0,0,0|3,0,0]=4 260 B10R1.2 [13CH3]Oc1cccc(c1N)Cl 7a_100012022510_200025704644 [1,0,0,0,0,0|3,0,0]=4 261 B10R1.2 [13CH3]Oc1cccc(c1N)F 34a_100020591140_200025704644 [1,0,0,0,0,0|3,0,0]=4 262 B10R1.2 [13CH3]Oc1cccc(c1N)F 7a_100020591140_200025704644 [1,0,0,0,0,0|3,0,0]=4 263 B10R1.2 [13CH3]Oc1cccc(c1N)I 34a_200000049512_200025704644 [1,0,0,0,0,0|3,0,0]=4 264 B10R1.2 [13CH3]Oc1cccc(c1N)I 7a_200000049512_200025704644 [1,0,0,0,0,0|3,0,0]=4 265 B10R1.2 [13CH3]Oc1cccc(c1N)N 34a_100000033209_200025704644 [1,0,0,0,0,0|3,0,0]=4 266 B10R1.2 [13CH3]Sc1cccc(c1Br)O 62a_100010187914_200025704644 [1,0,0,0,0,0|3,0,0]=4 267 B10R1.2 [13CH3]Sc1cccc(c1Br)O 62a_200025704644_100010187914 [1,0,0,0,0,0|3,0,0]=4 268 B10R1.2 [13CH3]Sc1cccc(c1Cl)O 62a_200025704644_100000049636 [1,0,0,0,0,0|3,0,0]=4 269 B10R1.2 [13CH3]Sc1cccc(c1F)O 62a_100009817021_200025704644 [1,0,0,0,0,0|3,0,0]=4 270 B10R1.2 [13CH3]Sc1cccc(c1F)O 62a_200025704644_100009817021 [1,0,0,0,0,0|3,0,0]=4 271 B10R1.2 [13CH3]Sc1cccc(c1N)Br 62a_100010146558_200025704644 [1,0,0,0,0,0|3,0,0]=4 272 B10R1.2 [13CH3]Sc1cccc(c1N)Br 62a_200025704644_100010146558 [1,0,0,0,0,0|3,0,0]=4 273 B10R1.2 [13CH3]Sc1cccc(c1N)Cl 62a_100010190421_200025704644 [1,0,0,0,0,0|3,0,0]=4 274 B10R1.2 [13CH3]Sc1cccc(c1N)Cl 62a_200025704644_100010190421 [1,0,0,0,0,0|3,0,0]=4 275 B10R1.2 [13CH3]Sc1cccc(c1N)F 62a_100000042321_200025704644 [1,0,0,0,0,0|3,0,0]=4 276 B10R1.2 [13CH3]Sc1cccc(c1N)F 62a_200025704644_100000042321 [1,0,0,0,0,0|3,0,0]=4 277 B10R1.2 [13CH3]Sc1cccc(c1N)N 62a_100015191791_200025704644 [1,0,0,0,0,0|3,0,0]=4 278 B10R1.2 [13CH3]Sc1cccc(c1N)O 62a_200025704644_100011934926 [1,0,0,0,0,0|2,0,0]=3 279 B10R1.2 [13CH3]Sc1cccc(c1O)O 62a_200025704644_100009815950 [1,0,0,0,0,0|3,0,0]=4 280 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [1,0,0,0,0,0|3,0,0]=4 281 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [1,0,0,0,0,0|3,0,0]=4 282 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [1,0,0,0,0,0|3,0,0]=4 283 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [1,0,0,0,0,0|3,0,0]=4 284 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [1,0,0,0,0,0|2,0,0]=3 285 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [1,0,0,0,0,0|3,0,0]=4 286 B10R1.61 C=C(C)c1cccnc1N 271570a_100000694244_100000045569 [1,0,0,0,0,0|3,0,0]=4 287 B10R1.61 C=C(C)c1ccncc1N 271570a_100000694244_100009815883 [1,0,0,0,0,0|3,0,0]=4 288 B10R1.61 C=C(C)c1cnccc1N 271570a_100000694244_100000047001 [1,0,0,0,0,0|3,0,0]=4 289 B10R1.61 C=C(C)c1ncccc1N 271570a_100000694244_100000688686 [1,0,0,0,0,0|3,0,0]=4 290 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [1,0,0,0,0,0|2,0,0]=3 291 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [1,0,0,0,0,0|2,0,0]=3 292 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [1,0,0,0,0,0|2,0,0]=3 293 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [1,0,0,0,0,0|2,0,0]=3 294 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [1,0,0,0,0,0|2,0,0]=3 295 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [1,0,0,0,0,0|2,0,0]=3 296 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [1,0,0,0,0,0|2,0,0]=3 297 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [1,0,0,0,0,0|2,0,0]=3 298 B10R1.61 CC(=O)c1cccnc1O 271570a_203496583355_100000753718 [1,0,0,0,0,0|3,0,0]=4 299 B10R1.61 CC(=O)c1ccncc1O 271570a_203496583355_100009993184 [1,0,0,0,0,0|3,0,0]=4 300 B10R1.61 CC(=O)c1cnccc1O 271570a_203496583355_100160469449 [1,0,0,0,0,0|3,0,0]=4 301 B10R1.61 CC(=O)c1ncccc1O 271570a_203496583355_100012348690 [1,0,0,0,0,0|3,0,0]=4 302 B10R1.61 CC(O)c1ccccc1O 271570a_203496583355_100000702211 [1,0,0,0,0,0|2,0,1]=4 303 B10R1.61 CS(=O)c1ccccc1O 271570a_203496583355_100000734199 [1,0,0,0,0,0|3,0,0]=4 304 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [1,0,0,0,0,0|2,0,0]=3 305 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [1,0,0,0,0,0|2,0,0]=3 306 B10R1.61 NC(=O)c1cccnc1O 271570a_203496583355_100000162199 [1,0,0,0,0,0|3,0,0]=4 307 B10R1.61 NC(=O)c1ccncc1O 271570a_203496583355_100010205435 [1,0,0,0,0,0|3,0,0]=4 308 B10R1.61 NC(=O)c1cnccc1O 271570a_203496583355_100000697804 [1,0,0,0,0,0|3,0,0]=4 309 B10R1.61 NC(=O)c1ncccc1O 271570a_203496583355_200012359670 [1,0,0,0,0,0|3,0,0]=4 310 B10R1.61 OB(O)c1ccccc1O 271570a_203496583355_100000693059 [1,0,0,0,0,0|2,0,1]=4 311 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [1,0,0,0,0,0|2,0,0]=3 312 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [1,0,0,0,0,0|2,0,0]=3 313 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [1,0,0,0,0,0|2,0,0]=3 314 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [1,0,0,0,0,0|2,0,0]=3 315 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [1,0,0,0,0,0|2,0,0]=3 316 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [1,0,0,0,0,0|2,0,0]=3 317 B10R1.113 C=C(C)c1cc(ccn1)O 271570a_100000694244_100000762945 [1,0,0,0,0,0|3,0,0]=4 318 B10R1.113 C=C(C)c1cccc(c1)Br 271570a_100000694244_100000691529 [1,0,0,0,0,0|3,0,0]=4 319 B10R1.113 C=C(C)c1cccc(c1)C 271570a_100000694244_100011215228 [1,0,0,0,0,0|3,0,0]=4 320 B10R1.113 C=C(C)c1cccc(c1)Cl 271570a_100000694244_100000699651 [1,0,0,0,0,0|3,0,0]=4 321 B10R1.113 C=C(C)c1cccc(c1)F 271570a_100000694244_100000685547 [1,0,0,0,0,0|3,0,0]=4 322 B10R1.113 C=C(C)c1cccc(c1)N 271570a_100000694244_100000210019 [1,0,0,0,0,0|3,0,0]=4 323 B10R1.113 C=C(C)c1cccc(c1)O 271570a_100000694244_100000211634 [1,0,0,0,0,0|2,0,0]=3 324 B10R1.113 C=C(C)c1cccc(c1)O 271570a_203496583355_100012123953 [1,0,0,0,0,0|2,0,0]=3 325 B10R1.113 C=C(C)c1cccc(c1)[S] 271570a_100000694244_114929384022 [1,0,0,0,0,0|2,1,0]=4 326 B10R1.113 C=C(C)c1cncc(c1)O 271570a_100000694244_100000754920 [1,0,0,0,0,0|3,0,0]=4 327 B10R1.113 C=C(C)c1cncc(c1)O 271570a_203496583355_200009889500 [1,0,0,0,0,0|3,0,0]=4 328 B10R1.113 CC(=O)c1cc(ccn1)O 271570a_203496583355_100000709912 [1,0,0,0,0,0|2,0,0]=3 329 B10R1.113 CC(=O)c1cccc(c1)Br 1458a_100000210664_200000210301 [1,0,0,0,0,0|2,0,0]=3 330 B10R1.113 CC(=O)c1cccc(c1)C 1458a_100000189346_200000210301 [1,0,0,0,0,0|2,0,0]=3 331 B10R1.113 CC(=O)c1cccc(c1)Cl 1458a_100000210390_200000210301 [1,0,0,0,0,0|2,0,0]=3 332 B10R1.113 CC(=O)c1cccc(c1)F 1458a_100000210950_200000210301 [1,0,0,0,0,0|2,0,0]=3 333 B10R1.113 CC(=O)c1cccc(c1)I 1458a_100000184098_200000210301 [1,0,0,0,0,0|2,0,0]=3 334 B10R1.113 CC(=O)c1cccc(c1)O 1458a_100000183914_200000210301 [1,0,0,0,0,0|1,0,0]=2 335 B10R1.113 CC(=O)c1cccc(c1)O 271570a_203496583355_100000210093 [1,0,0,0,0,0|1,0,0]=2 336 B10R1.113 CC(=O)c1cccc(n1)O 271570a_203496583355_100009816502 [1,0,0,0,0,0|2,0,0]=3 337 B10R1.113 CC(=O)c1ccnc(c1)O 271570a_203496583355_100000685609 [1,0,0,0,0,0|2,0,0]=3 338 B10R1.113 CC(=O)c1ccnc(n1)O 271570a_203496583355_100010643186 [1,0,0,0,0,0|3,0,0]=4 339 B10R1.113 CC(=O)c1cncc(c1)O 271570a_203496583355_100011216243 [1,0,0,0,0,0|2,0,0]=3 340 B10R1.113 CC(C)c1cccc(c1)O 271570a_203496583355_100011214899 [1,0,0,0,0,0|2,0,1]=4 341 B10R1.113 CC(N)c1cccc(c1)O 271570a_203496583355_100020642005 [1,0,0,0,0,0|2,0,1]=4 342 B10R1.113 CC(O)c1cc(ccn1)O 271570a_203496583355_100000144657 [1,0,0,0,0,0|2,0,1]=4 343 B10R1.113 CC(O)c1cccc(c1)O 271570a_203496583355_100000246457 [1,0,0,0,0,0|1,0,1]=3 344 B10R1.113 CC(O)c1cccc(n1)O 271570a_203496583355_100009820884 [1,0,0,0,0,0|2,0,1]=4 345 B10R1.113 CC(O)c1cncc(c1)O 271570a_203496583355_100012351597 [1,0,0,0,0,0|2,0,1]=4 346 B10R1.113 CN(C)c1cccc(c1)O 2230a_100000756613_200000210301 [1,0,0,0,0,0|3,0,0]=4 347 B10R1.113 CN(C)c1cccc(c1)O 269982a_100000756613_200000210301 [1,0,0,0,0,0|3,0,0]=4 348 B10R1.113 CN(C)c1cccc(c1)O 271570a_203496583355_100011215952 [1,0,0,0,0,0|3,0,0]=4 349 B10R1.113 CN(C)c1cccc(c1)O 34a_100000756613_200000210301 [1,0,0,0,0,0|3,0,0]=4 350 B10R1.113 CN([13CH3])c1cccc(c1)O 2230a_100000756613_200025704644 [1,0,0,0,0,0|3,0,0]=4 351 B10R1.113 CN([13CH3])c1cccc(c1)O 269982a_100000756613_200025704644 [1,0,0,0,0,0|3,0,0]=4 352 B10R1.113 CN([13CH3])c1cccc(c1)O 34a_100000756613_200025704644 [1,0,0,0,0,0|3,0,0]=4 353 B10R1.113 CS(=O)c1cccc(c1)O 271570a_203496583355_100009816267 [1,0,0,0,0,0|2,0,0]=3 354 B10R1.113 Cc1cccc(c1)C(=O)[13CH3] 1458a_100000189346_200025704644 [1,0,0,0,0,0|2,0,0]=3 355 B10R1.113 NC(=O)c1cc(ccn1)O 271570a_203496583355_100000229564 [1,0,0,0,0,0|2,0,0]=3 356 B10R1.113 NC(=O)c1cc(ncn1)O 271570a_203496583355_100000725265 [1,0,0,0,0,0|3,0,0]=4 357 B10R1.113 NC(=O)c1cccc(c1)O 271570a_203496583355_100000162208 [1,0,0,0,0,0|1,0,0]=2 358 B10R1.113 NC(=O)c1cccc(n1)O 271570a_203496583355_100011834053 [1,0,0,0,0,0|2,0,0]=3 359 B10R1.113 NC(=O)c1ccnc(c1)O 271570a_203496583355_100000229836 [1,0,0,0,0,0|2,0,0]=3 360 B10R1.113 NC(=O)c1ccnc(n1)O 271570a_203496583355_100000066158 [1,0,0,0,0,0|3,0,0]=4 361 B10R1.113 NC(=O)c1cncc(c1)O 271570a_203496583355_100000162242 [1,0,0,0,0,0|2,0,0]=3 362 B10R1.113 NC(=O)c1cncc(n1)O 271570a_203496583355_100000764846 [1,0,0,0,0,0|3,0,0]=4 363 B10R1.113 NC(=O)c1cnnc(c1)O 271570a_203496583355_100015785749 [1,0,0,0,0,0|3,0,0]=4 364 B10R1.113 OB(O)c1cccc(c1)O 271570a_203496583355_100000687717 [1,0,0,0,0,0|1,0,1]=3 365 B10R1.113 OB(O)c1cccc(n1)O 271570a_203496583355_100000117343 [1,0,0,0,0,0|2,0,1]=4 366 B10R1.113 OB(O)c1ccnc(c1)O 271570a_203496583355_100000049459 [1,0,0,0,0,0|2,0,1]=4 367 B10R1.113 OB(O)c1cncc(c1)O 271570a_203496583355_200009814628 [1,0,0,0,0,0|2,0,1]=4 368 B10R1.113 Oc1cccc(c1)C(F)F 271570a_203496583355_100009892619 [1,0,0,0,0,0|2,0,1]=4 369 B10R1.113 [13CH3]C(=O)c1cccc(c1)Br 1458a_100000210664_200025704644 [1,0,0,0,0,0|2,0,0]=3 370 B10R1.113 [13CH3]C(=O)c1cccc(c1)Cl 1458a_100000210390_200025704644 [1,0,0,0,0,0|2,0,0]=3 371 B10R1.113 [13CH3]C(=O)c1cccc(c1)F 1458a_100000210950_200025704644 [1,0,0,0,0,0|2,0,0]=3 372 B10R1.113 [13CH3]C(=O)c1cccc(c1)I 1458a_100000184098_200025704644 [1,0,0,0,0,0|2,0,0]=3 373 B10R1.113 [13CH3]C(=O)c1cccc(c1)O 1458a_100000183914_200025704644 [1,0,0,0,0,0|1,0,0]=2 374 B12R1.24 CCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210202 [0,1,0,0,0,0|3,0,0]=4 375 B12R1.24 CCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000210202 [0,1,0,0,0,0|3,0,0]=4 376 B12R1.24 CCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210202 [0,1,0,0,0,0|3,0,0]=4 377 B12R1.24 CCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210202 [0,1,0,0,0,0|3,0,0]=4 378 B12R1.24 CCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210202 [0,1,0,0,0,0|3,0,0]=4 379 B12R1.24 CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210202 [0,1,0,0,0,0|2,0,0]=3 380 B12R1.24 CCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000210202 [0,1,0,0,0,0|3,0,0]=4 381 B12R1.24 CCC(=O)c1cccc(c1C)C 1458a_100000183679_100000210202 [0,1,0,0,0,0|3,0,0]=4 382 B12R1.24 CCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000210202 [0,1,0,0,0,0|3,0,0]=4 383 B12R1.24 CCC(=O)c1cccc(c1C)F 1458a_100011218272_100000210202 [0,1,0,0,0,0|3,0,0]=4 384 B12R1.24 CCC(=O)c1cccc(c1C)I 1458a_100000751865_100000210202 [0,1,0,0,0,0|3,0,0]=4 385 B12R1.24 CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210202 [0,1,0,0,0,0|2,0,0]=3 386 B12R1.24 CCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210202 [0,1,0,0,0,0|3,0,0]=4 387 B12R1.24 CCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000210202 [0,1,0,0,0,0|3,0,0]=4 388 B12R1.24 CCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210202 [0,1,0,0,0,0|3,0,0]=4 389 B12R1.24 CCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210202 [0,1,0,0,0,0|3,0,0]=4 390 B12R1.24 CCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210202 [0,1,0,0,0,0|3,0,0]=4 391 B12R1.24 CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210202 [0,1,0,0,0,0|2,0,0]=3 392 B12R1.24 CCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210202 [0,1,0,0,0,0|3,0,0]=4 393 B12R1.24 CCC(=O)c1cccc(c1F)C 1458a_100000766181_100000210202 [0,1,0,0,0,0|3,0,0]=4 394 B12R1.24 CCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210202 [0,1,0,0,0,0|3,0,0]=4 395 B12R1.24 CCC(=O)c1cccc(c1F)F 1458a_100000748134_100000210202 [0,1,0,0,0,0|3,0,0]=4 396 B12R1.24 CCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210202 [0,1,0,0,0,0|3,0,0]=4 397 B12R1.24 CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210202 [0,1,0,0,0,0|2,0,0]=3 398 B12R1.24 CCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210202 [0,1,0,0,0,0|3,0,0]=4 399 B12R1.24 CCC(=O)c1cccc(c1I)C 1458a_100000739377_100000210202 [0,1,0,0,0,0|3,0,0]=4 400 B12R1.24 CCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210202 [0,1,0,0,0,0|3,0,0]=4 401 B12R1.24 CCC(=O)c1cccc(c1I)F 1458a_100000690930_100000210202 [0,1,0,0,0,0|3,0,0]=4 402 B12R1.24 CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210202 [0,1,0,0,0,0|2,0,0]=3 403 B12R1.24 CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210202 [0,1,0,0,0,0|3,0,0]=4 404 B12R1.24 CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210202 [0,1,0,0,0,0|3,0,0]=4 405 B12R1.24 CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210202 [0,1,0,0,0,0|3,0,0]=4 406 B12R1.24 CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210202 [0,1,0,0,0,0|3,0,0]=4 407 B12R1.24 CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210202 [0,1,0,0,0,0|2,0,0]=3 408 B12R1.24 CNC(=O)c1cccc(c1Br)Br 11a_106832991635_100012360534 [0,1,0,0,0,0|3,0,0]=4 409 B12R1.24 CNC(=O)c1cccc(c1Br)Br 1626a_100102657272_100012360534 [0,1,0,0,0,0|3,0,0]=4 410 B12R1.24 CNC(=O)c1cccc(c1Br)Br 240690a_100102657272_100012360534 [0,1,0,0,0,0|3,0,0]=4 411 B12R1.24 CNC(=O)c1cccc(c1Br)Br 527a_100102657272_100012360534 [0,1,0,0,0,0|3,0,0]=4 412 B12R1.24 CNC(=O)c1cccc(c1Br)C 11a_106832991635_100000692419 [0,1,0,0,0,0|3,0,0]=4 413 B12R1.24 CNC(=O)c1cccc(c1Br)C 1626a_100102657272_100000692419 [0,1,0,0,0,0|3,0,0]=4 414 B12R1.24 CNC(=O)c1cccc(c1Br)C 240690a_100102657272_100000692419 [0,1,0,0,0,0|3,0,0]=4 415 B12R1.24 CNC(=O)c1cccc(c1Br)C 527a_100102657272_100000692419 [0,1,0,0,0,0|3,0,0]=4 416 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 11a_106832991635_100012339722 [0,1,0,0,0,0|3,0,0]=4 417 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 1626a_100102657272_100012339722 [0,1,0,0,0,0|3,0,0]=4 418 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 240690a_100102657272_100012339722 [0,1,0,0,0,0|3,0,0]=4 419 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 527a_100102657272_100012339722 [0,1,0,0,0,0|3,0,0]=4 420 B12R1.24 CNC(=O)c1cccc(c1Br)F 11a_106832991635_100011217547 [0,1,0,0,0,0|3,0,0]=4 421 B12R1.24 CNC(=O)c1cccc(c1Br)F 1626a_100102657272_100011217547 [0,1,0,0,0,0|3,0,0]=4 422 B12R1.24 CNC(=O)c1cccc(c1Br)F 240690a_100102657272_100011217547 [0,1,0,0,0,0|3,0,0]=4 423 B12R1.24 CNC(=O)c1cccc(c1Br)F 527a_100102657272_100011217547 [0,1,0,0,0,0|3,0,0]=4 424 B12R1.24 CNC(=O)c1cccc(c1Br)I 11a_106832991635_100010232522 [0,1,0,0,0,0|3,0,0]=4 425 B12R1.24 CNC(=O)c1cccc(c1Br)I 1626a_100102657272_100010232522 [0,1,0,0,0,0|3,0,0]=4 426 B12R1.24 CNC(=O)c1cccc(c1Br)I 240690a_100102657272_100010232522 [0,1,0,0,0,0|3,0,0]=4 427 B12R1.24 CNC(=O)c1cccc(c1Br)I 527a_100102657272_100010232522 [0,1,0,0,0,0|3,0,0]=4 428 B12R1.24 CNC(=O)c1cccc(c1Br)O 240690a_100102657272_100010230362 [0,1,0,0,0,0|2,0,0]=3 429 B12R1.24 CNC(=O)c1cccc(c1Br)O 527a_100102657272_100010230362 [0,1,0,0,0,0|2,0,0]=3 430 B12R1.24 CNC(=O)c1cccc(c1C)Br 11a_106832991635_100000760464 [0,1,0,0,0,0|3,0,0]=4 431 B12R1.24 CNC(=O)c1cccc(c1C)Br 1626a_100102657272_100000760464 [0,1,0,0,0,0|3,0,0]=4 432 B12R1.24 CNC(=O)c1cccc(c1C)Br 240690a_100102657272_100000760464 [0,1,0,0,0,0|3,0,0]=4 433 B12R1.24 CNC(=O)c1cccc(c1C)Br 527a_100102657272_100000760464 [0,1,0,0,0,0|3,0,0]=4 434 B12R1.24 CNC(=O)c1cccc(c1C)C 11a_106832991635_100000183679 [0,1,0,0,0,0|3,0,0]=4 435 B12R1.24 CNC(=O)c1cccc(c1C)C 1626a_100102657272_100000183679 [0,1,0,0,0,0|3,0,0]=4 436 B12R1.24 CNC(=O)c1cccc(c1C)C 240690a_100102657272_100000183679 [0,1,0,0,0,0|3,0,0]=4 437 B12R1.24 CNC(=O)c1cccc(c1C)C 527a_100102657272_100000183679 [0,1,0,0,0,0|3,0,0]=4 438 B12R1.24 CNC(=O)c1cccc(c1C)Cl 11a_106832991635_100000690184 [0,1,0,0,0,0|3,0,0]=4 439 B12R1.24 CNC(=O)c1cccc(c1C)Cl 1626a_100102657272_100000690184 [0,1,0,0,0,0|3,0,0]=4 440 B12R1.24 CNC(=O)c1cccc(c1C)Cl 240690a_100102657272_100000690184 [0,1,0,0,0,0|3,0,0]=4 441 B12R1.24 CNC(=O)c1cccc(c1C)Cl 527a_100102657272_100000690184 [0,1,0,0,0,0|3,0,0]=4 442 B12R1.24 CNC(=O)c1cccc(c1C)F 11a_106832991635_100011218272 [0,1,0,0,0,0|3,0,0]=4 443 B12R1.24 CNC(=O)c1cccc(c1C)F 1626a_100102657272_100011218272 [0,1,0,0,0,0|3,0,0]=4 444 B12R1.24 CNC(=O)c1cccc(c1C)F 240690a_100102657272_100011218272 [0,1,0,0,0,0|3,0,0]=4 445 B12R1.24 CNC(=O)c1cccc(c1C)F 527a_100102657272_100011218272 [0,1,0,0,0,0|3,0,0]=4 446 B12R1.24 CNC(=O)c1cccc(c1C)I 11a_106832991635_100000751865 [0,1,0,0,0,0|3,0,0]=4 447 B12R1.24 CNC(=O)c1cccc(c1C)I 1626a_100102657272_100000751865 [0,1,0,0,0,0|3,0,0]=4 448 B12R1.24 CNC(=O)c1cccc(c1C)I 240690a_100102657272_100000751865 [0,1,0,0,0,0|3,0,0]=4 449 B12R1.24 CNC(=O)c1cccc(c1C)I 527a_100102657272_100000751865 [0,1,0,0,0,0|3,0,0]=4 450 B12R1.24 CNC(=O)c1cccc(c1C)O 240690a_100102657272_100000766327 [0,1,0,0,0,0|2,0,0]=3 451 B12R1.24 CNC(=O)c1cccc(c1C)O 527a_100102657272_100000766327 [0,1,0,0,0,0|2,0,0]=3 452 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 11a_106832991635_100000760540 [0,1,0,0,0,0|3,0,0]=4 453 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 1626a_100102657272_100000760540 [0,1,0,0,0,0|3,0,0]=4 454 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 240690a_100102657272_100000760540 [0,1,0,0,0,0|3,0,0]=4 455 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 527a_100102657272_100000760540 [0,1,0,0,0,0|3,0,0]=4 456 B12R1.24 CNC(=O)c1cccc(c1Cl)C 11a_106832991635_100000693142 [0,1,0,0,0,0|3,0,0]=4 457 B12R1.24 CNC(=O)c1cccc(c1Cl)C 1626a_100102657272_100000693142 [0,1,0,0,0,0|3,0,0]=4 458 B12R1.24 CNC(=O)c1cccc(c1Cl)C 240690a_100102657272_100000693142 [0,1,0,0,0,0|3,0,0]=4 459 B12R1.24 CNC(=O)c1cccc(c1Cl)C 527a_100102657272_100000693142 [0,1,0,0,0,0|3,0,0]=4 460 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 11a_106832991635_100000183631 [0,1,0,0,0,0|3,0,0]=4 461 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 1626a_100102657272_100000183631 [0,1,0,0,0,0|3,0,0]=4 462 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 240690a_100102657272_100000183631 [0,1,0,0,0,0|3,0,0]=4 463 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 527a_100102657272_100000183631 [0,1,0,0,0,0|3,0,0]=4 464 B12R1.24 CNC(=O)c1cccc(c1Cl)F 11a_106832991635_100000759904 [0,1,0,0,0,0|3,0,0]=4 465 B12R1.24 CNC(=O)c1cccc(c1Cl)F 1626a_100102657272_100000759904 [0,1,0,0,0,0|3,0,0]=4 466 B12R1.24 CNC(=O)c1cccc(c1Cl)F 240690a_100102657272_100000759904 [0,1,0,0,0,0|3,0,0]=4 467 B12R1.24 CNC(=O)c1cccc(c1Cl)F 527a_100102657272_100000759904 [0,1,0,0,0,0|3,0,0]=4 468 B12R1.24 CNC(=O)c1cccc(c1Cl)I 11a_106832991635_100010176783 [0,1,0,0,0,0|3,0,0]=4 469 B12R1.24 CNC(=O)c1cccc(c1Cl)I 1626a_100102657272_100010176783 [0,1,0,0,0,0|3,0,0]=4 470 B12R1.24 CNC(=O)c1cccc(c1Cl)I 240690a_100102657272_100010176783 [0,1,0,0,0,0|3,0,0]=4 471 B12R1.24 CNC(=O)c1cccc(c1Cl)I 527a_100102657272_100010176783 [0,1,0,0,0,0|3,0,0]=4 472 B12R1.24 CNC(=O)c1cccc(c1Cl)O 240690a_100102657272_100000092362 [0,1,0,0,0,0|2,0,0]=3 473 B12R1.24 CNC(=O)c1cccc(c1Cl)O 527a_100102657272_100000092362 [0,1,0,0,0,0|2,0,0]=3 474 B12R1.24 CNC(=O)c1cccc(c1F)Br 11a_106832991635_100000756403 [0,1,0,0,0,0|3,0,0]=4 475 B12R1.24 CNC(=O)c1cccc(c1F)Br 1626a_100102657272_100000756403 [0,1,0,0,0,0|3,0,0]=4 476 B12R1.24 CNC(=O)c1cccc(c1F)Br 240690a_100102657272_100000756403 [0,1,0,0,0,0|3,0,0]=4 477 B12R1.24 CNC(=O)c1cccc(c1F)Br 527a_100102657272_100000756403 [0,1,0,0,0,0|3,0,0]=4 478 B12R1.24 CNC(=O)c1cccc(c1F)C 11a_106832991635_100000766181 [0,1,0,0,0,0|3,0,0]=4 479 B12R1.24 CNC(=O)c1cccc(c1F)C 1626a_100102657272_100000766181 [0,1,0,0,0,0|3,0,0]=4 480 B12R1.24 CNC(=O)c1cccc(c1F)C 240690a_100102657272_100000766181 [0,1,0,0,0,0|3,0,0]=4 481 B12R1.24 CNC(=O)c1cccc(c1F)C 527a_100102657272_100000766181 [0,1,0,0,0,0|3,0,0]=4 482 B12R1.24 CNC(=O)c1cccc(c1F)Cl 11a_106832991635_100000688816 [0,1,0,0,0,0|3,0,0]=4 483 B12R1.24 CNC(=O)c1cccc(c1F)Cl 1626a_100102657272_100000688816 [0,1,0,0,0,0|3,0,0]=4 484 B12R1.24 CNC(=O)c1cccc(c1F)Cl 240690a_100102657272_100000688816 [0,1,0,0,0,0|3,0,0]=4 485 B12R1.24 CNC(=O)c1cccc(c1F)Cl 527a_100102657272_100000688816 [0,1,0,0,0,0|3,0,0]=4 486 B12R1.24 CNC(=O)c1cccc(c1F)F 11a_106832991635_100000748134 [0,1,0,0,0,0|3,0,0]=4 487 B12R1.24 CNC(=O)c1cccc(c1F)F 1626a_100102657272_100000748134 [0,1,0,0,0,0|3,0,0]=4 488 B12R1.24 CNC(=O)c1cccc(c1F)F 240690a_100102657272_100000748134 [0,1,0,0,0,0|3,0,0]=4 489 B12R1.24 CNC(=O)c1cccc(c1F)F 527a_100102657272_100000748134 [0,1,0,0,0,0|3,0,0]=4 490 B12R1.24 CNC(=O)c1cccc(c1F)I 11a_106832991635_100010185205 [0,1,0,0,0,0|3,0,0]=4 491 B12R1.24 CNC(=O)c1cccc(c1F)I 1626a_100102657272_100010185205 [0,1,0,0,0,0|3,0,0]=4 492 B12R1.24 CNC(=O)c1cccc(c1F)I 240690a_100102657272_100010185205 [0,1,0,0,0,0|3,0,0]=4 493 B12R1.24 CNC(=O)c1cccc(c1F)I 527a_100102657272_100010185205 [0,1,0,0,0,0|3,0,0]=4 494 B12R1.24 CNC(=O)c1cccc(c1F)O 240690a_100102657272_100000037433 [0,1,0,0,0,0|2,0,0]=3 495 B12R1.24 CNC(=O)c1cccc(c1F)O 527a_100102657272_100000037433 [0,1,0,0,0,0|2,0,0]=3 496 B12R1.24 CNC(=O)c1cccc(c1I)Br 11a_106832991635_100000688019 [0,1,0,0,0,0|3,0,0]=4 497 B12R1.24 CNC(=O)c1cccc(c1I)Br 1626a_100102657272_100000688019 [0,1,0,0,0,0|3,0,0]=4 498 B12R1.24 CNC(=O)c1cccc(c1I)Br 240690a_100102657272_100000688019 [0,1,0,0,0,0|3,0,0]=4 499 B12R1.24 CNC(=O)c1cccc(c1I)Br 527a_100102657272_100000688019 [0,1,0,0,0,0|3,0,0]=4 500 B12R1.24 CNC(=O)c1cccc(c1I)C 11a_106832991635_100000739377 [0,1,0,0,0,0|3,0,0]=4 501 B12R1.24 CNC(=O)c1cccc(c1I)C 1626a_100102657272_100000739377 [0,1,0,0,0,0|3,0,0]=4 502 B12R1.24 CNC(=O)c1cccc(c1I)C 240690a_100102657272_100000739377 [0,1,0,0,0,0|3,0,0]=4 503 B12R1.24 CNC(=O)c1cccc(c1I)C 527a_100102657272_100000739377 [0,1,0,0,0,0|3,0,0]=4 504 B12R1.24 CNC(=O)c1cccc(c1I)Cl 11a_106832991635_100010176784 [0,1,0,0,0,0|3,0,0]=4 505 B12R1.24 CNC(=O)c1cccc(c1I)Cl 1626a_100102657272_100010176784 [0,1,0,0,0,0|3,0,0]=4 506 B12R1.24 CNC(=O)c1cccc(c1I)Cl 240690a_100102657272_100010176784 [0,1,0,0,0,0|3,0,0]=4 507 B12R1.24 CNC(=O)c1cccc(c1I)Cl 527a_100102657272_100010176784 [0,1,0,0,0,0|3,0,0]=4 508 B12R1.24 CNC(=O)c1cccc(c1I)F 11a_106832991635_100000690930 [0,1,0,0,0,0|3,0,0]=4 509 B12R1.24 CNC(=O)c1cccc(c1I)F 1626a_100102657272_100000690930 [0,1,0,0,0,0|3,0,0]=4 510 B12R1.24 CNC(=O)c1cccc(c1I)F 240690a_100102657272_100000690930 [0,1,0,0,0,0|3,0,0]=4 511 B12R1.24 CNC(=O)c1cccc(c1I)F 527a_100102657272_100000690930 [0,1,0,0,0,0|3,0,0]=4 512 B12R1.24 CNC(=O)c1cccc(c1I)O 527a_100102657272_100010084636 [0,1,0,0,0,0|2,0,0]=3 513 B12R1.24 CNC(=O)c1cccc(c1O)Br 240690a_100102657272_100000752940 [0,1,0,0,0,0|3,0,0]=4 514 B12R1.24 CNC(=O)c1cccc(c1O)Br 527a_100102657272_100000752940 [0,1,0,0,0,0|3,0,0]=4 515 B12R1.24 CNC(=O)c1cccc(c1O)C 240690a_100102657272_100000183896 [0,1,0,0,0,0|3,0,0]=4 516 B12R1.24 CNC(=O)c1cccc(c1O)C 527a_100102657272_100000183896 [0,1,0,0,0,0|3,0,0]=4 517 B12R1.24 CNC(=O)c1cccc(c1O)Cl 240690a_100102657272_100000742801 [0,1,0,0,0,0|3,0,0]=4 518 B12R1.24 CNC(=O)c1cccc(c1O)Cl 527a_100102657272_100000742801 [0,1,0,0,0,0|3,0,0]=4 519 B12R1.24 CNC(=O)c1cccc(c1O)F 240690a_100102657272_100011217230 [0,1,0,0,0,0|3,0,0]=4 520 B12R1.24 CNC(=O)c1cccc(c1O)F 527a_100102657272_100011217230 [0,1,0,0,0,0|3,0,0]=4 521 B12R1.24 CNC(=O)c1cccc(c1O)O 527a_100102657272_100000690420 [0,1,0,0,0,0|2,0,0]=3 522 B12R1.24 COC(=O)c1c[nH]cc(c1=O)O 271570a_203496583355_100010873956 [0,1,0,0,0,0|2,0,0]=3 523 B12R1.24 COC(=O)c1cccc(c1Br)O 271570a_203496583355_100010240208 [0,1,0,0,0,0|1,0,0]=2 524 B12R1.24 COC(=O)c1cccc(c1C)O 271570a_203496583355_100012298220 [0,1,0,0,0,0|1,0,0]=2 525 B12R1.24 COC(=O)c1cccc(c1F)O 271570a_203496583355_100012355674 [0,1,0,0,0,0|1,0,0]=2 526 B12R1.24 COC(=O)c1cccc(c1N)O 271570a_203496583355_100011356556 [0,1,0,0,0,0|0,0,0]=1 527 B12R1.24 COC(=O)c1cccc(c1O)Br 271570a_203496583355_100010150843 [0,1,0,0,0,0|2,0,0]=3 528 B12R1.24 COC(=O)c1cccc(c1O)C 271570a_203496583355_100012002529 [0,1,0,0,0,0|2,0,0]=3 529 B12R1.24 COC(=O)c1cccc(c1O)F 271570a_203496583355_100012357630 [0,1,0,0,0,0|2,0,0]=3 530 B12R1.24 COC(=O)c1cccc(c1O)N 271570a_203496583355_100000719424 [0,1,0,0,0,0|2,0,0]=3 531 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_100009816214 [0,1,0,0,0,0|1,0,0]=2 532 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_200010230364 [0,1,0,0,0,0|1,0,0]=2 533 B12R1.24 COC(=O)c1ccnc(c1C)O 271570a_203496583355_100000087782 [0,1,0,0,0,0|2,0,0]=3 534 B12R1.24 COC(=O)c1ccnc(c1F)O 271570a_203496583355_100000081818 [0,1,0,0,0,0|2,0,0]=3 535 B12R1.24 COC(=O)c1ccnc(c1N)O 271570a_203496583355_100000067308 [0,1,0,0,0,0|1,0,0]=2 536 B12R1.24 COC(=O)c1cncc(c1C)O 271570a_203496583355_100010713144 [0,1,0,0,0,0|2,0,0]=3 537 B12R1.24 COC(=O)c1nccc(c1C)O 271570a_203496583355_100000094583 [0,1,0,0,0,0|2,0,0]=3 538 B12R1.24 COC(=O)c1nccc(c1F)O 271570a_203496583355_100000687924 [0,1,0,0,0,0|2,0,0]=3 539 B12R1.24 COC(C)c1cccc(c1F)O 271570a_203496583355_200010365929 [0,1,0,0,0,0|2,0,1]=4 540 B12R1.24 Cc1c(cccc1C(=O)CF)Br 1458a_100000760464_100015361967 [0,1,0,0,0,0|3,0,0]=4 541 B12R1.24 Cc1c(cccc1C(=O)CF)Cl 1458a_100000690184_100015361967 [0,1,0,0,0,0|3,0,0]=4 542 B12R1.24 Cc1c(cccc1C(=O)CF)F 1458a_100011218272_100015361967 [0,1,0,0,0,0|3,0,0]=4 543 B12R1.24 Cc1c(cccc1C(=O)CF)I 1458a_100000751865_100015361967 [0,1,0,0,0,0|3,0,0]=4 544 B12R1.24 Cc1c(cccc1C(=O)CF)O 1458a_100000766327_100015361967 [0,1,0,0,0,0|2,0,0]=3 545 B12R1.24 Cc1c(cccc1C(=O)NN)O 271570a_203496583355_200012298103 [0,1,0,0,0,0|2,0,0]=3 546 B12R1.24 Cc1cccc(c1Br)C(=O)CF 1458a_100000692419_100015361967 [0,1,0,0,0,0|3,0,0]=4 547 B12R1.24 Cc1cccc(c1C)C(=O)CF 1458a_100000183679_100015361967 [0,1,0,0,0,0|3,0,0]=4 548 B12R1.24 Cc1cccc(c1Cl)C(=O)CF 1458a_100000693142_100015361967 [0,1,0,0,0,0|3,0,0]=4 549 B12R1.24 Cc1cccc(c1F)C(=O)CF 1458a_100000766181_100015361967 [0,1,0,0,0,0|3,0,0]=4 550 B12R1.24 Cc1cccc(c1I)C(=O)CF 1458a_100000739377_100015361967 [0,1,0,0,0,0|3,0,0]=4 551 B12R1.24 Cc1cccc(c1O)C(=O)CF 1458a_100000183896_100015361967 [0,1,0,0,0,0|3,0,0]=4 552 B12R1.24 O=C(CF)c1cccc(c1Br)Br 1458a_100012360534_100015361967 [0,1,0,0,0,0|3,0,0]=4 553 B12R1.24 O=C(CF)c1cccc(c1Br)Cl 1458a_100012339722_100015361967 [0,1,0,0,0,0|3,0,0]=4 554 B12R1.24 O=C(CF)c1cccc(c1Br)F 1458a_100011217547_100015361967 [0,1,0,0,0,0|3,0,0]=4 555 B12R1.24 O=C(CF)c1cccc(c1Br)I 1458a_100010232522_100015361967 [0,1,0,0,0,0|3,0,0]=4 556 B12R1.24 O=C(CF)c1cccc(c1Br)O 1458a_100010230362_100015361967 [0,1,0,0,0,0|2,0,0]=3 557 B12R1.24 O=C(CF)c1cccc(c1Cl)Br 1458a_100000760540_100015361967 [0,1,0,0,0,0|3,0,0]=4 558 B12R1.24 O=C(CF)c1cccc(c1Cl)Cl 1458a_100000183631_100015361967 [0,1,0,0,0,0|3,0,0]=4 559 B12R1.24 O=C(CF)c1cccc(c1Cl)F 1458a_100000759904_100015361967 [0,1,0,0,0,0|3,0,0]=4 560 B12R1.24 O=C(CF)c1cccc(c1Cl)I 1458a_100010176783_100015361967 [0,1,0,0,0,0|3,0,0]=4 561 B12R1.24 O=C(CF)c1cccc(c1Cl)O 1458a_100000092362_100015361967 [0,1,0,0,0,0|2,0,0]=3 562 B12R1.24 O=C(CF)c1cccc(c1F)Br 1458a_100000756403_100015361967 [0,1,0,0,0,0|3,0,0]=4 563 B12R1.24 O=C(CF)c1cccc(c1F)Cl 1458a_100000688816_100015361967 [0,1,0,0,0,0|3,0,0]=4 564 B12R1.24 O=C(CF)c1cccc(c1F)F 1458a_100000748134_100015361967 [0,1,0,0,0,0|3,0,0]=4 565 B12R1.24 O=C(CF)c1cccc(c1F)I 1458a_100010185205_100015361967 [0,1,0,0,0,0|3,0,0]=4 566 B12R1.24 O=C(CF)c1cccc(c1F)O 1458a_100000037433_100015361967 [0,1,0,0,0,0|2,0,0]=3 567 B12R1.24 O=C(CF)c1cccc(c1I)Br 1458a_100000688019_100015361967 [0,1,0,0,0,0|3,0,0]=4 568 B12R1.24 O=C(CF)c1cccc(c1I)Cl 1458a_100010176784_100015361967 [0,1,0,0,0,0|3,0,0]=4 569 B12R1.24 O=C(CF)c1cccc(c1I)F 1458a_100000690930_100015361967 [0,1,0,0,0,0|3,0,0]=4 570 B12R1.24 O=C(CF)c1cccc(c1I)O 1458a_100010084636_100015361967 [0,1,0,0,0,0|2,0,0]=3 571 B12R1.24 O=C(CF)c1cccc(c1O)Br 1458a_100000752940_100015361967 [0,1,0,0,0,0|3,0,0]=4 572 B12R1.24 O=C(CF)c1cccc(c1O)Cl 1458a_100000742801_100015361967 [0,1,0,0,0,0|3,0,0]=4 573 B12R1.24 O=C(CF)c1cccc(c1O)F 1458a_100011217230_100015361967 [0,1,0,0,0,0|3,0,0]=4 574 B12R1.24 O=C(CF)c1cccc(c1O)O 1458a_100000690420_100015361967 [0,1,0,0,0,0|2,0,0]=3 575 B12R1.87 C=C(C)c1cccc(c1C#N)O 271570a_100000694244_100012180507 [0,1,0,0,0,0|2,0,1]=4 576 B12R1.87 C=C(C)c1cccc(c1C=O)O 271570a_100000694244_100009814793 [0,1,0,0,0,0|3,0,0]=4 577 B12R1.87 C=C(C)c1cccc(c1CN)F 271570a_100000694244_100012349121 [0,1,0,0,0,0|3,0,0]=4 578 B12R1.87 C=C(C)c1cccc(c1NC)N 271570a_100000694244_100010510394 [0,1,0,0,0,0|3,0,0]=4 579 B12R1.87 C=C(C)c1cccc(c1NN)F 271570a_100000694244_100016994982 [0,1,0,0,0,0|3,0,0]=4 580 B12R1.87 C=C(C)c1cccc(c1OC)O 271570a_100000694244_100010234590 [0,1,0,0,0,0|3,0,0]=4 581 B12R1.87 C=Cc1c(cccc1C(=O)C)F 271570a_100011290941_100012362612 [0,1,0,0,0,0|3,0,0]=4 582 B12R1.87 C=Cc1c(cccc1C(=O)N)C 271570a_100011290941_200011409216 [0,1,0,0,0,0|3,0,0]=4 583 B12R1.87 C=Cc1c(cccc1C(=O)N)F 271570a_100011290941_200012351544 [0,1,0,0,0,0|3,0,0]=4 584 B12R1.87 CC(=O)c1cccc(c1C#N)F 1458a_100000702252_200000210301 [0,1,0,0,0,0|2,0,1]=4 585 B12R1.87 CC(=O)c1cccc(c1O[13CH3])C 34a_100009847209_200025704644 [0,1,0,0,0,0|3,0,0]=4 586 B12R1.87 CC(=O)c1cccc(c1O[13CH3])C 7a_100009847209_200025704644 [0,1,0,0,0,0|3,0,0]=4 587 B12R1.87 CC(=O)c1cccc(c1O[13CH3])Cl 34a_100000043392_200025704644 [0,1,0,0,0,0|3,0,0]=4 588 B12R1.87 CC(=O)c1cccc(c1O[13CH3])Cl 7a_100000043392_200025704644 [0,1,0,0,0,0|3,0,0]=4 589 B12R1.87 CC(=O)c1cccc(c1O[13CH3])F 34a_100011246037_200025704644 [0,1,0,0,0,0|3,0,0]=4 590 B12R1.87 CC(=O)c1cccc(c1O[13CH3])F 7a_100011246037_200025704644 [0,1,0,0,0,0|3,0,0]=4 591 B12R1.87 CC(=O)c1cccc(c1S[13CH3])F 62a_100012362612_200025704644 [0,1,0,0,0,0|3,0,0]=4 592 B12R1.87 CC(=O)c1cccc(c1S[13CH3])F 62a_200025704644_100012362612 [0,1,0,0,0,0|3,0,0]=4 593 B12R1.87 CCc1c(cccc1C(=O)C)Br 1458a_100010125490_200000210301 [0,1,0,0,0,0|3,0,0]=4 594 B12R1.87 CCc1c(cccc1C(=O)[13CH3])Br 1458a_100010125490_200025704644 [0,1,0,0,0,0|3,0,0]=4 595 B12R1.87 CNc1c(cccc1C(=O)N)C 34a_100000223273_200000210301 [0,1,0,0,0,0|2,0,0]=3 596 B12R1.87 CNc1c(cccc1C(=O)N)Cl 34a_200011997947_200000210301 [0,1,0,0,0,0|2,0,0]=3 597 B12R1.87 CNc1c(cccc1C(=O)N)F 34a_100011722151_200000210301 [0,1,0,0,0,0|2,0,0]=3 598 B12R1.87 CNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_200000210301 [0,1,0,0,0,0|2,0,1]=4 599 B12R1.87 COc1c(cccc1B(O)O)O 271570a_203496583355_100010078571 [0,1,0,0,0,0|2,0,1]=4 600 B12R1.87 COc1c(cccc1C(=O)C)Br 1458a_100000689802_200000210301 [0,1,0,0,0,0|3,0,0]=4 601 B12R1.87 COc1c(cccc1C(=O)C)C 1458a_100000187929_200000210301 [0,1,0,0,0,0|3,0,0]=4 602 B12R1.87 COc1c(cccc1C(=O)C)C 34a_100009847209_200000210301 [0,1,0,0,0,0|3,0,0]=4 603 B12R1.87 COc1c(cccc1C(=O)C)C 7a_100009847209_200000210301 [0,1,0,0,0,0|3,0,0]=4 604 B12R1.87 COc1c(cccc1C(=O)C)Cl 1458a_100011934004_200000210301 [0,1,0,0,0,0|3,0,0]=4 605 B12R1.87 COc1c(cccc1C(=O)C)Cl 34a_100000043392_200000210301 [0,1,0,0,0,0|3,0,0]=4 606 B12R1.87 COc1c(cccc1C(=O)C)Cl 7a_100000043392_200000210301 [0,1,0,0,0,0|3,0,0]=4 607 B12R1.87 COc1c(cccc1C(=O)C)F 1458a_100011218433_200000210301 [0,1,0,0,0,0|3,0,0]=4 608 B12R1.87 COc1c(cccc1C(=O)C)F 34a_100011246037_200000210301 [0,1,0,0,0,0|3,0,0]=4 609 B12R1.87 COc1c(cccc1C(=O)C)F 7a_100011246037_200000210301 [0,1,0,0,0,0|3,0,0]=4 610 B12R1.87 COc1c(cccc1C(=O)C)O 1458a_100000080799_200000210301 [0,1,0,0,0,0|2,0,0]=3 611 B12R1.87 COc1c(cccc1C(=O)C)O 271570a_203496583355_100010725610 [0,1,0,0,0,0|2,0,0]=3 612 B12R1.87 COc1c(cccc1C(=O)N)Cl 34a_100009868166_200000210301 [0,1,0,0,0,0|3,0,0]=4 613 B12R1.87 COc1c(cccc1C(=O)N)Cl 7a_100009868166_200000210301 [0,1,0,0,0,0|3,0,0]=4 614 B12R1.87 COc1c(cccc1C(=O)N)F 34a_100009886295_200000210301 [0,1,0,0,0,0|3,0,0]=4 615 B12R1.87 COc1c(cccc1C(=O)N)F 7a_100009886295_200000210301 [0,1,0,0,0,0|3,0,0]=4 616 B12R1.87 COc1c(cccc1C(=O)N)O 271570a_203496583355_100010146779 [0,1,0,0,0,0|2,0,0]=3 617 B12R1.87 COc1c(cccc1C(=O)[13CH3])Br 1458a_100000689802_200025704644 [0,1,0,0,0,0|3,0,0]=4 618 B12R1.87 COc1c(cccc1C(=O)[13CH3])C 1458a_100000187929_200025704644 [0,1,0,0,0,0|3,0,0]=4 619 B12R1.87 COc1c(cccc1C(=O)[13CH3])Cl 1458a_100011934004_200025704644 [0,1,0,0,0,0|3,0,0]=4 620 B12R1.87 COc1c(cccc1C(=O)[13CH3])F 1458a_100011218433_200025704644 [0,1,0,0,0,0|3,0,0]=4 621 B12R1.87 COc1c(cccc1C(=O)[13CH3])O 1458a_100000080799_200025704644 [0,1,0,0,0,0|2,0,0]=3 622 B12R1.87 CSc1c(cccc1C(=O)C)F 62a_100012362612_200000210301 [0,1,0,0,0,0|3,0,0]=4 623 B12R1.87 CSc1c(cccc1C(=O)C)F 62a_200000210301_100012362612 [0,1,0,0,0,0|3,0,0]=4 624 B12R1.87 CSc1c(cccc1C(=O)N)C 62a_200000210301_200011409216 [0,1,0,0,0,0|3,0,0]=4 625 B12R1.87 CSc1c(cccc1C(=O)N)C 62a_200011409216_200000210301 [0,1,0,0,0,0|3,0,0]=4 626 B12R1.87 CSc1c(cccc1C(=O)N)F 62a_200000210301_200012351544 [0,1,0,0,0,0|3,0,0]=4 627 B12R1.87 CSc1c(cccc1C(=O)N)F 62a_200012351544_200000210301 [0,1,0,0,0,0|3,0,0]=4 628 B12R1.87 Cc1cccc(c1N[13CH3])C(=O)N 34a_100000223273_200025704644 [0,1,0,0,0,0|2,0,0]=3 629 B12R1.87 Cc1cccc(c1S[13CH3])C(=O)N 62a_200011409216_200025704644 [0,1,0,0,0,0|3,0,0]=4 630 B12R1.87 Cc1cccc(c1S[13CH3])C(=O)N 62a_200025704644_200011409216 [0,1,0,0,0,0|3,0,0]=4 631 B12R1.87 N#Cc1c(cccc1B(O)O)O 271570a_203496583355_100010231474 [0,1,0,0,0,0|1,0,2]=4 632 B12R1.87 O=Cc1c(cccc1B(O)O)O 271570a_203496583355_100009861587 [0,1,0,0,0,0|2,0,1]=4 633 B12R1.87 [13CH3]C(=O)c1cccc(c1C#N)F 1458a_100000702252_200025704644 [0,1,0,0,0,0|2,0,1]=4 634 B12R1.87 [13CH3]Nc1c(cccc1C(=O)N)Cl 34a_200011997947_200025704644 [0,1,0,0,0,0|2,0,0]=3 635 B12R1.87 [13CH3]Nc1c(cccc1C(=O)N)F 34a_100011722151_200025704644 [0,1,0,0,0,0|2,0,0]=3 636 B12R1.87 [13CH3]Nc1c(cccc1[N+](=O)[O-])F 34a_100000687224_200025704644 [0,1,0,0,0,0|2,0,1]=4 637 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)Cl 34a_100009868166_200025704644 [0,1,0,0,0,0|3,0,0]=4 638 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)Cl 7a_100009868166_200025704644 [0,1,0,0,0,0|3,0,0]=4 639 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)F 34a_100009886295_200025704644 [0,1,0,0,0,0|3,0,0]=4 640 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)F 7a_100009886295_200025704644 [0,1,0,0,0,0|3,0,0]=4 641 B12R1.87 [13CH3]Sc1c(cccc1C(=O)N)F 62a_200012351544_200025704644 [0,1,0,0,0,0|3,0,0]=4 642 B12R1.87 [13CH3]Sc1c(cccc1C(=O)N)F 62a_200025704644_200012351544 [0,1,0,0,0,0|3,0,0]=4 643 B12R1.228 NS(=O)(=O)c1cccc(c1F)O 271570a_203496583355_100011217397 [0,1,0,0,0,0|2,0,1]=4 644 B12R1.228 Nc1c(cccc1C(F)(F)F)O 271570a_203496583355_100010199007 [0,1,0,0,0,0|2,0,1]=4 645 B12R1.440 C=C(C)c1cccc(c1Br)CO 271570a_100000694244_100010240205 [0,1,0,0,0,0|3,0,0]=4 646 B12R1.440 C=C(C)c1cccc(c1C)CO 271570a_100000694244_100000694458 [0,1,0,0,0,0|3,0,0]=4 647 B12R1.440 C=C(C)c1cccc(c1C)OC 271570a_100000694244_100010002647 [0,1,0,0,0,0|3,0,0]=4 648 B12R1.440 C=C(C)c1cccc(c1Cl)OC 271570a_100000694244_100010147677 [0,1,0,0,0,0|3,0,0]=4 649 B12R1.440 C=C(C)c1cccc(c1F)CO 271570a_100000694244_100011935076 [0,1,0,0,0,0|3,0,0]=4 650 B12R1.440 C=C(C)c1cccc(c1F)OC 271570a_100000694244_100010185846 [0,1,0,0,0,0|3,0,0]=4 651 B12R1.440 C=C(C)c1cccc(c1N)C#N 271570a_100000694244_100000690598 [0,1,0,0,0,0|3,0,0]=4 652 B12R1.440 C=C(C)c1cccc(c1N)C=O 271570a_100000694244_100010144990 [0,1,0,0,0,0|2,0,1]=4 653 B12R1.440 C=C(C)c1cccc(c1N)CO 271570a_100000694244_100012349457 [0,1,0,0,0,0|2,0,0]=3 654 B12R1.440 C=C(C)c1cccc(c1N)NC 271570a_100000694244_100000695761 [0,1,0,0,0,0|3,0,0]=4 655 B12R1.440 C=C(C)c1cccc(c1N)OC 271570a_100000694244_100000708083 [0,1,0,0,0,0|2,0,0]=3 656 B12R1.440 C=C(C)c1cccc(c1O)OC 271570a_100000694244_100000686866 [0,1,0,0,0,0|3,0,0]=4 657 B12R1.440 C=C(C)c1cncc(c1N)CO 271570a_100000694244_200010988789 [0,1,0,0,0,0|3,0,0]=4 658 B12R1.440 C=C(C)c1nccc(c1N)OC 271570a_100000694244_100000100113 [0,1,0,0,0,0|3,0,0]=4 659 B12R1.440 C=Cc1cccc(c1C)C(=O)C 271570a_100011290941_100012706834 [0,1,0,0,0,0|3,0,0]=4 660 B12R1.440 C=Cc1cccc(c1C)C(=O)N 271570a_100011290941_200012298201 [0,1,0,0,0,0|3,0,0]=4 661 B12R1.440 C=Cc1cccc(c1F)C(=O)C 271570a_100011290941_100012355707 [0,1,0,0,0,0|3,0,0]=4 662 B12R1.440 C=Cc1cccc(c1F)C(=O)N 271570a_100011290941_100012351131 [0,1,0,0,0,0|3,0,0]=4 663 B12R1.440 C=Cc1cccc(c1N)C(=O)N 271570a_100011290941_100010144993 [0,1,0,0,0,0|2,0,0]=3 664 B12R1.440 C=Cc1cccc(c1O)C(=O)C 271570a_100011290941_100009815558 [0,1,0,0,0,0|3,0,0]=4 665 B12R1.440 C=Cc1nccc(c1N)C(=O)C 271570a_100011290941_200000063496 [0,1,0,0,0,0|3,0,0]=4 666 B12R1.440 C=Cc1nccc(c1N)C(=O)N 271570a_100011290941_100000080204 [0,1,0,0,0,0|3,0,0]=4 667 B12R1.440 CC(=O)c1cccc(c1C)O[13CH3] 34a_200009877264_200025704644 [0,1,0,0,0,0|2,0,0]=3 668 B12R1.440 CC(=O)c1cccc(c1C)O[13CH3] 7a_200009877264_200025704644 [0,1,0,0,0,0|2,0,0]=3 669 B12R1.440 CC(=O)c1cccc(c1C)S[13CH3] 62a_100012706834_200025704644 [0,1,0,0,0,0|2,1,0]=4 670 B12R1.440 CC(=O)c1cccc(c1C)S[13CH3] 62a_200025704644_100012706834 [0,1,0,0,0,0|2,1,0]=4 671 B12R1.440 CC(=O)c1cccc(c1Cl)C#N 1458a_100009860865_200000210301 [0,1,0,0,0,0|3,0,0]=4 672 B12R1.440 CC(=O)c1cccc(c1F)C#N 1458a_100011999812_200000210301 [0,1,0,0,0,0|3,0,0]=4 673 B12R1.440 CC(=O)c1cccc(c1F)O[13CH3] 34a_100009856408_200025704644 [0,1,0,0,0,0|2,0,0]=3 674 B12R1.440 CC(=O)c1cccc(c1F)O[13CH3] 7a_100009856408_200025704644 [0,1,0,0,0,0|2,0,0]=3 675 B12R1.440 CC(=O)c1cccc(c1F)S[13CH3] 62a_100012355707_200025704644 [0,1,0,0,0,0|2,1,0]=4 676 B12R1.440 CC(=O)c1cccc(c1F)S[13CH3] 62a_200025704644_100012355707 [0,1,0,0,0,0|2,1,0]=4 677 B12R1.440 CC(=O)c1cccc(c1N)O[13CH3] 7a_100000036053_200025704644 [0,1,0,0,0,0|1,0,0]=2 678 B12R1.440 CC(=O)c1cccc(c1O)C#N 1458a_100009886288_200000210301 [0,1,0,0,0,0|3,0,0]=4 679 B12R1.440 CC(=O)c1ccnc(c1N)S[13CH3] 62a_200000063496_200025704644 [0,1,0,0,0,0|2,1,0]=4 680 B12R1.440 CC(=O)c1ccnc(c1N)S[13CH3] 62a_200025704644_200000063496 [0,1,0,0,0,0|2,1,0]=4 681 B12R1.440 CNc1cccc(c1C)C(=O)N 34a_100000738810_200000210301 [0,1,0,0,0,0|3,0,0]=4 682 B12R1.440 CNc1cccc(c1C)C(=O)N 7a_100000738810_200000210301 [0,1,0,0,0,0|3,0,0]=4 683 B12R1.440 CNc1cccc(c1F)C(=O)N 34a_100014075672_200000210301 [0,1,0,0,0,0|3,0,0]=4 684 B12R1.440 COc1cccc(c1Br)C(=O)C 1458a_100010245468_200000210301 [0,1,0,0,0,0|2,0,0]=3 685 B12R1.440 COc1cccc(c1Br)C(=O)[13CH3] 1458a_100010245468_200025704644 [0,1,0,0,0,0|2,0,0]=3 686 B12R1.440 COc1cccc(c1Br)[N+](=O)[O-] 34a_100010197803_200000210301 [0,1,0,0,0,0|2,0,1]=4 687 B12R1.440 COc1cccc(c1Br)[N+](=O)[O-] 7a_100010197803_200000210301 [0,1,0,0,0,0|2,0,1]=4 688 B12R1.440 COc1cccc(c1C)C(=O)C 1458a_100011217801_200000210301 [0,1,0,0,0,0|2,0,0]=3 689 B12R1.440 COc1cccc(c1C)C(=O)C 34a_200009877264_200000210301 [0,1,0,0,0,0|2,0,0]=3 690 B12R1.440 COc1cccc(c1C)C(=O)C 7a_200009877264_200000210301 [0,1,0,0,0,0|2,0,0]=3 691 B12R1.440 COc1cccc(c1C)C(=O)[13CH3] 1458a_100011217801_200025704644 [0,1,0,0,0,0|2,0,0]=3 692 B12R1.440 COc1cccc(c1C)[N+](=O)[O-] 34a_100000740326_200000210301 [0,1,0,0,0,0|2,0,1]=4 693 B12R1.440 COc1cccc(c1C)[N+](=O)[O-] 7a_100000740326_200000210301 [0,1,0,0,0,0|2,0,1]=4 694 B12R1.440 COc1cccc(c1Cl)C(=O)C 1458a_100000068443_200000210301 [0,1,0,0,0,0|2,0,0]=3 695 B12R1.440 COc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000068443_200025704644 [0,1,0,0,0,0|2,0,0]=3 696 B12R1.440 COc1cccc(c1Cl)[N+](=O)[O-] 34a_100012001863_200000210301 [0,1,0,0,0,0|2,0,1]=4 697 B12R1.440 COc1cccc(c1Cl)[N+](=O)[O-] 7a_100012001863_200000210301 [0,1,0,0,0,0|2,0,1]=4 698 B12R1.440 COc1cccc(c1F)C(=O)C 1458a_100000766180_200000210301 [0,1,0,0,0,0|2,0,0]=3 699 B12R1.440 COc1cccc(c1F)C(=O)C 34a_100009856408_200000210301 [0,1,0,0,0,0|2,0,0]=3 700 B12R1.440 COc1cccc(c1F)C(=O)C 7a_100009856408_200000210301 [0,1,0,0,0,0|2,0,0]=3 701 B12R1.440 COc1cccc(c1F)C(=O)N 34a_100009841371_200000210301 [0,1,0,0,0,0|2,0,0]=3 702 B12R1.440 COc1cccc(c1F)C(=O)N 7a_100009841371_200000210301 [0,1,0,0,0,0|2,0,0]=3 703 B12R1.440 COc1cccc(c1F)C(=O)[13CH3] 1458a_100000766180_200025704644 [0,1,0,0,0,0|2,0,0]=3 704 B12R1.440 COc1cccc(c1F)[N+](=O)[O-] 34a_100000100933_200000210301 [0,1,0,0,0,0|2,0,1]=4 705 B12R1.440 COc1cccc(c1F)[N+](=O)[O-] 7a_100000100933_200000210301 [0,1,0,0,0,0|2,0,1]=4 706 B12R1.440 COc1cccc(c1I)C(=O)C 1458a_100010075502_200000210301 [0,1,0,0,0,0|2,0,0]=3 707 B12R1.440 COc1cccc(c1I)C(=O)[13CH3] 1458a_100010075502_200025704644 [0,1,0,0,0,0|2,0,0]=3 708 B12R1.440 COc1cccc(c1I)[N+](=O)[O-] 7a_100010176071_200000210301 [0,1,0,0,0,0|2,0,1]=4 709 B12R1.440 COc1cccc(c1N)C(=O)C 7a_100000036053_200000210301 [0,1,0,0,0,0|1,0,0]=2 710 B12R1.440 COc1cccc(c1N)[N+](=O)[O-] 7a_100000739591_200000210301 [0,1,0,0,0,0|1,0,1]=3 711 B12R1.440 COc1cccc(c1O)C(=O)C 1458a_100000212136_200000210301 [0,1,0,0,0,0|2,0,0]=3 712 B12R1.440 COc1cccc(c1O)C(=O)[13CH3] 1458a_100000212136_200025704644 [0,1,0,0,0,0|2,0,0]=3 713 B12R1.440 CSc1cccc(c1C)C(=O)C 62a_100012706834_200000210301 [0,1,0,0,0,0|2,1,0]=4 714 B12R1.440 CSc1cccc(c1C)C(=O)C 62a_200000210301_100012706834 [0,1,0,0,0,0|2,1,0]=4 715 B12R1.440 CSc1cccc(c1C)C(=O)N 62a_200000210301_200012298201 [0,1,0,0,0,0|2,1,0]=4 716 B12R1.440 CSc1cccc(c1C)C(=O)N 62a_200012298201_200000210301 [0,1,0,0,0,0|2,1,0]=4 717 B12R1.440 CSc1cccc(c1F)C(=O)C 62a_100012355707_200000210301 [0,1,0,0,0,0|2,1,0]=4 718 B12R1.440 CSc1cccc(c1F)C(=O)C 62a_200000210301_100012355707 [0,1,0,0,0,0|2,1,0]=4 719 B12R1.440 CSc1cccc(c1F)C(=O)N 62a_100012351131_200000210301 [0,1,0,0,0,0|2,1,0]=4 720 B12R1.440 CSc1cccc(c1F)C(=O)N 62a_200000210301_100012351131 [0,1,0,0,0,0|2,1,0]=4 721 B12R1.440 CSc1cccc(c1N)C(=O)N 62a_100010144993_200000210301 [0,1,0,0,0,0|1,1,0]=3 722 B12R1.440 CSc1nccc(c1N)C(=O)C 62a_200000063496_200000210301 [0,1,0,0,0,0|2,1,0]=4 723 B12R1.440 CSc1nccc(c1N)C(=O)C 62a_200000210301_200000063496 [0,1,0,0,0,0|2,1,0]=4 724 B12R1.440 CSc1nccc(c1N)C(=O)N 62a_100000080204_200000210301 [0,1,0,0,0,0|2,1,0]=4 725 B12R1.440 CSc1nccc(c1N)C(=O)N 62a_200000210301_100000080204 [0,1,0,0,0,0|2,1,0]=4 726 B12R1.440 Cc1c(cccc1C(=O)N)N[13CH3] 34a_100000738810_200025704644 [0,1,0,0,0,0|3,0,0]=4 727 B12R1.440 Cc1c(cccc1C(=O)N)N[13CH3] 7a_100000738810_200025704644 [0,1,0,0,0,0|3,0,0]=4 728 B12R1.440 Cc1c(cccc1C(=O)N)S[13CH3] 62a_200012298201_200025704644 [0,1,0,0,0,0|2,1,0]=4 729 B12R1.440 Cc1c(cccc1C(=O)N)S[13CH3] 62a_200025704644_200012298201 [0,1,0,0,0,0|2,1,0]=4 730 B12R1.440 Cc1c(cccc1[N+](=O)[O-])O[13CH3] 34a_100000740326_200025704644 [0,1,0,0,0,0|2,0,1]=4 731 B12R1.440 Cc1c(cccc1[N+](=O)[O-])O[13CH3] 7a_100000740326_200025704644 [0,1,0,0,0,0|2,0,1]=4 732 B12R1.440 [13CH3]C(=O)c1cccc(c1Cl)C#N 1458a_100009860865_200025704644 [0,1,0,0,0,0|3,0,0]=4 733 B12R1.440 [13CH3]C(=O)c1cccc(c1F)C#N 1458a_100011999812_200025704644 [0,1,0,0,0,0|3,0,0]=4 734 B12R1.440 [13CH3]C(=O)c1cccc(c1O)C#N 1458a_100009886288_200025704644 [0,1,0,0,0,0|3,0,0]=4 735 B12R1.440 [13CH3]Nc1cccc(c1F)C(=O)N 34a_100014075672_200025704644 [0,1,0,0,0,0|3,0,0]=4 736 B12R1.440 [13CH3]Oc1cccc(c1Br)[N+](=O)[O-] 34a_100010197803_200025704644 [0,1,0,0,0,0|2,0,1]=4 737 B12R1.440 [13CH3]Oc1cccc(c1Br)[N+](=O)[O-] 7a_100010197803_200025704644 [0,1,0,0,0,0|2,0,1]=4 738 B12R1.440 [13CH3]Oc1cccc(c1Cl)[N+](=O)[O-] 34a_100012001863_200025704644 [0,1,0,0,0,0|2,0,1]=4 739 B12R1.440 [13CH3]Oc1cccc(c1Cl)[N+](=O)[O-] 7a_100012001863_200025704644 [0,1,0,0,0,0|2,0,1]=4 740 B12R1.440 [13CH3]Oc1cccc(c1F)C(=O)N 34a_100009841371_200025704644 [0,1,0,0,0,0|2,0,0]=3 741 B12R1.440 [13CH3]Oc1cccc(c1F)C(=O)N 7a_100009841371_200025704644 [0,1,0,0,0,0|2,0,0]=3 742 B12R1.440 [13CH3]Oc1cccc(c1F)[N+](=O)[O-] 34a_100000100933_200025704644 [0,1,0,0,0,0|2,0,1]=4 743 B12R1.440 [13CH3]Oc1cccc(c1F)[N+](=O)[O-] 7a_100000100933_200025704644 [0,1,0,0,0,0|2,0,1]=4 744 B12R1.440 [13CH3]Oc1cccc(c1I)[N+](=O)[O-] 7a_100010176071_200025704644 [0,1,0,0,0,0|2,0,1]=4 745 B12R1.440 [13CH3]Oc1cccc(c1N)[N+](=O)[O-] 7a_100000739591_200025704644 [0,1,0,0,0,0|1,0,1]=3 746 B12R1.440 [13CH3]Sc1cccc(c1F)C(=O)N 62a_100012351131_200025704644 [0,1,0,0,0,0|2,1,0]=4 747 B12R1.440 [13CH3]Sc1cccc(c1F)C(=O)N 62a_200025704644_100012351131 [0,1,0,0,0,0|2,1,0]=4 748 B12R1.440 [13CH3]Sc1cccc(c1N)C(=O)N 62a_100010144993_200025704644 [0,1,0,0,0,0|1,1,0]=3 749 B12R1.440 [13CH3]Sc1nccc(c1N)C(=O)N 62a_100000080204_200025704644 [0,1,0,0,0,0|2,1,0]=4 750 B12R1.440 [13CH3]Sc1nccc(c1N)C(=O)N 62a_200025704644_100000080204 [0,1,0,0,0,0|2,1,0]=4 751 B12R1.511 C=C(C)c1cc(cc(c1N)Br)Cl 271570a_100000694244_200012970264 [0,1,0,0,0,0|3,0,0]=4 752 B12R1.511 C=C(C)c1cc(cc(c1N)C)Br 271570a_100000694244_200000690823 [0,1,0,0,0,0|3,0,0]=4 753 B12R1.511 C=C(C)c1cc(cc(c1N)C)C 271570a_100000694244_100000688863 [0,1,0,0,0,0|3,0,0]=4 754 B12R1.511 C=C(C)c1cc(cc(c1N)C)Cl 271570a_100000694244_100012344046 [0,1,0,0,0,0|3,0,0]=4 755 B12R1.511 C=C(C)c1cc(cc(c1N)C)F 271570a_100000694244_100011216670 [0,1,0,0,0,0|3,0,0]=4 756 B12R1.511 C=C(C)c1cc(cc(c1N)Cl)Cl 271570a_100000694244_100011216899 [0,1,0,0,0,0|3,0,0]=4 757 B12R1.511 C=C(C)c1cc(cc(c1N)F)Br 271570a_100000694244_100012970276 [0,1,0,0,0,0|3,0,0]=4 758 B12R1.511 C=C(C)c1cc(cc(c1N)F)C 271570a_100000694244_100012353694 [0,1,0,0,0,0|3,0,0]=4 759 B12R1.511 C=C(C)c1cc(cc(c1N)F)Cl 271570a_100000694244_100011214900 [0,1,0,0,0,0|3,0,0]=4 760 B12R1.511 C=C(C)c1cc(cc(c1N)F)F 271570a_100000694244_100000211602 [0,1,0,0,0,0|3,0,0]=4 761 B12R1.511 C=C(C)c1cc(cc(c1N)N)C 271570a_100000694244_100012348275 [0,1,0,0,0,0|3,0,0]=4 762 B12R1.511 C=C(C)c1cc(cc(c1N)N)F 271570a_100000694244_100011934818 [0,1,0,0,0,0|3,0,0]=4 763 B12R1.511 CC(=O)c1cc(cc(c1Br)Br)C 1458a_200012920551_200000210301 [0,1,0,0,0,0|3,0,0]=4 764 B12R1.511 CC(=O)c1cc(cc(c1Br)C)C 1458a_200000701928_200000210301 [0,1,0,0,0,0|3,0,0]=4 765 B12R1.511 CC(=O)c1cc(cc(c1Br)F)F 1458a_100010209673_200000210301 [0,1,0,0,0,0|3,0,0]=4 766 B12R1.511 CC(=O)c1cc(cc(c1C)Br)Br 1458a_100012356187_200000210301 [0,1,0,0,0,0|3,0,0]=4 767 B12R1.511 CC(=O)c1cc(cc(c1C)Br)F 1458a_100012347597_200000210301 [0,1,0,0,0,0|3,0,0]=4 768 B12R1.511 CC(=O)c1cc(cc(c1C)C)Br 1458a_100012920495_200000210301 [0,1,0,0,0,0|3,0,0]=4 769 B12R1.511 CC(=O)c1cc(cc(c1C)Cl)Br 1458a_100012921640_200000210301 [0,1,0,0,0,0|3,0,0]=4 770 B12R1.511 CC(=O)c1cc(cc(c1C)Cl)F 1458a_100012177191_200000210301 [0,1,0,0,0,0|3,0,0]=4 771 B12R1.511 CC(=O)c1cc(cc(c1C)F)Br 1458a_100010768523_200000210301 [0,1,0,0,0,0|3,0,0]=4 772 B12R1.511 CC(=O)c1cc(cc(c1C)O)Br 1458a_100011101721_200000210301 [0,1,0,0,0,0|2,0,0]=3 773 B12R1.511 CC(=O)c1cc(cc(c1Cl)Br)Cl 1458a_200012920481_200000210301 [0,1,0,0,0,0|3,0,0]=4 774 B12R1.511 CC(=O)c1cc(cc(c1Cl)Br)F 1458a_100011105905_200000210301 [0,1,0,0,0,0|3,0,0]=4 775 B12R1.511 CC(=O)c1cc(cc(c1Cl)C)F 1458a_200010768536_200000210301 [0,1,0,0,0,0|3,0,0]=4 776 B12R1.511 CC(=O)c1cc(cc(c1Cl)Cl)Cl 1458a_100011215521_200000210301 [0,1,0,0,0,0|3,0,0]=4 777 B12R1.511 CC(=O)c1cc(cc(c1Cl)Cl)F 1458a_200010244589_200000210301 [0,1,0,0,0,0|3,0,0]=4 778 B12R1.511 CC(=O)c1cc(cc(c1Cl)F)Cl 1458a_200012352169_200000210301 [0,1,0,0,0,0|3,0,0]=4 779 B12R1.511 CC(=O)c1cc(cc(c1Cl)F)F 1458a_100009888511_200000210301 [0,1,0,0,0,0|3,0,0]=4 780 B12R1.511 CC(=O)c1cc(cc(c1F)Br)C 1458a_100009996753_200000210301 [0,1,0,0,0,0|3,0,0]=4 781 B12R1.511 CC(=O)c1cc(cc(c1F)Br)Cl 1458a_100000720295_200000210301 [0,1,0,0,0,0|3,0,0]=4 782 B12R1.511 CC(=O)c1cc(cc(c1F)Br)F 1458a_100012920464_200000210301 [0,1,0,0,0,0|3,0,0]=4 783 B12R1.511 CC(=O)c1cc(cc(c1F)C)Br 1458a_100012928937_200000210301 [0,1,0,0,0,0|3,0,0]=4 784 B12R1.511 CC(=O)c1cc(cc(c1F)Cl)Br 1458a_100012920557_200000210301 [0,1,0,0,0,0|3,0,0]=4 785 B12R1.511 CC(=O)c1cc(cc(c1F)Cl)I 1458a_100012920558_200000210301 [0,1,0,0,0,0|3,0,0]=4 786 B12R1.511 CC(=O)c1cc(cc(c1F)F)Br 1458a_100012349847_200000210301 [0,1,0,0,0,0|3,0,0]=4 787 B12R1.511 CC(=O)c1cc(cc(c1F)F)C 1458a_100000094381_200000210301 [0,1,0,0,0,0|3,0,0]=4 788 B12R1.511 CC(=O)c1cc(cc(c1F)F)F 1458a_100011217470_200000210301 [0,1,0,0,0,0|3,0,0]=4 789 B12R1.511 CC(=O)c1cc(cc(c1F)F)I 1458a_100012344719_200000210301 [0,1,0,0,0,0|3,0,0]=4 790 B12R1.511 CC(=O)c1cc(cc(c1I)I)I 1458a_100000211575_200000210301 [0,1,0,0,0,0|3,0,0]=4 791 B12R1.511 CC(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_200000210301 [0,1,0,0,0,0|3,0,0]=4 792 B12R1.511 CC(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_200000210301 [0,1,0,0,0,0|3,0,0]=4 793 B12R1.511 CC(=O)c1cc(cc(c1O)C)Br 1458a_100011825902_200000210301 [0,1,0,0,0,0|3,0,0]=4 794 B12R1.511 CC(=O)c1cc(cc(c1O)C)Cl 1458a_100011255218_200000210301 [0,1,0,0,0,0|3,0,0]=4 795 B12R1.511 CC(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_200000210301 [0,1,0,0,0,0|3,0,0]=4 796 B12R1.511 CC(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_200000210301 [0,1,0,0,0,0|3,0,0]=4 797 B12R1.511 CC(=O)c1cc(cc(c1O)F)F 1458a_100011255242_200000210301 [0,1,0,0,0,0|3,0,0]=4 798 B12R1.511 CC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_200000210301 [0,1,0,0,0,0|3,0,0]=4 799 B12R1.511 CC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_200000210301 [0,1,0,0,0,0|2,0,0]=3 800 B12R1.511 CC(=O)c1cc(cc(c1O)O)C 271570a_203496583355_100011659362 [0,1,0,0,0,0|2,0,0]=3 801 B12R1.511 CC(C)c1cc(cc(c1N)O)F 271570a_203496583355_202125602415 [0,1,0,0,0,0|2,0,1]=4 802 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)Br 1458a_100012356187_200025704644 [0,1,0,0,0,0|3,0,0]=4 803 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)Cl 1458a_100012921640_200025704644 [0,1,0,0,0,0|3,0,0]=4 804 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)F 1458a_100010768523_200025704644 [0,1,0,0,0,0|3,0,0]=4 805 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)O 1458a_100011101721_200025704644 [0,1,0,0,0,0|2,0,0]=3 806 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])F)Br 1458a_100012347597_200025704644 [0,1,0,0,0,0|3,0,0]=4 807 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])F)Cl 1458a_100012177191_200025704644 [0,1,0,0,0,0|3,0,0]=4 808 B12R1.511 Cc1cc(c(c(c1)B(O)O)C)O 271570a_203496583355_100010254868 [0,1,0,0,0,0|2,0,1]=4 809 B12R1.511 Cc1cc(c(c(c1)B(O)O)F)O 271570a_203496583355_200010212287 [0,1,0,0,0,0|2,0,1]=4 810 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])Br)Br 1458a_200012920551_200025704644 [0,1,0,0,0,0|3,0,0]=4 811 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])Br)C 1458a_200000701928_200025704644 [0,1,0,0,0,0|3,0,0]=4 812 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])F)Br 1458a_100009996753_200025704644 [0,1,0,0,0,0|3,0,0]=4 813 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])F)F 1458a_100000094381_200025704644 [0,1,0,0,0,0|3,0,0]=4 814 B12R1.511 Cc1cc(cc(c1C)C(=O)[13CH3])Br 1458a_100012920495_200025704644 [0,1,0,0,0,0|3,0,0]=4 815 B12R1.511 Cc1cc(cc(c1Cl)C(=O)[13CH3])F 1458a_200010768536_200025704644 [0,1,0,0,0,0|3,0,0]=4 816 B12R1.511 Cc1cc(cc(c1F)C(=O)[13CH3])Br 1458a_100012928937_200025704644 [0,1,0,0,0,0|3,0,0]=4 817 B12R1.511 Cc1cc(cc(c1O)C(=O)[13CH3])Br 1458a_100011825902_200025704644 [0,1,0,0,0,0|3,0,0]=4 818 B12R1.511 Cc1cc(cc(c1O)C(=O)[13CH3])Cl 1458a_100011255218_200025704644 [0,1,0,0,0,0|3,0,0]=4 819 B12R1.511 NC(=O)c1cc(cc(c1O)O)F 271570a_203496583355_200135271384 [0,1,0,0,0,0|2,0,0]=3 820 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Br)F)F 1458a_100010209673_200025704644 [0,1,0,0,0,0|3,0,0]=4 821 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Br)Cl 1458a_200012920481_200025704644 [0,1,0,0,0,0|3,0,0]=4 822 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Br)F 1458a_100011105905_200025704644 [0,1,0,0,0,0|3,0,0]=4 823 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Cl)Cl 1458a_100011215521_200025704644 [0,1,0,0,0,0|3,0,0]=4 824 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Cl)F 1458a_200010244589_200025704644 [0,1,0,0,0,0|3,0,0]=4 825 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)F)Cl 1458a_200012352169_200025704644 [0,1,0,0,0,0|3,0,0]=4 826 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)F)F 1458a_100009888511_200025704644 [0,1,0,0,0,0|3,0,0]=4 827 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Br)Cl 1458a_100000720295_200025704644 [0,1,0,0,0,0|3,0,0]=4 828 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Br)F 1458a_100012920464_200025704644 [0,1,0,0,0,0|3,0,0]=4 829 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Cl)Br 1458a_100012920557_200025704644 [0,1,0,0,0,0|3,0,0]=4 830 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Cl)I 1458a_100012920558_200025704644 [0,1,0,0,0,0|3,0,0]=4 831 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)F)Br 1458a_100012349847_200025704644 [0,1,0,0,0,0|3,0,0]=4 832 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)F)F 1458a_100011217470_200025704644 [0,1,0,0,0,0|3,0,0]=4 833 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)F)I 1458a_100012344719_200025704644 [0,1,0,0,0,0|3,0,0]=4 834 B12R1.511 [13CH3]C(=O)c1cc(cc(c1I)I)I 1458a_100000211575_200025704644 [0,1,0,0,0,0|3,0,0]=4 835 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_200025704644 [0,1,0,0,0,0|3,0,0]=4 836 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_200025704644 [0,1,0,0,0,0|3,0,0]=4 837 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_200025704644 [0,1,0,0,0,0|3,0,0]=4 838 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_200025704644 [0,1,0,0,0,0|3,0,0]=4 839 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)F)F 1458a_100011255242_200025704644 [0,1,0,0,0,0|3,0,0]=4 840 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)I)I 1458a_100000748652_200025704644 [0,1,0,0,0,0|3,0,0]=4 841 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_200025704644 [0,1,0,0,0,0|2,0,0]=3 842 B12R1.893 C=C(C)c1ccc(c(c1F)O)Br 271570a_100000694244_200010782288 [0,1,0,0,0,0|3,0,0]=4 843 B12R1.893 C=C(C)c1ccc(c(c1F)O)F 271570a_100000694244_100010167067 [0,1,0,0,0,0|3,0,0]=4 844 B12R1.893 C=C(C)c1ccc(c(c1N)C)F 271570a_100000694244_100011009917 [0,1,0,0,0,0|3,0,0]=4 845 B12R1.893 C=C(C)c1ccc(c(c1N)F)F 271570a_100000694244_100010008850 [0,1,0,0,0,0|3,0,0]=4 846 B12R1.893 C=C(C)c1ccc(c(c1N)N)F 271570a_100000694244_100011102919 [0,1,0,0,0,0|3,0,0]=4 847 B12R1.893 C=C(C)c1ccc(c(c1N)O)Br 271570a_100000694244_100020748643 [0,1,0,0,0,0|2,0,0]=3 848 B12R1.893 CC(=O)c1ccc(c(c1Br)F)F 1458a_100012356454_200000210301 [0,1,0,0,0,0|3,0,0]=4 849 B12R1.893 CC(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_200000210301 [0,1,0,0,0,0|2,0,0]=3 850 B12R1.893 CC(=O)c1ccc(c(c1C)F)F 1458a_100000061971_200000210301 [0,1,0,0,0,0|3,0,0]=4 851 B12R1.893 CC(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_200000210301 [0,1,0,0,0,0|3,0,0]=4 852 B12R1.893 CC(=O)c1ccc(c(c1Cl)C)Cl 1458a_100010074829_200000210301 [0,1,0,0,0,0|3,0,0]=4 853 B12R1.893 CC(=O)c1ccc(c(c1Cl)C)F 1458a_100000061447_200000210301 [0,1,0,0,0,0|3,0,0]=4 854 B12R1.893 CC(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_200000210301 [0,1,0,0,0,0|3,0,0]=4 855 B12R1.893 CC(=O)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_200000210301 [0,1,0,0,0,0|3,0,0]=4 856 B12R1.893 CC(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_200000210301 [0,1,0,0,0,0|3,0,0]=4 857 B12R1.893 CC(=O)c1ccc(c(c1Cl)F)F 1458a_100009888510_200000210301 [0,1,0,0,0,0|3,0,0]=4 858 B12R1.893 CC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_200000210301 [0,1,0,0,0,0|2,0,0]=3 859 B12R1.893 CC(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_200000210301 [0,1,0,0,0,0|3,0,0]=4 860 B12R1.893 CC(=O)c1ccc(c(c1F)Br)F 1458a_100010204296_200000210301 [0,1,0,0,0,0|3,0,0]=4 861 B12R1.893 CC(=O)c1ccc(c(c1F)C)Br 1458a_100000722919_200000210301 [0,1,0,0,0,0|3,0,0]=4 862 B12R1.893 CC(=O)c1ccc(c(c1F)C)C 1458a_100010768504_200000210301 [0,1,0,0,0,0|3,0,0]=4 863 B12R1.893 CC(=O)c1ccc(c(c1F)C)Cl 1458a_100012183103_200000210301 [0,1,0,0,0,0|3,0,0]=4 864 B12R1.893 CC(=O)c1ccc(c(c1F)C)F 1458a_100000067293_200000210301 [0,1,0,0,0,0|3,0,0]=4 865 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_200000210301 [0,1,0,0,0,0|3,0,0]=4 866 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)C 1458a_100000722910_200000210301 [0,1,0,0,0,0|3,0,0]=4 867 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)F 1458a_100000034381_200000210301 [0,1,0,0,0,0|3,0,0]=4 868 B12R1.893 CC(=O)c1ccc(c(c1F)F)Br 1458a_100009816880_200000210301 [0,1,0,0,0,0|3,0,0]=4 869 B12R1.893 CC(=O)c1ccc(c(c1F)F)C 1458a_100011219789_200000210301 [0,1,0,0,0,0|3,0,0]=4 870 B12R1.893 CC(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_200000210301 [0,1,0,0,0,0|3,0,0]=4 871 B12R1.893 CC(=O)c1ccc(c(c1F)F)F 1458a_100000766628_200000210301 [0,1,0,0,0,0|3,0,0]=4 872 B12R1.893 CC(=O)c1ccc(c(c1F)F)I 1458a_100010177778_200000210301 [0,1,0,0,0,0|3,0,0]=4 873 B12R1.893 CC(=O)c1ccc(c(c1F)F)O 1458a_100000036740_200000210301 [0,1,0,0,0,0|3,0,0]=4 874 B12R1.893 CC(=O)c1ccc(c(c1F)F)O 271570a_203496583355_100010174444 [0,1,0,0,0,0|3,0,0]=4 875 B12R1.893 CC(=O)c1ccc(c(c1F)O)F 1458a_100000084588_200000210301 [0,1,0,0,0,0|2,0,0]=3 876 B12R1.893 CC(=O)c1ccc(c(c1F)O)F 271570a_203496583355_100010179980 [0,1,0,0,0,0|2,0,0]=3 877 B12R1.893 CC(=O)c1ccc(c(c1I)C)C 1458a_100010188221_200000210301 [0,1,0,0,0,0|3,0,0]=4 878 B12R1.893 CC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_200000210301 [0,1,0,0,0,0|3,0,0]=4 879 B12R1.893 CC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_200000210301 [0,1,0,0,0,0|3,0,0]=4 880 B12R1.893 CC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_200000210301 [0,1,0,0,0,0|3,0,0]=4 881 B12R1.893 CC(=O)c1ccc(c(c1O)F)F 271570a_203496583355_200013857550 [0,1,0,0,0,0|3,0,0]=4 882 B12R1.893 CC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200000210301 [0,1,0,0,0,0|2,0,0]=3 883 B12R1.893 Cc1c(ccc(c1Cl)C(=O)[13CH3])Cl 1458a_100010074829_200025704644 [0,1,0,0,0,0|3,0,0]=4 884 B12R1.893 Cc1c(ccc(c1Cl)C(=O)[13CH3])F 1458a_100000061447_200025704644 [0,1,0,0,0,0|3,0,0]=4 885 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])Br 1458a_100000722919_200025704644 [0,1,0,0,0,0|3,0,0]=4 886 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])Cl 1458a_100012183103_200025704644 [0,1,0,0,0,0|3,0,0]=4 887 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])F 1458a_100000067293_200025704644 [0,1,0,0,0,0|3,0,0]=4 888 B12R1.893 Cc1c(ccc(c1F)F)C(=O)[13CH3] 1458a_100000061971_200025704644 [0,1,0,0,0,0|3,0,0]=4 889 B12R1.893 Cc1ccc(c(c1C)F)C(=O)[13CH3] 1458a_100010768504_200025704644 [0,1,0,0,0,0|3,0,0]=4 890 B12R1.893 Cc1ccc(c(c1C)I)C(=O)[13CH3] 1458a_100010188221_200025704644 [0,1,0,0,0,0|3,0,0]=4 891 B12R1.893 Cc1ccc(c(c1C)O)C(=O)[13CH3] 1458a_100000742916_200025704644 [0,1,0,0,0,0|3,0,0]=4 892 B12R1.893 Cc1ccc(c(c1Cl)F)C(=O)[13CH3] 1458a_100000722910_200025704644 [0,1,0,0,0,0|3,0,0]=4 893 B12R1.893 Cc1ccc(c(c1F)F)C(=O)[13CH3] 1458a_100011219789_200025704644 [0,1,0,0,0,0|3,0,0]=4 894 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Br)F)F 1458a_100012356454_200025704644 [0,1,0,0,0,0|3,0,0]=4 895 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_200025704644 [0,1,0,0,0,0|2,0,0]=3 896 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_200025704644 [0,1,0,0,0,0|3,0,0]=4 897 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_200025704644 [0,1,0,0,0,0|3,0,0]=4 898 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_200025704644 [0,1,0,0,0,0|3,0,0]=4 899 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_200025704644 [0,1,0,0,0,0|3,0,0]=4 900 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)F)F 1458a_100009888510_200025704644 [0,1,0,0,0,0|3,0,0]=4 901 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_200025704644 [0,1,0,0,0,0|2,0,0]=3 902 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_200025704644 [0,1,0,0,0,0|3,0,0]=4 903 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Br)F 1458a_100010204296_200025704644 [0,1,0,0,0,0|3,0,0]=4 904 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_200025704644 [0,1,0,0,0,0|3,0,0]=4 905 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Cl)F 1458a_100000034381_200025704644 [0,1,0,0,0,0|3,0,0]=4 906 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)Br 1458a_100009816880_200025704644 [0,1,0,0,0,0|3,0,0]=4 907 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_200025704644 [0,1,0,0,0,0|3,0,0]=4 908 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)F 1458a_100000766628_200025704644 [0,1,0,0,0,0|3,0,0]=4 909 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)I 1458a_100010177778_200025704644 [0,1,0,0,0,0|3,0,0]=4 910 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)O 1458a_100000036740_200025704644 [0,1,0,0,0,0|3,0,0]=4 911 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)O)F 1458a_100000084588_200025704644 [0,1,0,0,0,0|2,0,0]=3 912 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_200025704644 [0,1,0,0,0,0|3,0,0]=4 913 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)F)F 1458a_100011799213_200025704644 [0,1,0,0,0,0|3,0,0]=4 914 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200025704644 [0,1,0,0,0,0|2,0,0]=3 915 B12R1.894 C=C(C)c1c(ccc(c1C)O)C 271570a_100000694244_100010659238 [0,1,0,0,0,0|3,0,0]=4 916 B12R1.894 C=C(C)c1c(ccc(c1N)F)F 271570a_100000694244_100014094178 [0,1,0,0,0,0|3,0,0]=4 917 B12R1.894 C=C(C)c1c(ccc(c1N)N)F 271570a_100000694244_100010128261 [0,1,0,0,0,0|3,0,0]=4 918 B12R1.894 CC(=O)c1c(ccc(c1Br)C)F 1458a_100000720849_200000210301 [0,1,0,0,0,0|3,0,0]=4 919 B12R1.894 CC(=O)c1c(ccc(c1Br)F)F 1458a_100010245744_200000210301 [0,1,0,0,0,0|3,0,0]=4 920 B12R1.894 CC(=O)c1c(ccc(c1C)Br)C 1458a_100012355652_200000210301 [0,1,0,0,0,0|3,0,0]=4 921 B12R1.894 CC(=O)c1c(ccc(c1C)Br)F 1458a_100010768519_200000210301 [0,1,0,0,0,0|3,0,0]=4 922 B12R1.894 CC(=O)c1c(ccc(c1C)F)Br 1458a_100010768524_200000210301 [0,1,0,0,0,0|3,0,0]=4 923 B12R1.894 CC(=O)c1c(ccc(c1Cl)Br)Cl 1458a_100012350121_200000210301 [0,1,0,0,0,0|3,0,0]=4 924 B12R1.894 CC(=O)c1c(ccc(c1Cl)Br)F 1458a_100010245877_200000210301 [0,1,0,0,0,0|3,0,0]=4 925 B12R1.894 CC(=O)c1c(ccc(c1Cl)C)Br 1458a_200010769262_200000210301 [0,1,0,0,0,0|3,0,0]=4 926 B12R1.894 CC(=O)c1c(ccc(c1Cl)C)F 1458a_100000036856_200000210301 [0,1,0,0,0,0|3,0,0]=4 927 B12R1.894 CC(=O)c1c(ccc(c1Cl)Cl)Cl 1458a_100000182695_200000210301 [0,1,0,0,0,0|3,0,0]=4 928 B12R1.894 CC(=O)c1c(ccc(c1Cl)Cl)F 1458a_100000061834_200000210301 [0,1,0,0,0,0|3,0,0]=4 929 B12R1.894 CC(=O)c1c(ccc(c1Cl)F)Cl 1458a_100000068355_200000210301 [0,1,0,0,0,0|3,0,0]=4 930 B12R1.894 CC(=O)c1c(ccc(c1Cl)F)F 1458a_100000043044_200000210301 [0,1,0,0,0,0|3,0,0]=4 931 B12R1.894 CC(=O)c1c(ccc(c1F)Br)Br 1458a_100010233042_200000210301 [0,1,0,0,0,0|3,0,0]=4 932 B12R1.894 CC(=O)c1c(ccc(c1F)Br)Cl 1458a_100010235752_200000210301 [0,1,0,0,0,0|3,0,0]=4 933 B12R1.894 CC(=O)c1c(ccc(c1F)Br)F 1458a_100000721511_200000210301 [0,1,0,0,0,0|3,0,0]=4 934 B12R1.894 CC(=O)c1c(ccc(c1F)C)Br 1458a_100010271678_200000210301 [0,1,0,0,0,0|3,0,0]=4 935 B12R1.894 CC(=O)c1c(ccc(c1F)C)Cl 1458a_100000039063_200000210301 [0,1,0,0,0,0|3,0,0]=4 936 B12R1.894 CC(=O)c1c(ccc(c1F)C)F 1458a_100000692215_200000210301 [0,1,0,0,0,0|3,0,0]=4 937 B12R1.894 CC(=O)c1c(ccc(c1F)Cl)Br 1458a_100010769261_200000210301 [0,1,0,0,0,0|3,0,0]=4 938 B12R1.894 CC(=O)c1c(ccc(c1F)Cl)Cl 1458a_100000061686_200000210301 [0,1,0,0,0,0|3,0,0]=4 939 B12R1.894 CC(=O)c1c(ccc(c1F)Cl)F 1458a_100011219569_200000210301 [0,1,0,0,0,0|3,0,0]=4 940 B12R1.894 CC(=O)c1c(ccc(c1F)F)Br 1458a_100010177765_200000210301 [0,1,0,0,0,0|3,0,0]=4 941 B12R1.894 CC(=O)c1c(ccc(c1F)F)Cl 1458a_100011998153_200000210301 [0,1,0,0,0,0|3,0,0]=4 942 B12R1.894 CC(=O)c1c(ccc(c1F)F)F 1458a_100000031524_200000210301 [0,1,0,0,0,0|3,0,0]=4 943 B12R1.894 CC(=O)c1c(ccc(c1F)F)I 1458a_100010177766_200000210301 [0,1,0,0,0,0|3,0,0]=4 944 B12R1.894 CC(=O)c1c(ccc(c1F)F)O 1458a_100000062415_200000210301 [0,1,0,0,0,0|3,0,0]=4 945 B12R1.894 CC(=O)c1c(ccc(c1F)I)Br 1458a_100010782274_200000210301 [0,1,0,0,0,0|3,0,0]=4 946 B12R1.894 CC(=O)c1c(ccc(c1F)I)Cl 1458a_100021583479_200000210301 [0,1,0,0,0,0|3,0,0]=4 947 B12R1.894 CC(=O)c1c(ccc(c1F)I)F 1458a_100012359589_200000210301 [0,1,0,0,0,0|3,0,0]=4 948 B12R1.894 CC(=O)c1c(ccc(c1F)O)F 1458a_100000068660_200000210301 [0,1,0,0,0,0|2,0,0]=3 949 B12R1.894 CC(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_200000210301 [0,1,0,0,0,0|3,0,0]=4 950 B12R1.894 CC(=O)c1c(ccc(c1O)C)C 1458a_100011255215_200000210301 [0,1,0,0,0,0|3,0,0]=4 951 B12R1.894 CC(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_200000210301 [0,1,0,0,0,0|3,0,0]=4 952 B12R1.894 CC(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_200000210301 [0,1,0,0,0,0|3,0,0]=4 953 B12R1.894 CC(=O)c1c(ccc(c1O)F)F 1458a_100011830443_200000210301 [0,1,0,0,0,0|3,0,0]=4 954 B12R1.894 Cc1c(ccc(c1C(=O)[13CH3])Br)F 1458a_100010768524_200025704644 [0,1,0,0,0,0|3,0,0]=4 955 B12R1.894 Cc1c(ccc(c1C(=O)[13CH3])F)Br 1458a_100010768519_200025704644 [0,1,0,0,0,0|3,0,0]=4 956 B12R1.894 Cc1ccc(c(c1B(O)O)F)O 271570a_203496583355_100016072109 [0,1,0,0,0,0|2,0,1]=4 957 B12R1.894 Cc1ccc(c(c1Br)C(=O)[13CH3])F 1458a_100000720849_200025704644 [0,1,0,0,0,0|3,0,0]=4 958 B12R1.894 Cc1ccc(c(c1C(=O)[13CH3])C)Br 1458a_100012355652_200025704644 [0,1,0,0,0,0|3,0,0]=4 959 B12R1.894 Cc1ccc(c(c1Cl)C(=O)[13CH3])Br 1458a_200010769262_200025704644 [0,1,0,0,0,0|3,0,0]=4 960 B12R1.894 Cc1ccc(c(c1Cl)C(=O)[13CH3])F 1458a_100000036856_200025704644 [0,1,0,0,0,0|3,0,0]=4 961 B12R1.894 Cc1ccc(c(c1F)C(=O)[13CH3])Br 1458a_100010271678_200025704644 [0,1,0,0,0,0|3,0,0]=4 962 B12R1.894 Cc1ccc(c(c1F)C(=O)[13CH3])Cl 1458a_100000039063_200025704644 [0,1,0,0,0,0|3,0,0]=4 963 B12R1.894 Cc1ccc(c(c1F)C(=O)[13CH3])F 1458a_100000692215_200025704644 [0,1,0,0,0,0|3,0,0]=4 964 B12R1.894 Cc1ccc(c(c1O)C(=O)[13CH3])C 1458a_100011255215_200025704644 [0,1,0,0,0,0|3,0,0]=4 965 B12R1.894 OB(O)c1c(ccc(c1F)O)Br 271570a_203496583355_200010201209 [0,1,0,0,0,0|2,0,1]=4 966 B12R1.894 OB(O)c1c(ccc(c1F)O)F 271570a_203496583355_200011356793 [0,1,0,0,0,0|2,0,1]=4 967 B12R1.894 OB(O)c1c(ccc(c1F)O)O 271570a_203496583355_200010254889 [0,1,0,0,0,0|2,0,1]=4 968 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Br)F)F 1458a_100010245744_200025704644 [0,1,0,0,0,0|3,0,0]=4 969 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)Br)Cl 1458a_100012350121_200025704644 [0,1,0,0,0,0|3,0,0]=4 970 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)Br)F 1458a_100010245877_200025704644 [0,1,0,0,0,0|3,0,0]=4 971 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)Cl)Cl 1458a_100000182695_200025704644 [0,1,0,0,0,0|3,0,0]=4 972 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)Cl)F 1458a_100000061834_200025704644 [0,1,0,0,0,0|3,0,0]=4 973 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)F)Cl 1458a_100000068355_200025704644 [0,1,0,0,0,0|3,0,0]=4 974 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)F)F 1458a_100000043044_200025704644 [0,1,0,0,0,0|3,0,0]=4 975 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Br)Br 1458a_100010233042_200025704644 [0,1,0,0,0,0|3,0,0]=4 976 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Br)Cl 1458a_100010235752_200025704644 [0,1,0,0,0,0|3,0,0]=4 977 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Br)F 1458a_100000721511_200025704644 [0,1,0,0,0,0|3,0,0]=4 978 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Cl)Br 1458a_100010769261_200025704644 [0,1,0,0,0,0|3,0,0]=4 979 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Cl)Cl 1458a_100000061686_200025704644 [0,1,0,0,0,0|3,0,0]=4 980 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Cl)F 1458a_100011219569_200025704644 [0,1,0,0,0,0|3,0,0]=4 981 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)Br 1458a_100010177765_200025704644 [0,1,0,0,0,0|3,0,0]=4 982 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)Cl 1458a_100011998153_200025704644 [0,1,0,0,0,0|3,0,0]=4 983 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)F 1458a_100000031524_200025704644 [0,1,0,0,0,0|3,0,0]=4 984 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)I 1458a_100010177766_200025704644 [0,1,0,0,0,0|3,0,0]=4 985 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)O 1458a_100000062415_200025704644 [0,1,0,0,0,0|3,0,0]=4 986 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)I)Br 1458a_100010782274_200025704644 [0,1,0,0,0,0|3,0,0]=4 987 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)I)Cl 1458a_100021583479_200025704644 [0,1,0,0,0,0|3,0,0]=4 988 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)I)F 1458a_100012359589_200025704644 [0,1,0,0,0,0|3,0,0]=4 989 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)O)F 1458a_100000068660_200025704644 [0,1,0,0,0,0|2,0,0]=3 990 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_200025704644 [0,1,0,0,0,0|3,0,0]=4 991 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_200025704644 [0,1,0,0,0,0|3,0,0]=4 992 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_200025704644 [0,1,0,0,0,0|3,0,0]=4 993 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)F)F 1458a_100011830443_200025704644 [0,1,0,0,0,0|3,0,0]=4 994 B12R2.81 Nc1c(cccc1C2CC2)O 271570a_100011220607_100011934926 [0,0,0,1,0,0|2,0,1]=4 995 B12R2.196 Cc1c[nH]c2c1cccc2O 271570a_203496583355_100010186758 [0,0,0,1,0,0|2,0,0]=3 996 B12R2.196 Cc1cccc2c1[nH]nc2O 271570a_203496583355_100010186057 [0,0,0,1,0,0|2,0,0]=3 997 B12R2.196 Cc1n[nH]c2c1cccc2O 271570a_203496583355_100010255084 [0,0,0,1,0,0|2,0,0]=3 998 B12R2.196 Nc1cccc2c1[nH]nc2O 271570a_203496583355_100009888981 [0,0,0,1,0,0|2,0,0]=3 999 B12R2.196 Nc1n[nH]c2c1cccc2O 271570a_203496583355_100010069757 [0,0,0,1,0,0|2,0,0]=3 1000 B12R2.196 Nc1noc2c1cccc2O 271570a_203496583355_100010069758 [0,0,0,1,0,0|3,0,0]=4 1001 B12R2.196 O=C1CCc2c1cccc2O 271570a_203496583355_100000744605 [0,0,0,1,0,0|2,0,0]=3 1002 B12R2.196 O=C1COc2c1cccc2O 271570a_203496583355_100011230590 [0,0,0,1,0,0|2,0,0]=3 1003 B12R2.196 O=C1NCc2c1cccc2O 271570a_203496583355_100000688282 [0,0,0,1,0,0|2,0,0]=3 1004 B12R2.196 O=C1OCc2c1cccc2O 271570a_203496583355_100010167076 [0,0,0,1,0,0|1,0,0]=2 1005 B12R2.196 O=c1[nH][nH]c2c1cccc2O 271570a_203496583355_100012199144 [0,0,0,1,0,0|1,0,0]=2 1006 B12R2.196 Oc1cccc2c1CC[C@@H]2O 271570a_203496583355_100010080924 [0,0,0,1,0,0|2,0,1]=4 1007 B12R2.196 Oc1cccn2c1ncc2O 271570a_203496583355_200020799507 [0,0,0,1,0,0|2,0,1]=4 1008 B12R2.196 Oc1n[nH]c2c1cccc2Br 271570a_203496583355_100010197283 [0,0,0,1,0,0|2,0,0]=3 1009 B12R2.196 Oc1n[nH]c2c1cccc2Cl 271570a_203496583355_100000050086 [0,0,0,1,0,0|2,0,0]=3 1010 B12R2.196 Oc1n[nH]c2c1cccc2F 271570a_203496583355_100010231504 [0,0,0,1,0,0|2,0,0]=3 1011 B12R2.196 Oc1n[nH]c2c1cccc2O 271570a_203496583355_200010988877 [0,0,0,1,0,0|1,0,0]=2 1012 B10R1.194 CC(=O)c1c[nH]c(c1C)O 271570a_203496583355_200010235672 [0,0,0,0,1,0|3,0,0]=4 1013 B10R1.194 NC(=O)c1scc(c1N)O 271570a_203496583355_100010220608 [0,0,0,0,1,0|2,0,0]=3 1014 B12R1.224 CC(=Cc1cccc(c1Br)O)C 271570a_100102525489_100010187914 [0,0,0,0,0,1|3,0,0]=4 1015 B12R1.224 CC(=Cc1cccc(c1C)O)C 271570a_100102525489_100012002258 [0,0,0,0,0,1|3,0,0]=4 1016 B12R1.224 CC(=Cc1cccc(c1Cl)O)C 271570a_100102525489_100000049636 [0,0,0,0,0,1|3,0,0]=4 1017 B12R1.224 CC(=Cc1cccc(c1F)O)C 271570a_100102525489_100009817021 [0,0,0,0,0,1|3,0,0]=4 1018 B12R1.224 CC(=Cc1cccc(c1N)Br)C 271570a_100102525489_100010146558 [0,0,0,0,0,1|3,0,0]=4 1019 B12R1.224 CC(=Cc1cccc(c1N)C)C 271570a_100102525489_100011834072 [0,0,0,0,0,1|3,0,0]=4 1020 B12R1.224 CC(=Cc1cccc(c1N)Cl)C 271570a_100102525489_100010190421 [0,0,0,0,0,1|3,0,0]=4 1021 B12R1.224 CC(=Cc1cccc(c1N)F)C 271570a_100102525489_100000042321 [0,0,0,0,0,1|3,0,0]=4 1022 B12R1.224 CC(=Cc1cccc(c1N)N)C 271570a_100102525489_100015191791 [0,0,0,0,0,1|3,0,0]=4 1023 B12R1.224 CC(=Cc1cccc(c1N)O)C 271570a_100102525489_100011934926 [0,0,0,0,0,1|2,0,0]=3 1024 B12R1.224 CC(=Cc1cccc(c1O)O)C 271570a_100102525489_100009815950 [0,0,0,0,0,1|3,0,0]=4 1025 B12R1.224 CC(=Cc1nccc(c1N)O)C 271570a_100102525489_100000128729 [0,0,0,0,0,1|3,0,0]=4 1026 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100000070787_200012349612 [0,0,0,0,0,1|3,0,0]=4 1027 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100010147021_200000210301 [0,0,0,0,0,1|3,0,0]=4 1028 B12R1.224 CC(=O)Cc1cccc(c1Br)Cl 1458a_100000070787_100010145525 [0,0,0,0,0,1|3,0,0]=4 1029 B12R1.224 CC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_200000210301 [0,0,0,0,0,1|3,0,0]=4 1030 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1458a_100000070787_100012351116 [0,0,0,0,0,1|3,0,0]=4 1031 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1458a_100012356664_200000210301 [0,0,0,0,0,1|3,0,0]=4 1032 B12R1.224 CC(=O)Cc1cccc(c1Br)I 1458a_100000070787_100010254545 [0,0,0,0,0,1|3,0,0]=4 1033 B12R1.224 CC(=O)Cc1cccc(c1C)Br 1458a_100000070787_100000694682 [0,0,0,0,0,1|3,0,0]=4 1034 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100000070787_100011515928 [0,0,0,0,0,1|3,0,0]=4 1035 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100011698479_200000210301 [0,0,0,0,0,1|3,0,0]=4 1036 B12R1.224 CC(=O)Cc1cccc(c1C)Cl 1458a_100000070787_100012186920 [0,0,0,0,0,1|3,0,0]=4 1037 B12R1.224 CC(=O)Cc1cccc(c1C)F 1458a_100000035905_200000210301 [0,0,0,0,0,1|3,0,0]=4 1038 B12R1.224 CC(=O)Cc1cccc(c1C)F 1458a_100000070787_100009813626 [0,0,0,0,0,1|3,0,0]=4 1039 B12R1.224 CC(=O)Cc1cccc(c1C)I 1458a_100000070787_100010150147 [0,0,0,0,0,1|3,0,0]=4 1040 B12R1.224 CC(=O)Cc1cccc(c1Cl)Br 1458a_100000070787_100012349491 [0,0,0,0,0,1|3,0,0]=4 1041 B12R1.224 CC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_200000210301 [0,0,0,0,0,1|3,0,0]=4 1042 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000070787_100000720918 [0,0,0,0,0,1|3,0,0]=4 1043 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_200000210301 [0,0,0,0,0,1|3,0,0]=4 1044 B12R1.224 CC(=O)Cc1cccc(c1Cl)F 1458a_100000070787_100000696688 [0,0,0,0,0,1|3,0,0]=4 1045 B12R1.224 CC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_200000210301 [0,0,0,0,0,1|3,0,0]=4 1046 B12R1.224 CC(=O)Cc1cccc(c1F)Br 1458a_100000070787_100012356507 [0,0,0,0,0,1|3,0,0]=4 1047 B12R1.224 CC(=O)Cc1cccc(c1F)Br 1458a_100011935088_200000210301 [0,0,0,0,0,1|3,0,0]=4 1048 B12R1.224 CC(=O)Cc1cccc(c1F)C 1458a_100000070787_100011216058 [0,0,0,0,0,1|3,0,0]=4 1049 B12R1.224 CC(=O)Cc1cccc(c1F)Cl 1458a_100000070787_100000716733 [0,0,0,0,0,1|3,0,0]=4 1050 B12R1.224 CC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_200000210301 [0,0,0,0,0,1|3,0,0]=4 1051 B12R1.224 CC(=O)Cc1cccc(c1F)F 1458a_100000070787_100000217499 [0,0,0,0,0,1|3,0,0]=4 1052 B12R1.224 CC(=O)Cc1cccc(c1F)F 1458a_100000684727_200000210301 [0,0,0,0,0,1|3,0,0]=4 1053 B12R1.224 CC(=O)Cc1cccc(c1I)F 1458a_100000070787_100010149603 [0,0,0,0,0,1|3,0,0]=4 1054 B12R1.224 CC(=O)Nc1cccc(c1Br)C 11a_100000684715_100015343762 [0,0,0,0,0,1|3,0,0]=4 1055 B12R1.224 CC(=O)Nc1cccc(c1Br)C 1626a_100000684715_100015343762 [0,0,0,0,0,1|3,0,0]=4 1056 B12R1.224 CC(=O)Nc1cccc(c1Br)C 22a_100000684715_100000070787 [0,0,0,0,0,1|3,0,0]=4 1057 B12R1.224 CC(=O)Nc1cccc(c1Br)Cl 11a_100000687072_100015343762 [0,0,0,0,0,1|3,0,0]=4 1058 B12R1.224 CC(=O)Nc1cccc(c1Br)Cl 1626a_100000687072_100015343762 [0,0,0,0,0,1|3,0,0]=4 1059 B12R1.224 CC(=O)Nc1cccc(c1Br)F 11a_100011934729_100015343762 [0,0,0,0,0,1|3,0,0]=4 1060 B12R1.224 CC(=O)Nc1cccc(c1Br)F 1626a_100011934729_100015343762 [0,0,0,0,0,1|3,0,0]=4 1061 B12R1.224 CC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000070787 [0,0,0,0,0,1|2,0,0]=3 1062 B12R1.224 CC(=O)Nc1cccc(c1C)Br 11a_100000750434_100015343762 [0,0,0,0,0,1|3,0,0]=4 1063 B12R1.224 CC(=O)Nc1cccc(c1C)Br 1626a_100000750434_100015343762 [0,0,0,0,0,1|3,0,0]=4 1064 B12R1.224 CC(=O)Nc1cccc(c1C)Br 22a_100000750434_100000070787 [0,0,0,0,0,1|3,0,0]=4 1065 B12R1.224 CC(=O)Nc1cccc(c1C)Br 527a_100000750434_100103153847 [0,0,0,0,0,1|3,0,0]=4 1066 B12R1.224 CC(=O)Nc1cccc(c1C)C 11a_100000210026_100015343762 [0,0,0,0,0,1|3,0,0]=4 1067 B12R1.224 CC(=O)Nc1cccc(c1C)C 1626a_100000210026_100015343762 [0,0,0,0,0,1|3,0,0]=4 1068 B12R1.224 CC(=O)Nc1cccc(c1C)C 22a_100000210026_100000070787 [0,0,0,0,0,1|3,0,0]=4 1069 B12R1.224 CC(=O)Nc1cccc(c1C)C 527a_100000210026_100103153847 [0,0,0,0,0,1|3,0,0]=4 1070 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 11a_100000210441_100015343762 [0,0,0,0,0,1|3,0,0]=4 1071 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 1626a_100000210441_100015343762 [0,0,0,0,0,1|3,0,0]=4 1072 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 22a_100000210441_100000070787 [0,0,0,0,0,1|3,0,0]=4 1073 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 527a_100000210441_100103153847 [0,0,0,0,0,1|3,0,0]=4 1074 B12R1.224 CC(=O)Nc1cccc(c1C)F 11a_100000745574_100015343762 [0,0,0,0,0,1|3,0,0]=4 1075 B12R1.224 CC(=O)Nc1cccc(c1C)F 1626a_100000745574_100015343762 [0,0,0,0,0,1|3,0,0]=4 1076 B12R1.224 CC(=O)Nc1cccc(c1C)F 22a_100000745574_100000070787 [0,0,0,0,0,1|3,0,0]=4 1077 B12R1.224 CC(=O)Nc1cccc(c1C)F 527a_100000745574_100103153847 [0,0,0,0,0,1|3,0,0]=4 1078 B12R1.224 CC(=O)Nc1cccc(c1C)I 11a_100000761887_100015343762 [0,0,0,0,0,1|3,0,0]=4 1079 B12R1.224 CC(=O)Nc1cccc(c1C)I 1626a_100000761887_100015343762 [0,0,0,0,0,1|3,0,0]=4 1080 B12R1.224 CC(=O)Nc1cccc(c1C)I 22a_100000761887_100000070787 [0,0,0,0,0,1|3,0,0]=4 1081 B12R1.224 CC(=O)Nc1cccc(c1C)I 527a_100000761887_100103153847 [0,0,0,0,0,1|3,0,0]=4 1082 B12R1.224 CC(=O)Nc1cccc(c1C)O 11a_100011216573_100015343762 [0,0,0,0,0,1|2,0,0]=3 1083 B12R1.224 CC(=O)Nc1cccc(c1C)O 22a_100011216573_100000070787 [0,0,0,0,0,1|2,0,0]=3 1084 B12R1.224 CC(=O)Nc1cccc(c1C)O 527a_100011216573_100103153847 [0,0,0,0,0,1|2,0,0]=3 1085 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 11a_100000687075_100015343762 [0,0,0,0,0,1|3,0,0]=4 1086 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 1626a_100000687075_100015343762 [0,0,0,0,0,1|3,0,0]=4 1087 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 527a_100000687075_100103153847 [0,0,0,0,0,1|3,0,0]=4 1088 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 11a_100000765562_100015343762 [0,0,0,0,0,1|3,0,0]=4 1089 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 1626a_100000765562_100015343762 [0,0,0,0,0,1|3,0,0]=4 1090 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 22a_100000765562_100000070787 [0,0,0,0,0,1|3,0,0]=4 1091 B12R1.224 CC(=O)Nc1cccc(c1Cl)Cl 11a_100000185733_100015343762 [0,0,0,0,0,1|3,0,0]=4 1092 B12R1.224 CC(=O)Nc1cccc(c1Cl)Cl 1626a_100000185733_100015343762 [0,0,0,0,0,1|3,0,0]=4 1093 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 11a_100000692321_100015343762 [0,0,0,0,0,1|3,0,0]=4 1094 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 1626a_100000692321_100015343762 [0,0,0,0,0,1|3,0,0]=4 1095 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 22a_100000692321_100000070787 [0,0,0,0,0,1|3,0,0]=4 1096 B12R1.224 CC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000070787 [0,0,0,0,0,1|2,0,0]=3 1097 B12R1.224 CC(=O)Nc1cccc(c1F)Br 11a_100011935091_100015343762 [0,0,0,0,0,1|3,0,0]=4 1098 B12R1.224 CC(=O)Nc1cccc(c1F)Br 1626a_100011935091_100015343762 [0,0,0,0,0,1|3,0,0]=4 1099 B12R1.224 CC(=O)Nc1cccc(c1F)Br 22a_100011935091_100000070787 [0,0,0,0,0,1|3,0,0]=4 1100 B12R1.224 CC(=O)Nc1cccc(c1F)Br 527a_100011935091_100103153847 [0,0,0,0,0,1|3,0,0]=4 1101 B12R1.224 CC(=O)Nc1cccc(c1F)C 11a_100000697159_100015343762 [0,0,0,0,0,1|3,0,0]=4 1102 B12R1.224 CC(=O)Nc1cccc(c1F)C 1626a_100000697159_100015343762 [0,0,0,0,0,1|3,0,0]=4 1103 B12R1.224 CC(=O)Nc1cccc(c1F)C 527a_100000697159_100103153847 [0,0,0,0,0,1|3,0,0]=4 1104 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 11a_100000199060_100015343762 [0,0,0,0,0,1|3,0,0]=4 1105 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 1626a_100000199060_100015343762 [0,0,0,0,0,1|3,0,0]=4 1106 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 22a_100000199060_100000070787 [0,0,0,0,0,1|3,0,0]=4 1107 B12R1.224 CC(=O)Nc1cccc(c1F)F 11a_100000743855_100015343762 [0,0,0,0,0,1|3,0,0]=4 1108 B12R1.224 CC(=O)Nc1cccc(c1F)F 1626a_100000743855_100015343762 [0,0,0,0,0,1|3,0,0]=4 1109 B12R1.224 CC(=O)Nc1cccc(c1F)F 22a_100000743855_100000070787 [0,0,0,0,0,1|3,0,0]=4 1110 B12R1.224 CC(=O)Nc1cccc(c1I)Br 11a_100020590159_100015343762 [0,0,0,0,0,1|3,0,0]=4 1111 B12R1.224 CC(=O)Nc1cccc(c1I)Br 1626a_100020590159_100015343762 [0,0,0,0,0,1|3,0,0]=4 1112 B12R1.224 CC(=O)Nc1cccc(c1I)C 11a_100000761888_100015343762 [0,0,0,0,0,1|3,0,0]=4 1113 B12R1.224 CC(=O)Nc1cccc(c1I)C 1626a_100000761888_100015343762 [0,0,0,0,0,1|3,0,0]=4 1114 B12R1.224 CC(=O)Nc1cccc(c1I)Cl 11a_100000049713_100015343762 [0,0,0,0,0,1|3,0,0]=4 1115 B12R1.224 CC(=O)Nc1cccc(c1I)Cl 1626a_100000049713_100015343762 [0,0,0,0,0,1|3,0,0]=4 1116 B12R1.224 CC(=O)Nc1cccc(c1I)F 11a_100000690935_100015343762 [0,0,0,0,0,1|3,0,0]=4 1117 B12R1.224 CC(=O)Nc1cccc(c1I)F 1626a_100000690935_100015343762 [0,0,0,0,0,1|3,0,0]=4 1118 B12R1.224 CC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000070787 [0,0,0,0,0,1|3,0,0]=4 1119 B12R1.224 CC(=O)Nc1cccc(c1O)Br 527a_100011934915_100103153847 [0,0,0,0,0,1|3,0,0]=4 1120 B12R1.224 CC(=O)Nc1cccc(c1O)C 11a_100000756359_100015343762 [0,0,0,0,0,1|3,0,0]=4 1121 B12R1.224 CC(=O)Nc1cccc(c1O)C 1626a_100000756359_100015343762 [0,0,0,0,0,1|3,0,0]=4 1122 B12R1.224 CC(=O)Nc1cccc(c1O)C 22a_100000756359_100000070787 [0,0,0,0,0,1|3,0,0]=4 1123 B12R1.224 CC(=O)Nc1cccc(c1O)C 527a_100000756359_100103153847 [0,0,0,0,0,1|3,0,0]=4 1124 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000070787 [0,0,0,0,0,1|3,0,0]=4 1125 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100103153847 [0,0,0,0,0,1|3,0,0]=4 1126 B12R1.224 CC(=O)Nc1cccc(c1O)F 1626a_100011934987_100015343762 [0,0,0,0,0,1|3,0,0]=4 1127 B12R1.224 CC(=O)Nc1cccc(c1O)F 22a_100011934987_100000070787 [0,0,0,0,0,1|3,0,0]=4 1128 B12R1.224 CC(=O)Nc1cccc(c1O)F 527a_100011934987_100103153847 [0,0,0,0,0,1|3,0,0]=4 1129 B12R1.224 CC(=O)Nc1cccc(c1O)I 1626a_100010084371_100015343762 [0,0,0,0,0,1|3,0,0]=4 1130 B12R1.224 CC(=O)Nc1cccc(c1O)I 22a_100010084371_100000070787 [0,0,0,0,0,1|3,0,0]=4 1131 B12R1.224 CC(=O)Nc1cccc(c1O)I 527a_100010084371_100103153847 [0,0,0,0,0,1|3,0,0]=4 1132 B12R1.224 CC(C)Sc1cccc(c1N)O 62a_100000210206_100011934926 [0,0,0,0,0,1|2,0,1]=4 1133 B12R1.224 Cc1c(cccc1CC(=O)[13CH3])F 1458a_100000035905_200025704644 [0,0,0,0,0,1|3,0,0]=4 1134 B12R1.224 Cc1cccc(c1Br)CC(=O)[13CH3] 1458a_100010147021_200025704644 [0,0,0,0,0,1|3,0,0]=4 1135 B12R1.224 Cc1cccc(c1C)CC(=O)[13CH3] 1458a_100011698479_200025704644 [0,0,0,0,0,1|3,0,0]=4 1136 B12R1.224 Cc1cccc(c1O)CC(=O)N 271570a_203496583355_100011096275 [0,0,0,0,0,1|3,0,0]=4 1137 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_200025704644 [0,0,0,0,0,1|3,0,0]=4 1138 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Br)F 1458a_100012356664_200025704644 [0,0,0,0,0,1|3,0,0]=4 1139 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_200025704644 [0,0,0,0,0,1|3,0,0]=4 1140 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_200025704644 [0,0,0,0,0,1|3,0,0]=4 1141 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)F 1458a_100012001123_200025704644 [0,0,0,0,0,1|3,0,0]=4 1142 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)Br 1458a_100011935088_200025704644 [0,0,0,0,0,1|3,0,0]=4 1143 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)Cl 1458a_100000709823_200025704644 [0,0,0,0,0,1|3,0,0]=4 1144 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)F 1458a_100000684727_200025704644 [0,0,0,0,0,1|3,0,0]=4 1145 B9R1.2 C=Cc1cc(ccn1)O 271570a_100011290941_100000762945 [2,0,0,0,0,0|2,0,0]=4 1146 B9R1.2 C=Cc1cccc(c1)Br 271570a_100011290941_100000691529 [2,0,0,0,0,0|2,0,0]=4 1147 B9R1.2 C=Cc1cccc(c1)C 271570a_100011290941_100011215228 [2,0,0,0,0,0|2,0,0]=4 1148 B9R1.2 C=Cc1cccc(c1)Cl 271570a_100011290941_100000699651 [2,0,0,0,0,0|2,0,0]=4 1149 B9R1.2 C=Cc1cccc(c1)F 271570a_100011290941_100000685547 [2,0,0,0,0,0|2,0,0]=4 1150 B9R1.2 C=Cc1cccc(c1)N 271570a_100011290941_100000210019 [2,0,0,0,0,0|2,0,0]=4 1151 B9R1.2 C=Cc1cccc(c1)O 271570a_100011290941_100000211634 [2,0,0,0,0,0|1,0,0]=3 1152 B9R1.2 C=Cc1cccc(c1)[S] 271570a_100011290941_114929384022 [2,0,0,0,0,0|1,1,0]=4 1153 B9R1.2 C=Cc1cncc(c1)O 271570a_100011290941_100000754920 [2,0,0,0,0,0|2,0,0]=4 1154 B9R1.2 CCc1cccc(c1)O 271570a_203496583355_100000684523 [2,0,0,0,0,0|1,0,1]=4 1155 B9R1.2 CNc1cccc(c1)O 271570a_203496583355_100000219648 [2,0,0,0,0,0|2,0,0]=4 1156 B9R1.2 CNc1cccc(c1)O 34a_100000210217_200000210301 [2,0,0,0,0,0|2,0,0]=4 1157 B9R1.2 COc1cccc(c1)O 271570a_203496583355_100000170001 [2,0,0,0,0,0|2,0,0]=4 1158 B9R1.2 CSc1cccc(c1)O 271570a_203496583355_100011215954 [2,0,0,0,0,0|2,0,0]=4 1159 B9R1.2 CSc1cccc(c1)O 62a_200000210301_100000211634 [2,0,0,0,0,0|2,0,0]=4 1160 B9R1.2 N#Cc1cccc(c1)O 271570a_203496583355_100000189340 [2,0,0,0,0,0|1,0,1]=4 1161 B9R1.2 NCc1cccc(c1)O 271570a_203496583355_100000106179 [2,0,0,0,0,0|1,0,1]=4 1162 B9R1.2 NNc1cccc(c1)O 271570a_203496583355_100000217339 [2,0,0,0,0,0|2,0,0]=4 1163 B9R1.2 O=Cc1cc(ccn1)O 271570a_203496583355_100011998288 [2,0,0,0,0,0|1,0,0]=3 1164 B9R1.2 O=Cc1cccc(c1)O 271570a_203496583355_100000014684 [2,0,0,0,0,0|0,0,0]=2 1165 B9R1.2 O=Cc1cccc(n1)O 271570a_203496583355_100000688028 [2,0,0,0,0,0|1,0,0]=3 1166 B9R1.2 O=Cc1ccnc(c1)O 271570a_203496583355_100011290808 [2,0,0,0,0,0|1,0,0]=3 1167 B9R1.2 O=Cc1cncc(c1)O 271570a_203496583355_100000687066 [2,0,0,0,0,0|1,0,0]=3 1168 B9R1.2 OCc1cc(ccn1)O 271570a_203496583355_100009819072 [2,0,0,0,0,0|1,0,1]=4 1169 B9R1.2 OCc1cccc(c1)O 271570a_203496583355_100000687537 [2,0,0,0,0,0|0,0,1]=3 1170 B9R1.2 OCc1cccc(n1)O 271570a_203496583355_100000694195 [2,0,0,0,0,0|1,0,1]=4 1171 B9R1.2 OCc1ccnc(c1)O 271570a_203496583355_100009814636 [2,0,0,0,0,0|1,0,1]=4 1172 B9R1.2 OCc1cncc(c1)O 271570a_203496583355_100011259137 [2,0,0,0,0,0|1,0,1]=4 1173 B9R1.2 Oc1cccc(c1)CF 271570a_203496583355_100010878472 [2,0,0,0,0,0|1,0,1]=4 1174 B9R1.2 [13CH3]Nc1cccc(c1)O 34a_100000210217_200025704644 [2,0,0,0,0,0|2,0,0]=4 1175 B9R1.2 [13CH3]Sc1cccc(c1)O 62a_200025704644_100000211634 [2,0,0,0,0,0|2,0,0]=4 1176 B9R1.3 Cc1c(cccc1Br)O 271570a_203496583355_100012353703 [2,0,0,0,0,0|2,0,0]=4 1177 B9R1.3 Cc1c(cccc1Cl)O 271570a_203496583355_100000726075 [2,0,0,0,0,0|2,0,0]=4 1178 B9R1.3 Cc1c(cccc1F)O 271570a_203496583355_100011216893 [2,0,0,0,0,0|2,0,0]=4 1179 B9R1.3 Cc1c(cccc1O)N 271570a_203496583355_100000761887 [2,0,0,0,0,0|2,0,0]=4 1180 B9R1.3 Cc1c(cccc1O)O 271570a_203496583355_100012002258 [2,0,0,0,0,0|1,0,0]=3 1181 B9R1.3 Cc1c(ccnc1O)O 271570a_203496583355_100009858498 [2,0,0,0,0,0|2,0,0]=4 1182 B9R1.3 Cc1cccc(c1C)O 271570a_203496583355_100011214922 [2,0,0,0,0,0|1,0,1]=4 1183 B9R1.3 Cc1cccc(c1Cl)O 271570a_203496583355_200012352035 [2,0,0,0,0,0|1,0,1]=4 1184 B9R1.3 Cc1cccc(c1F)O 271570a_203496583355_100000717567 [2,0,0,0,0,0|1,0,1]=4 1185 B9R1.3 Cc1cccc(c1N)O 271570a_203496583355_100011834072 [2,0,0,0,0,0|0,0,1]=3 1186 B9R1.3 Cc1cccc(c1O)O 271570a_203496583355_100000686692 [2,0,0,0,0,0|1,0,1]=4 1187 B9R1.3 Cc1cccc(c1O)O 271570a_203496583355_100009817157 [2,0,0,0,0,0|1,0,1]=4 1188 B9R1.3 Cc1ccnc(c1N)O 271570a_203496583355_100000763560 [2,0,0,0,0,0|1,0,1]=4 1189 B9R1.3 Cc1cncc(c1N)O 271570a_203496583355_100009818025 [2,0,0,0,0,0|1,0,1]=4 1190 B9R1.3 Cc1nccc(c1N)O 271570a_203496583355_100009885578 [2,0,0,0,0,0|1,0,1]=4 1191 B9R1.3 Cn1c(cccc1=O)O 271570a_203496583355_100000726605 [2,0,0,0,0,0|2,0,0]=4 1192 B9R1.3 Nc1c(cccc1Br)O 271570a_203496583355_100010146558 [2,0,0,0,0,0|1,0,0]=3 1193 B9R1.3 Nc1c(cccc1Cl)O 271570a_203496583355_100010190421 [2,0,0,0,0,0|1,0,0]=3 1194 B9R1.3 Nc1c(cccc1F)O 271570a_203496583355_100000042321 [2,0,0,0,0,0|1,0,0]=3 1195 B9R1.3 Nc1c(cccc1O)O 271570a_203496583355_100011934926 [2,0,0,0,0,0|0,0,0]=2 1196 B9R1.3 Nc1c(ccnc1O)O 271570a_203496583355_100000128729 [2,0,0,0,0,0|1,0,0]=3 1197 B9R1.3 Nc1c(cn[nH]c1=O)O 271570a_203496583355_100000126857 [2,0,0,0,0,0|2,0,0]=4 1198 B9R1.3 Nc1c(cncc1Br)O 271570a_203496583355_100011290786 [2,0,0,0,0,0|2,0,0]=4 1199 B9R1.3 Nc1c(cncc1Cl)O 271570a_203496583355_100000684942 [2,0,0,0,0,0|2,0,0]=4 1200 B9R1.3 Nc1c(cncc1F)O 271570a_203496583355_100009880649 [2,0,0,0,0,0|2,0,0]=4 1201 B9R1.3 Nc1c(ncnc1O)O 271570a_203496583355_100011795086 [2,0,0,0,0,0|2,0,0]=4 1202 B9R1.3 Nc1cccc(c1F)O 271570a_203496583355_100011935091 [2,0,0,0,0,0|2,0,0]=4 1203 B9R1.3 Nc1cccc(c1N)O 271570a_203496583355_100015191791 [2,0,0,0,0,0|1,0,0]=3 1204 B9R1.3 Nc1cccc(c1O)O 271570a_203496583355_100011934915 [2,0,0,0,0,0|2,0,0]=4 1205 B9R1.3 Nc1cccc(c1O)O 271570a_203496583355_100012183704 [2,0,0,0,0,0|2,0,0]=4 1206 B9R1.3 Nc1ccnc(c1N)O 271570a_203496583355_100000085203 [2,0,0,0,0,0|2,0,0]=4 1207 B9R1.3 Nc1cncc(c1N)O 271570a_203496583355_100000694774 [2,0,0,0,0,0|2,0,0]=4 1208 B9R1.3 Nc1nccc(c1N)O 271570a_203496583355_100000124095 [2,0,0,0,0,0|2,0,0]=4 1209 B9R1.3 Oc1cccc(c1Br)O 271570a_203496583355_100010187914 [2,0,0,0,0,0|1,0,0]=3 1210 B9R1.3 Oc1cccc(c1Cl)Br 271570a_203496583355_100010142854 [2,0,0,0,0,0|2,0,0]=4 1211 B9R1.3 Oc1cccc(c1Cl)Cl 271570a_203496583355_100011215384 [2,0,0,0,0,0|2,0,0]=4 1212 B9R1.3 Oc1cccc(c1Cl)F 271570a_203496583355_200010234923 [2,0,0,0,0,0|2,0,0]=4 1213 B9R1.3 Oc1cccc(c1Cl)O 271570a_203496583355_100000049636 [2,0,0,0,0,0|1,0,0]=3 1214 B9R1.3 Oc1cccc(c1F)Br 271570a_203496583355_100000702267 [2,0,0,0,0,0|2,0,0]=4 1215 B9R1.3 Oc1cccc(c1F)Cl 271570a_203496583355_100011217346 [2,0,0,0,0,0|2,0,0]=4 1216 B9R1.3 Oc1cccc(c1F)F 271570a_203496583355_100000694657 [2,0,0,0,0,0|2,0,0]=4 1217 B9R1.3 Oc1cccc(c1F)O 271570a_203496583355_100009817021 [2,0,0,0,0,0|1,0,0]=3 1218 B9R1.3 Oc1cccc(c1O)Br 271570a_203496583355_100010084509 [2,0,0,0,0,0|2,0,0]=4 1219 B9R1.3 Oc1cccc(c1O)Br 271570a_203496583355_100010187912 [2,0,0,0,0,0|2,0,0]=4 1220 B9R1.3 Oc1cccc(c1O)Cl 271570a_203496583355_100000050174 [2,0,0,0,0,0|2,0,0]=4 1221 B9R1.3 Oc1cccc(c1O)Cl 271570a_203496583355_100010202889 [2,0,0,0,0,0|2,0,0]=4 1222 B9R1.3 Oc1cccc(c1O)F 271570a_203496583355_100009813666 [2,0,0,0,0,0|2,0,0]=4 1223 B9R1.3 Oc1cccc(c1O)F 271570a_203496583355_100009820682 [2,0,0,0,0,0|2,0,0]=4 1224 B9R1.3 Oc1cccc(c1O)O 271570a_203496583355_100009815950 [2,0,0,0,0,0|1,0,0]=3 1225 B9R1.3 Oc1cccc(c1O)O 271570a_203496583355_100010205330 [2,0,0,0,0,0|1,0,0]=3 1226 B9R1.3 Oc1ccnc(c1F)O 271570a_203496583355_100009876375 [2,0,0,0,0,0|2,0,0]=4 1227 B9R1.3 Oc1ccnc(c1O)O 271570a_203496583355_200009817435 [2,0,0,0,0,0|2,0,0]=4 1228 B9R1.15 C=Cc1ccccc1Br 271570a_100011290941_100000695589 [2,0,0,0,0,0|2,0,0]=4 1229 B9R1.15 C=Cc1ccccc1C 271570a_100011290941_100000210755 [2,0,0,0,0,0|2,0,0]=4 1230 B9R1.15 C=Cc1ccccc1Cl 271570a_100011290941_100000764095 [2,0,0,0,0,0|2,0,0]=4 1231 B9R1.15 C=Cc1ccccc1F 271570a_100011290941_100011215700 [2,0,0,0,0,0|2,0,0]=4 1232 B9R1.15 C=Cc1ccccc1N 271570a_100011290941_100000210017 [2,0,0,0,0,0|1,0,0]=3 1233 B9R1.15 C=Cc1ccccc1O 271570a_100011290941_100000739446 [2,0,0,0,0,0|2,0,0]=4 1234 B9R1.15 C=Cc1cccnc1N 271570a_100011290941_100000045569 [2,0,0,0,0,0|2,0,0]=4 1235 B9R1.15 C=Cc1ccncc1N 271570a_100011290941_100009815883 [2,0,0,0,0,0|2,0,0]=4 1236 B9R1.15 C=Cc1cnccc1N 271570a_100011290941_100000047001 [2,0,0,0,0,0|2,0,0]=4 1237 B9R1.15 C=Cc1ncccc1N 271570a_100011290941_100000688686 [2,0,0,0,0,0|2,0,0]=4 1238 B9R1.15 COc1ccccc1N 34a_100000185747_200000210301 [2,0,0,0,0,0|2,0,0]=4 1239 B9R1.15 COc1ccccc1N 7a_100000185747_200000210301 [2,0,0,0,0,0|2,0,0]=4 1240 B9R1.15 CSc1ccccc1N 62a_100000210017_200000210301 [2,0,0,0,0,0|2,0,0]=4 1241 B9R1.15 CSc1ccccc1N 62a_200000210301_100000210017 [2,0,0,0,0,0|2,0,0]=4 1242 B9R1.15 O=Cc1ccccc1O 271570a_203496583355_100000211189 [2,0,0,0,0,0|1,0,0]=3 1243 B9R1.15 O=Cc1cccnc1O 271570a_203496583355_100009816751 [2,0,0,0,0,0|2,0,0]=4 1244 B9R1.15 O=Cc1ccncc1O 271570a_203496583355_100011934409 [2,0,0,0,0,0|2,0,0]=4 1245 B9R1.15 O=Cc1cnccc1O 271570a_203496583355_100000050567 [2,0,0,0,0,0|2,0,0]=4 1246 B9R1.15 O=Cc1ncccc1O 271570a_203496583355_100011934733 [2,0,0,0,0,0|2,0,0]=4 1247 B9R1.15 OCc1ccccc1O 271570a_203496583355_100000187465 [2,0,0,0,0,0|1,0,1]=4 1248 B9R1.15 [13CH3]Oc1ccccc1N 34a_100000185747_200025704644 [2,0,0,0,0,0|2,0,0]=4 1249 B9R1.15 [13CH3]Oc1ccccc1N 7a_100000185747_200025704644 [2,0,0,0,0,0|2,0,0]=4 1250 B9R1.15 [13CH3]Sc1ccccc1N 62a_100000210017_200025704644 [2,0,0,0,0,0|2,0,0]=4 1251 B9R1.15 [13CH3]Sc1ccccc1N 62a_200025704644_100000210017 [2,0,0,0,0,0|2,0,0]=4 1252 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [2,0,0,0,0,0|2,0,0]=4 1253 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [2,0,0,0,0,0|1,0,0]=3 1254 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [2,0,0,0,0,0|1,0,0]=3 1255 B11R1.8 C=Cc1cc(cc(c1N)Br)Cl 271570a_100011290941_200012970264 [1,1,0,0,0,0|2,0,0]=4 1256 B11R1.8 C=Cc1cc(cc(c1N)C)Br 271570a_100011290941_200000690823 [1,1,0,0,0,0|2,0,0]=4 1257 B11R1.8 C=Cc1cc(cc(c1N)C)C 271570a_100011290941_100000688863 [1,1,0,0,0,0|2,0,0]=4 1258 B11R1.8 C=Cc1cc(cc(c1N)C)Cl 271570a_100011290941_100012344046 [1,1,0,0,0,0|2,0,0]=4 1259 B11R1.8 C=Cc1cc(cc(c1N)C)F 271570a_100011290941_100011216670 [1,1,0,0,0,0|2,0,0]=4 1260 B11R1.8 C=Cc1cc(cc(c1N)Cl)Cl 271570a_100011290941_100011216899 [1,1,0,0,0,0|2,0,0]=4 1261 B11R1.8 C=Cc1cc(cc(c1N)F)Br 271570a_100011290941_100012970276 [1,1,0,0,0,0|2,0,0]=4 1262 B11R1.8 C=Cc1cc(cc(c1N)F)C 271570a_100011290941_100012353694 [1,1,0,0,0,0|2,0,0]=4 1263 B11R1.8 C=Cc1cc(cc(c1N)F)Cl 271570a_100011290941_100011214900 [1,1,0,0,0,0|2,0,0]=4 1264 B11R1.8 C=Cc1cc(cc(c1N)F)F 271570a_100011290941_100000211602 [1,1,0,0,0,0|2,0,0]=4 1265 B11R1.8 C=Cc1cc(cc(c1N)N)C 271570a_100011290941_100012348275 [1,1,0,0,0,0|2,0,0]=4 1266 B11R1.8 C=Cc1cc(cc(c1N)N)F 271570a_100011290941_100011934818 [1,1,0,0,0,0|2,0,0]=4 1267 B11R1.8 CNc1cc(cc(c1N)O)F 271570a_203496583355_200102954750 [1,1,0,0,0,0|2,0,0]=4 1268 B11R1.8 COc1cc(cc(c1N)O)F 271570a_203496583355_100011004115 [1,1,0,0,0,0|2,0,0]=4 1269 B11R1.8 Cc1cc(c(c(c1)C=O)F)O 271570a_203496583355_100010161323 [1,1,0,0,0,0|1,0,0]=3 1270 B11R1.8 Cc1cc(c(c(c1)C=O)O)O 271570a_203496583355_100000698970 [1,1,0,0,0,0|1,0,0]=3 1271 B11R1.8 Cc1cc(cc(c1F)C=O)O 271570a_203496583355_100010235757 [1,1,0,0,0,0|2,0,0]=4 1272 B11R1.8 N#Cc1cc(cc(c1N)O)Br 271570a_203496583355_200010208226 [1,1,0,0,0,0|1,0,1]=4 1273 B11R1.8 N#Cc1cc(cc(c1N)O)F 271570a_203496583355_100013085293 [1,1,0,0,0,0|1,0,1]=4 1274 B11R1.8 Nc1c(cc(cc1CO)F)O 271570a_203496583355_200010775858 [1,1,0,0,0,0|0,0,1]=3 1275 B11R1.8 O=Cc1cc(cc(c1F)F)O 271570a_203496583355_100009814787 [1,1,0,0,0,0|2,0,0]=4 1276 B11R1.8 O=Cc1cc(cc(c1F)O)F 271570a_203496583355_100010890130 [1,1,0,0,0,0|1,0,0]=3 1277 B11R1.8 O=Cc1cc(cc(c1O)F)O 271570a_203496583355_100011217654 [1,1,0,0,0,0|2,0,0]=4 1278 B11R1.8 O=Cc1cc(cc(c1O)O)F 271570a_203496583355_100011659637 [1,1,0,0,0,0|1,0,0]=3 1279 B11R1.8 OCc1cc(cc(c1F)O)F 271570a_203496583355_100010988950 [1,1,0,0,0,0|1,0,1]=4 1280 B11R1.13 C=C=Cc1cccc(c1Br)O 271570a_100015277604_100010187914 [1,1,0,0,0,0|2,0,0]=4 1281 B11R1.13 C=C=Cc1cccc(c1C)O 271570a_100015277604_100012002258 [1,1,0,0,0,0|2,0,0]=4 1282 B11R1.13 C=C=Cc1cccc(c1Cl)O 271570a_100015277604_100000049636 [1,1,0,0,0,0|2,0,0]=4 1283 B11R1.13 C=C=Cc1cccc(c1F)O 271570a_100015277604_100009817021 [1,1,0,0,0,0|2,0,0]=4 1284 B11R1.13 C=C=Cc1cccc(c1N)Br 271570a_100015277604_100010146558 [1,1,0,0,0,0|2,0,0]=4 1285 B11R1.13 C=C=Cc1cccc(c1N)C 271570a_100015277604_100011834072 [1,1,0,0,0,0|2,0,0]=4 1286 B11R1.13 C=C=Cc1cccc(c1N)Cl 271570a_100015277604_100010190421 [1,1,0,0,0,0|2,0,0]=4 1287 B11R1.13 C=C=Cc1cccc(c1N)F 271570a_100015277604_100000042321 [1,1,0,0,0,0|2,0,0]=4 1288 B11R1.13 C=C=Cc1cccc(c1N)N 271570a_100015277604_100015191791 [1,1,0,0,0,0|2,0,0]=4 1289 B11R1.13 C=C=Cc1cccc(c1N)O 271570a_100015277604_100011934926 [1,1,0,0,0,0|1,0,0]=3 1290 B11R1.13 C=C=Cc1cccc(c1O)O 271570a_100015277604_100009815950 [1,1,0,0,0,0|2,0,0]=4 1291 B11R1.13 C=C=Cc1nccc(c1N)O 271570a_100015277604_100000128729 [1,1,0,0,0,0|2,0,0]=4 1292 B11R1.13 CC=Cc1cccc(c1Br)O 271570a_100016259895_100010187914 [1,1,0,0,0,0|2,0,0]=4 1293 B11R1.13 CC=Cc1cccc(c1C)O 271570a_100016259895_100012002258 [1,1,0,0,0,0|2,0,0]=4 1294 B11R1.13 CC=Cc1cccc(c1Cl)O 271570a_100016259895_100000049636 [1,1,0,0,0,0|2,0,0]=4 1295 B11R1.13 CC=Cc1cccc(c1F)O 271570a_100016259895_100009817021 [1,1,0,0,0,0|2,0,0]=4 1296 B11R1.13 CC=Cc1cccc(c1N)Br 271570a_100016259895_100010146558 [1,1,0,0,0,0|2,0,0]=4 1297 B11R1.13 CC=Cc1cccc(c1N)C 271570a_100016259895_100011834072 [1,1,0,0,0,0|2,0,0]=4 1298 B11R1.13 CC=Cc1cccc(c1N)Cl 271570a_100016259895_100010190421 [1,1,0,0,0,0|2,0,0]=4 1299 B11R1.13 CC=Cc1cccc(c1N)F 271570a_100016259895_100000042321 [1,1,0,0,0,0|2,0,0]=4 1300 B11R1.13 CC=Cc1cccc(c1N)N 271570a_100016259895_100015191791 [1,1,0,0,0,0|2,0,0]=4 1301 B11R1.13 CC=Cc1cccc(c1N)O 271570a_100016259895_100011934926 [1,1,0,0,0,0|1,0,0]=3 1302 B11R1.13 CC=Cc1cccc(c1O)O 271570a_100016259895_100009815950 [1,1,0,0,0,0|2,0,0]=4 1303 B11R1.13 CC=Cc1nccc(c1N)O 271570a_100016259895_100000128729 [1,1,0,0,0,0|2,0,0]=4 1304 B11R1.13 CCOc1cccc(c1N)O 271570a_203496583355_200103155331 [1,1,0,0,0,0|1,0,1]=4 1305 B11R1.13 CCSc1cccc(c1N)O 62a_100000210202_100011934926 [1,1,0,0,0,0|1,0,1]=4 1306 B11R1.13 COCc1cccc(c1C)O 271570a_203496583355_100102485947 [1,1,0,0,0,0|1,0,1]=4 1307 B11R1.13 COCc1cccc(c1N)Br 34a_100012349457_200000210301 [1,1,0,0,0,0|1,0,1]=4 1308 B11R1.13 COCc1cccc(c1N)C 34a_100011215590_200000210301 [1,1,0,0,0,0|1,0,1]=4 1309 B11R1.13 COCc1cccc(c1N)Cl 34a_100012182729_200000210301 [1,1,0,0,0,0|1,0,1]=4 1310 B11R1.13 COCc1cccc(c1N)F 34a_100000692437_200000210301 [1,1,0,0,0,0|1,0,1]=4 1311 B11R1.13 Cc1cccc(c1N)CO[13CH3] 34a_100011215590_200025704644 [1,1,0,0,0,0|1,0,1]=4 1312 B11R1.13 Nc1c(cccc1SCF)O 62a_100015361967_100011934926 [1,1,0,0,0,0|1,0,1]=4 1313 B11R1.13 [13CH3]OCc1cccc(c1N)Br 34a_100012349457_200025704644 [1,1,0,0,0,0|1,0,1]=4 1314 B11R1.13 [13CH3]OCc1cccc(c1N)Cl 34a_100012182729_200025704644 [1,1,0,0,0,0|1,0,1]=4 1315 B11R1.13 [13CH3]OCc1cccc(c1N)F 34a_100000692437_200025704644 [1,1,0,0,0,0|1,0,1]=4 1316 B11R1.72 C=Cc1c(ccc(c1C)O)C 271570a_100011290941_100010659238 [1,1,0,0,0,0|2,0,0]=4 1317 B11R1.72 C=Cc1c(ccc(c1N)F)F 271570a_100011290941_100014094178 [1,1,0,0,0,0|2,0,0]=4 1318 B11R1.72 C=Cc1c(ccc(c1N)N)F 271570a_100011290941_100010128261 [1,1,0,0,0,0|2,0,0]=4 1319 B11R1.72 Cc1ccc(c(c1F)C=O)O 271570a_203496583355_100000039034 [1,1,0,0,0,0|2,0,0]=4 1320 B11R1.72 Cc1ccc(c(c1O)C=O)F 271570a_203496583355_100000033498 [1,1,0,0,0,0|2,0,0]=4 1321 B11R1.72 O=Cc1c(ccc(c1F)F)O 271570a_203496583355_100009814791 [1,1,0,0,0,0|2,0,0]=4 1322 B11R1.72 O=Cc1c(ccc(c1F)O)Br 271570a_203496583355_100010769263 [1,1,0,0,0,0|1,0,0]=3 1323 B11R1.72 O=Cc1c(ccc(c1F)O)Cl 271570a_203496583355_100010782290 [1,1,0,0,0,0|1,0,0]=3 1324 B11R1.72 O=Cc1c(ccc(c1F)O)F 271570a_203496583355_100000725362 [1,1,0,0,0,0|1,0,0]=3 1325 B11R1.72 O=Cc1c(ccc(c1O)F)F 271570a_203496583355_100000034233 [1,1,0,0,0,0|2,0,0]=4 1326 B11R1.72 O=Cc1c(ccc(c1O)F)O 271570a_203496583355_100010762561 [1,1,0,0,0,0|2,0,0]=4 1327 B11R1.72 O=Cc1c(ccc(c1O)O)O 271570a_203496583355_100010184888 [1,1,0,0,0,0|1,0,0]=3 1328 B11R1.72 OCc1c(ccc(c1F)O)Br 271570a_203496583355_200010782277 [1,1,0,0,0,0|1,0,1]=4 1329 B11R1.72 OCc1c(ccc(c1F)O)F 271570a_203496583355_100000725363 [1,1,0,0,0,0|1,0,1]=4 1330 B11R1.265 C=Cc1c(cccc1C=O)F 271570a_100011290941_100011998484 [1,1,0,0,0,0|2,0,0]=4 1331 B11R1.265 C=Cc1c(cccc1C=O)O 271570a_100011290941_100009816417 [1,1,0,0,0,0|1,0,0]=3 1332 B11R1.265 C=Cc1cccc(c1C#N)O 271570a_100011290941_100012180507 [1,1,0,0,0,0|1,0,1]=4 1333 B11R1.265 C=Cc1cccc(c1C=O)O 271570a_100011290941_100009814793 [1,1,0,0,0,0|2,0,0]=4 1334 B11R1.265 C=Cc1cccc(c1CN)F 271570a_100011290941_100012349121 [1,1,0,0,0,0|2,0,0]=4 1335 B11R1.265 C=Cc1cccc(c1NC)N 271570a_100011290941_100010510394 [1,1,0,0,0,0|2,0,0]=4 1336 B11R1.265 C=Cc1cccc(c1NN)F 271570a_100011290941_100016994982 [1,1,0,0,0,0|2,0,0]=4 1337 B11R1.265 C=Cc1cccc(c1OC)O 271570a_100011290941_100010234590 [1,1,0,0,0,0|2,0,0]=4 1338 B11R1.265 CNc1c(cccc1CO)C 34a_100011215590_200000210301 [1,1,0,0,0,0|1,0,1]=4 1339 B11R1.265 CNc1c(cccc1CO)Cl 34a_100012182729_200000210301 [1,1,0,0,0,0|1,0,1]=4 1340 B11R1.265 CNc1c(cccc1CO)F 34a_100000692437_200000210301 [1,1,0,0,0,0|1,0,1]=4 1341 B11R1.265 CNc1c(cccc1OC)O 34a_100012022766_200000210301 [1,1,0,0,0,0|2,0,0]=4 1342 B11R1.265 COc1c(cccc1C=O)O 271570a_203496583355_100000692592 [1,1,0,0,0,0|1,0,0]=3 1343 B11R1.265 COc1c(cccc1CO)O 271570a_203496583355_100000704359 [1,1,0,0,0,0|1,0,1]=4 1344 B11R1.265 COc1c(ccnc1O)C=O 271570a_203496583355_200009814792 [1,1,0,0,0,0|2,0,0]=4 1345 B11R1.265 COc1c(cncc1C=O)O 271570a_203496583355_100015834815 [1,1,0,0,0,0|2,0,0]=4 1346 B11R1.265 COc1cccc(c1N[13CH3])O 34a_100012022766_200025704644 [1,1,0,0,0,0|2,0,0]=4 1347 B11R1.265 CSc1c(cccc1C=O)C 62a_100012186367_200000210301 [1,1,0,0,0,0|2,0,0]=4 1348 B11R1.265 CSc1c(cccc1C=O)C 62a_200000210301_100012186367 [1,1,0,0,0,0|2,0,0]=4 1349 B11R1.265 CSc1c(cccc1C=O)F 62a_100011934749_200000210301 [1,1,0,0,0,0|2,0,0]=4 1350 B11R1.265 CSc1c(cccc1C=O)F 62a_200000210301_100011934749 [1,1,0,0,0,0|2,0,0]=4 1351 B11R1.265 CSc1c(cccc1C=O)O 62a_100009816417_200000210301 [1,1,0,0,0,0|1,0,0]=3 1352 B11R1.265 CSc1c(cccc1C=O)O 62a_200000210301_100009816417 [1,1,0,0,0,0|1,0,0]=3 1353 B11R1.265 Cc1cccc(c1N[13CH3])CO 34a_100011215590_200025704644 [1,1,0,0,0,0|1,0,1]=4 1354 B11R1.265 Cc1cccc(c1S[13CH3])C=O 62a_100012186367_200025704644 [1,1,0,0,0,0|2,0,0]=4 1355 B11R1.265 Cc1cccc(c1S[13CH3])C=O 62a_200025704644_100012186367 [1,1,0,0,0,0|2,0,0]=4 1356 B11R1.265 N#Cc1c(cccc1C=O)O 271570a_203496583355_100000100183 [1,1,0,0,0,0|0,0,1]=3 1357 B11R1.265 [13CH3]Nc1c(cccc1CO)Cl 34a_100012182729_200025704644 [1,1,0,0,0,0|1,0,1]=4 1358 B11R1.265 [13CH3]Nc1c(cccc1CO)F 34a_100000692437_200025704644 [1,1,0,0,0,0|1,0,1]=4 1359 B11R1.265 [13CH3]Sc1c(cccc1C=O)F 62a_100011934749_200025704644 [1,1,0,0,0,0|2,0,0]=4 1360 B11R1.265 [13CH3]Sc1c(cccc1C=O)F 62a_200025704644_100011934749 [1,1,0,0,0,0|2,0,0]=4 1361 B11R1.265 [13CH3]Sc1c(cccc1C=O)O 62a_100009816417_200025704644 [1,1,0,0,0,0|1,0,0]=3 1362 B11R1.265 [13CH3]Sc1c(cccc1C=O)O 62a_200025704644_100009816417 [1,1,0,0,0,0|1,0,0]=3 1363 B11R1.267 C=Cc1cccc(c1Br)CO 271570a_100011290941_100010240205 [1,1,0,0,0,0|2,0,0]=4 1364 B11R1.267 C=Cc1cccc(c1C)C=O 271570a_100011290941_100012179384 [1,1,0,0,0,0|2,0,0]=4 1365 B11R1.267 C=Cc1cccc(c1C)CO 271570a_100011290941_100000694458 [1,1,0,0,0,0|2,0,0]=4 1366 B11R1.267 C=Cc1cccc(c1C)OC 271570a_100011290941_100010002647 [1,1,0,0,0,0|2,0,0]=4 1367 B11R1.267 C=Cc1cccc(c1Cl)OC 271570a_100011290941_100010147677 [1,1,0,0,0,0|2,0,0]=4 1368 B11R1.267 C=Cc1cccc(c1F)C=O 271570a_100011290941_100000766533 [1,1,0,0,0,0|2,0,0]=4 1369 B11R1.267 C=Cc1cccc(c1F)CO 271570a_100011290941_100011935076 [1,1,0,0,0,0|2,0,0]=4 1370 B11R1.267 C=Cc1cccc(c1F)OC 271570a_100011290941_100010185846 [1,1,0,0,0,0|2,0,0]=4 1371 B11R1.267 C=Cc1cccc(c1N)C#N 271570a_100011290941_100000690598 [1,1,0,0,0,0|2,0,0]=4 1372 B11R1.267 C=Cc1cccc(c1N)C=O 271570a_100011290941_100010144990 [1,1,0,0,0,0|1,0,0]=3 1373 B11R1.267 C=Cc1cccc(c1N)CO 271570a_100011290941_100012349457 [1,1,0,0,0,0|1,0,0]=3 1374 B11R1.267 C=Cc1cccc(c1N)NC 271570a_100011290941_100000695761 [1,1,0,0,0,0|2,0,0]=4 1375 B11R1.267 C=Cc1cccc(c1N)OC 271570a_100011290941_100000708083 [1,1,0,0,0,0|1,0,0]=3 1376 B11R1.267 C=Cc1cccc(c1O)C=O 271570a_100011290941_100000737635 [1,1,0,0,0,0|2,0,0]=4 1377 B11R1.267 C=Cc1cccc(c1O)OC 271570a_100011290941_100000686866 [1,1,0,0,0,0|2,0,0]=4 1378 B11R1.267 C=Cc1cncc(c1N)CO 271570a_100011290941_200010988789 [1,1,0,0,0,0|2,0,0]=4 1379 B11R1.267 C=Cc1nccc(c1N)OC 271570a_100011290941_100000100113 [1,1,0,0,0,0|2,0,0]=4 1380 B11R1.267 COc1cccc(c1C)CO 34a_200000084602_200000210301 [1,1,0,0,0,0|1,0,1]=4 1381 B11R1.267 COc1cccc(c1C)CO 7a_200000084602_200000210301 [1,1,0,0,0,0|1,0,1]=4 1382 B11R1.267 COc1cccc(c1N)OC 34a_100012022766_200000210301 [1,1,0,0,0,0|2,0,0]=4 1383 B11R1.267 COc1cccc(c1N)OC 7a_100012022766_200000210301 [1,1,0,0,0,0|2,0,0]=4 1384 B11R1.267 COc1cccc(c1N)O[13CH3] 34a_100012022766_200025704644 [1,1,0,0,0,0|2,0,0]=4 1385 B11R1.267 COc1cccc(c1N)O[13CH3] 7a_100012022766_200025704644 [1,1,0,0,0,0|2,0,0]=4 1386 B11R1.267 COc1cccc(c1N)SC 62a_100000708083_200000210301 [1,1,0,0,0,0|2,0,0]=4 1387 B11R1.267 COc1cccc(c1N)S[13CH3] 62a_100000708083_200025704644 [1,1,0,0,0,0|2,0,0]=4 1388 B11R1.267 COc1cccc(c1O)CO 271570a_203496583355_100010236476 [1,1,0,0,0,0|1,0,1]=4 1389 B11R1.267 CSc1cccc(c1C)C=O 62a_100012179384_200000210301 [1,1,0,0,0,0|1,1,0]=4 1390 B11R1.267 CSc1cccc(c1C)C=O 62a_200000210301_100012179384 [1,1,0,0,0,0|1,1,0]=4 1391 B11R1.267 CSc1cccc(c1F)C=O 62a_100000766533_200000210301 [1,1,0,0,0,0|1,1,0]=4 1392 B11R1.267 CSc1cccc(c1F)C=O 62a_200000210301_100000766533 [1,1,0,0,0,0|1,1,0]=4 1393 B11R1.267 CSc1cccc(c1N)C=O 62a_100010144990_200000210301 [1,1,0,0,0,0|0,1,0]=3 1394 B11R1.267 CSc1cccc(c1N)CO 62a_100012349457_200000210301 [1,1,0,0,0,0|0,1,1]=4 1395 B11R1.267 CSc1cccc(c1N)CO 62a_200000210301_100012349457 [1,1,0,0,0,0|0,1,1]=4 1396 B11R1.267 CSc1cccc(c1O)C=O 62a_200000210301_100010171435 [1,1,0,0,0,0|1,1,0]=4 1397 B11R1.267 CSc1cncc(c1N)C=O 62a_100010729279_200000210301 [1,1,0,0,0,0|1,1,0]=4 1398 B11R1.267 CSc1cncc(c1N)C=O 62a_200000210301_100010729279 [1,1,0,0,0,0|1,1,0]=4 1399 B11R1.267 Cc1c(cccc1O[13CH3])CO 34a_200000084602_200025704644 [1,1,0,0,0,0|1,0,1]=4 1400 B11R1.267 Cc1c(cccc1O[13CH3])CO 7a_200000084602_200025704644 [1,1,0,0,0,0|1,0,1]=4 1401 B11R1.267 Cc1c(cccc1S[13CH3])C=O 62a_100012179384_200025704644 [1,1,0,0,0,0|1,1,0]=4 1402 B11R1.267 Cc1c(cccc1S[13CH3])C=O 62a_200025704644_100012179384 [1,1,0,0,0,0|1,1,0]=4 1403 B11R1.267 N#Cc1cccc(c1O)C=O 271570a_203496583355_100010133059 [1,1,0,0,0,0|2,0,0]=4 1404 B11R1.267 [13CH3]Sc1cccc(c1F)C=O 62a_100000766533_200025704644 [1,1,0,0,0,0|1,1,0]=4 1405 B11R1.267 [13CH3]Sc1cccc(c1F)C=O 62a_200025704644_100000766533 [1,1,0,0,0,0|1,1,0]=4 1406 B11R1.267 [13CH3]Sc1cccc(c1N)C=O 62a_100010144990_200025704644 [1,1,0,0,0,0|0,1,0]=3 1407 B11R1.267 [13CH3]Sc1cccc(c1N)CO 62a_100012349457_200025704644 [1,1,0,0,0,0|0,1,1]=4 1408 B11R1.267 [13CH3]Sc1cccc(c1N)CO 62a_200025704644_100012349457 [1,1,0,0,0,0|0,1,1]=4 1409 B11R1.267 [13CH3]Sc1cccc(c1O)C=O 62a_200025704644_100010171435 [1,1,0,0,0,0|1,1,0]=4 1410 B11R1.267 [13CH3]Sc1cncc(c1N)C=O 62a_100010729279_200025704644 [1,1,0,0,0,0|1,1,0]=4 1411 B11R1.267 [13CH3]Sc1cncc(c1N)C=O 62a_200025704644_100010729279 [1,1,0,0,0,0|1,1,0]=4 1412 B11R1.278 C=Cc1ccc(c(c1F)O)Br 271570a_100011290941_200010782288 [1,1,0,0,0,0|2,0,0]=4 1413 B11R1.278 C=Cc1ccc(c(c1F)O)F 271570a_100011290941_100010167067 [1,1,0,0,0,0|2,0,0]=4 1414 B11R1.278 C=Cc1ccc(c(c1N)C)F 271570a_100011290941_100011009917 [1,1,0,0,0,0|2,0,0]=4 1415 B11R1.278 C=Cc1ccc(c(c1N)F)F 271570a_100011290941_100010008850 [1,1,0,0,0,0|2,0,0]=4 1416 B11R1.278 C=Cc1ccc(c(c1N)N)F 271570a_100011290941_100011102919 [1,1,0,0,0,0|2,0,0]=4 1417 B11R1.278 C=Cc1ccc(c(c1N)O)Br 271570a_100011290941_100020748643 [1,1,0,0,0,0|1,0,0]=3 1418 B11R1.278 CSc1ccc(c(c1N)O)Br 62a_100020748643_200000210301 [1,1,0,0,0,0|2,0,0]=4 1419 B11R1.278 Cc1c(ccc(c1F)C=O)O 271570a_203496583355_100015546853 [1,1,0,0,0,0|2,0,0]=4 1420 B11R1.278 Cc1c(ccc(c1O)C=O)F 271570a_203496583355_100009872231 [1,1,0,0,0,0|2,0,0]=4 1421 B11R1.278 N#Cc1ccc(c(c1N)O)F 271570a_203496583355_100010128265 [1,1,0,0,0,0|1,0,1]=4 1422 B11R1.278 O=Cc1ccc(c(c1F)F)O 271570a_203496583355_100010209662 [1,1,0,0,0,0|2,0,0]=4 1423 B11R1.278 O=Cc1ccc(c(c1F)O)F 271570a_203496583355_100000050342 [1,1,0,0,0,0|1,0,0]=3 1424 B11R1.278 O=Cc1ccc(c(c1O)F)F 271570a_203496583355_100015087033 [1,1,0,0,0,0|2,0,0]=4 1425 B11R1.278 O=Cc1ccc(c(c1O)F)O 271570a_203496583355_100010762540 [1,1,0,0,0,0|2,0,0]=4 1426 B11R1.278 [13CH3]Sc1ccc(c(c1N)O)Br 62a_100020748643_200025704644 [1,1,0,0,0,0|2,0,0]=4 1427 B11R1.53 C#Cc1ccccc1C(=O)C 1458a_100011243808_200000210301 [1,1,0,0,0,0|2,0,0]=4 1428 B11R1.53 C#Cc1ccccc1C(=O)[13CH3] 1458a_100011243808_200025704644 [1,1,0,0,0,0|2,0,0]=4 1429 B11R1.53 C=C(C)c1ccccc1CN 271570a_100000694244_100000689332 [1,1,0,0,0,0|2,0,0]=4 1430 B11R1.53 C=C(C)c1ccccc1NC 271570a_100000694244_100020606079 [1,1,0,0,0,0|2,0,0]=4 1431 B11R1.53 C=C(C)c1ccccc1NC 34a_100000037685_200000210301 [1,1,0,0,0,0|2,0,0]=4 1432 B11R1.53 C=C(C)c1ccccc1NN 271570a_100000694244_100000241748 [1,1,0,0,0,0|2,0,0]=4 1433 B11R1.53 C=C(C)c1ccccc1N[13CH3] 34a_100000037685_200025704644 [1,1,0,0,0,0|2,0,0]=4 1434 B11R1.53 C=Cc1ccccc1C(=O)C 1458a_100011830265_200000210301 [1,1,0,0,0,0|2,0,0]=4 1435 B11R1.53 C=Cc1ccccc1C(=O)C 271570a_100011290941_100000751169 [1,1,0,0,0,0|2,0,0]=4 1436 B11R1.53 C=Cc1ccccc1C(=O)N 271570a_100011290941_100000162227 [1,1,0,0,0,0|2,0,0]=4 1437 B11R1.53 C=Cc1ccccc1C(=O)[13CH3] 1458a_100011830265_200025704644 [1,1,0,0,0,0|2,0,0]=4 1438 B11R1.53 CC(=O)c1ccccc1C#N 1458a_100000742908_200000210301 [1,1,0,0,0,0|1,0,1]=4 1439 B11R1.53 CC(=O)c1ccccc1CO 1458a_100011301526_200000210301 [1,1,0,0,0,0|2,0,0]=4 1440 B11R1.53 CC(=O)c1ccccc1I=O 1458a_100000032414_200000210301 [1,1,0,0,0,0|2,0,0]=4 1441 B11R1.53 CC(=O)c1ccccc1S[13CH3] 62a_100000751169_200025704644 [1,1,0,0,0,0|2,0,0]=4 1442 B11R1.53 CC(O)c1ccccc1N[13CH3] 2230a_100011405641_200025704644 [1,1,0,0,0,0|1,0,1]=4 1443 B11R1.53 CCc1ccccc1C(=O)C 1458a_100000689120_200000210301 [1,1,0,0,0,0|2,0,0]=4 1444 B11R1.53 CCc1ccccc1C(=O)[13CH3] 1458a_100000689120_200025704644 [1,1,0,0,0,0|2,0,0]=4 1445 B11R1.53 CNc1ccccc1C(=O)N 34a_100000185089_200000210301 [1,1,0,0,0,0|1,0,0]=3 1446 B11R1.53 CNc1ccccc1C(C)O 2230a_100011405641_200000210301 [1,1,0,0,0,0|1,0,1]=4 1447 B11R1.53 CNc1cccnc1C(=O)N 27a_100102657272_200012359670 [1,1,0,0,0,0|2,0,0]=4 1448 B11R1.53 CNc1ccncc1C(=O)C 27a_100102657272_100160469449 [1,1,0,0,0,0|2,0,0]=4 1449 B11R1.53 CNc1ccncc1C(=O)N 27a_100102657272_100000697804 [1,1,0,0,0,0|2,0,0]=4 1450 B11R1.53 CNc1ncccc1C(=O)C 27a_100102657272_100009816689 [1,1,0,0,0,0|2,0,0]=4 1451 B11R1.53 CNc1ncccc1C(=O)N 27a_100102657272_100000162199 [1,1,0,0,0,0|2,0,0]=4 1452 B11R1.53 COc1ccccc1C(=O)C 1458a_100000185835_200000210301 [1,1,0,0,0,0|2,0,0]=4 1453 B11R1.53 COc1ccccc1C(=O)N 34a_100000192804_200000210301 [1,1,0,0,0,0|2,0,0]=4 1454 B11R1.53 COc1ccccc1C(=O)N 7a_100000192804_200000210301 [1,1,0,0,0,0|2,0,0]=4 1455 B11R1.53 COc1ccccc1C(=O)[13CH3] 1458a_100000185835_200025704644 [1,1,0,0,0,0|2,0,0]=4 1456 B11R1.53 COc1ccccc1C(=O)[O-] 7a_100015234032_200000210301 [1,1,0,0,0,0|1,0,1]=4 1457 B11R1.53 CSc1ccccc1C(=O)C 1458a_100000183967_200000210301 [1,1,0,0,0,0|2,0,0]=4 1458 B11R1.53 CSc1ccccc1C(=O)C 62a_100000751169_200000210301 [1,1,0,0,0,0|2,0,0]=4 1459 B11R1.53 CSc1ccccc1C(=O)N 62a_100000162227_200000210301 [1,1,0,0,0,0|2,0,0]=4 1460 B11R1.53 CSc1ccccc1C(=O)N 62a_200000210301_100000162227 [1,1,0,0,0,0|2,0,0]=4 1461 B11R1.53 CSc1ccccc1C(=O)O 62a_200000210301_100000734275 [1,1,0,0,0,0|1,0,0]=3 1462 B11R1.53 CSc1ccccc1C(=O)O 62a_202125556159_200000210301 [1,1,0,0,0,0|1,0,0]=3 1463 B11R1.53 CSc1ccccc1C(=O)[13CH3] 1458a_100000183967_200025704644 [1,1,0,0,0,0|2,0,0]=4 1464 B11R1.53 [13CH3]C(=O)c1ccccc1C#N 1458a_100000742908_200025704644 [1,1,0,0,0,0|1,0,1]=4 1465 B11R1.53 [13CH3]C(=O)c1ccccc1CO 1458a_100011301526_200025704644 [1,1,0,0,0,0|2,0,0]=4 1466 B11R1.53 [13CH3]C(=O)c1ccccc1I=O 1458a_100000032414_200025704644 [1,1,0,0,0,0|2,0,0]=4 1467 B11R1.53 [13CH3]Nc1ccccc1C(=O)N 34a_100000185089_200025704644 [1,1,0,0,0,0|1,0,0]=3 1468 B11R1.53 [13CH3]Oc1ccccc1C(=O)N 34a_100000192804_200025704644 [1,1,0,0,0,0|2,0,0]=4 1469 B11R1.53 [13CH3]Oc1ccccc1C(=O)N 7a_100000192804_200025704644 [1,1,0,0,0,0|2,0,0]=4 1470 B11R1.53 [13CH3]Oc1ccccc1C(=O)[O-] 7a_100015234032_200025704644 [1,1,0,0,0,0|1,0,1]=4 1471 B11R1.53 [13CH3]Sc1ccccc1C(=O)N 62a_100000162227_200025704644 [1,1,0,0,0,0|2,0,0]=4 1472 B11R1.53 [13CH3]Sc1ccccc1C(=O)N 62a_200025704644_100000162227 [1,1,0,0,0,0|2,0,0]=4 1473 B11R1.53 [13CH3]Sc1ccccc1C(=O)O 62a_200025704644_100000734275 [1,1,0,0,0,0|1,0,0]=3 1474 B11R1.53 [13CH3]Sc1ccccc1C(=O)O 62a_202125556159_200025704644 [1,1,0,0,0,0|1,0,0]=3 1475 B11R1.156 C=C(C)c1c(cccc1Br)N 271570a_100000694244_100020590159 [1,1,0,0,0,0|2,0,0]=4 1476 B11R1.156 C=C(C)c1c(cccc1Cl)N 271570a_100000694244_100000049713 [1,1,0,0,0,0|2,0,0]=4 1477 B11R1.156 C=C(C)c1c(cccc1F)N 271570a_100000694244_100011934729 [1,1,0,0,0,0|2,0,0]=4 1478 B11R1.156 C=C(C)c1c(cccc1N)C 271570a_100000694244_100000684715 [1,1,0,0,0,0|2,0,0]=4 1479 B11R1.156 C=C(C)c1c(cccc1O)N 271570a_100000694244_100012183704 [1,1,0,0,0,0|2,0,0]=4 1480 B11R1.156 CC(=O)c1c(cccc1Br)Br 1458a_100000690891_200000210301 [1,1,0,0,0,0|2,0,0]=4 1481 B11R1.156 CC(=O)c1c(cccc1Br)C 1458a_100000701904_200000210301 [1,1,0,0,0,0|2,0,0]=4 1482 B11R1.156 CC(=O)c1c(cccc1Br)Cl 1458a_100011253703_200000210301 [1,1,0,0,0,0|2,0,0]=4 1483 B11R1.156 CC(=O)c1c(cccc1Br)F 1458a_100000752694_200000210301 [1,1,0,0,0,0|2,0,0]=4 1484 B11R1.156 CC(=O)c1c(cccc1Br)O 1458a_100011935254_200000210301 [1,1,0,0,0,0|2,0,0]=4 1485 B11R1.156 CC(=O)c1c(cccc1C)C 1458a_100000758298_200000210301 [1,1,0,0,0,0|2,0,0]=4 1486 B11R1.156 CC(=O)c1c(cccc1Cl)C 1458a_100000692601_200000210301 [1,1,0,0,0,0|2,0,0]=4 1487 B11R1.156 CC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_200000210301 [1,1,0,0,0,0|2,0,0]=4 1488 B11R1.156 CC(=O)c1c(cccc1Cl)F 1458a_100000210369_200000210301 [1,1,0,0,0,0|2,0,0]=4 1489 B11R1.156 CC(=O)c1c(cccc1Cl)O 1458a_100000745519_200000210301 [1,1,0,0,0,0|2,0,0]=4 1490 B11R1.156 CC(=O)c1c(cccc1F)C 1458a_100000762013_200000210301 [1,1,0,0,0,0|2,0,0]=4 1491 B11R1.156 CC(=O)c1c(cccc1F)F 1458a_100000210804_200000210301 [1,1,0,0,0,0|2,0,0]=4 1492 B11R1.156 CC(=O)c1c(cccc1F)O 1458a_100000763259_200000210301 [1,1,0,0,0,0|2,0,0]=4 1493 B11R1.156 CC(=O)c1c(cccc1F)O 271570a_203496583355_100012351873 [1,1,0,0,0,0|2,0,0]=4 1494 B11R1.156 CC(=O)c1c(cccc1I)Br 1458a_100010232521_200000210301 [1,1,0,0,0,0|2,0,0]=4 1495 B11R1.156 CC(=O)c1c(cccc1I)C 1458a_100000688020_200000210301 [1,1,0,0,0,0|2,0,0]=4 1496 B11R1.156 CC(=O)c1c(cccc1I)Cl 1458a_100000702859_200000210301 [1,1,0,0,0,0|2,0,0]=4 1497 B11R1.156 CC(=O)c1c(cccc1I)F 1458a_100000023732_200000210301 [1,1,0,0,0,0|2,0,0]=4 1498 B11R1.156 CC(=O)c1c(cccc1O)C 1458a_100011934116_200000210301 [1,1,0,0,0,0|2,0,0]=4 1499 B11R1.156 CC(=O)c1c(cccc1O)O 1458a_100000755285_200000210301 [1,1,0,0,0,0|2,0,0]=4 1500 B11R1.156 CC(=O)c1c(cccc1O)O 271570a_203496583355_100010174959 [1,1,0,0,0,0|2,0,0]=4 1501 B11R1.156 CC(=O)c1c(ccnc1O)N 271570a_203496583355_200010729368 [1,1,0,0,0,0|2,0,0]=4 1502 B11R1.156 Cc1cccc(c1C(=O)[13CH3])Br 1458a_100000701904_200025704644 [1,1,0,0,0,0|2,0,0]=4 1503 B11R1.156 Cc1cccc(c1C(=O)[13CH3])C 1458a_100000758298_200025704644 [1,1,0,0,0,0|2,0,0]=4 1504 B11R1.156 Cc1cccc(c1C(=O)[13CH3])Cl 1458a_100000692601_200025704644 [1,1,0,0,0,0|2,0,0]=4 1505 B11R1.156 Cc1cccc(c1C(=O)[13CH3])F 1458a_100000762013_200025704644 [1,1,0,0,0,0|2,0,0]=4 1506 B11R1.156 Cc1cccc(c1C(=O)[13CH3])I 1458a_100000688020_200025704644 [1,1,0,0,0,0|2,0,0]=4 1507 B11R1.156 Cc1cccc(c1C(=O)[13CH3])O 1458a_100011934116_200025704644 [1,1,0,0,0,0|2,0,0]=4 1508 B11R1.156 NC(=O)c1c(cccc1Cl)O 271570a_203496583355_100010147686 [1,1,0,0,0,0|2,0,0]=4 1509 B11R1.156 NC(=O)c1c(cccc1F)O 271570a_203496583355_100011219063 [1,1,0,0,0,0|2,0,0]=4 1510 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)Br 1458a_100000690891_200025704644 [1,1,0,0,0,0|2,0,0]=4 1511 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)Cl 1458a_100011253703_200025704644 [1,1,0,0,0,0|2,0,0]=4 1512 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)F 1458a_100000752694_200025704644 [1,1,0,0,0,0|2,0,0]=4 1513 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)O 1458a_100011935254_200025704644 [1,1,0,0,0,0|2,0,0]=4 1514 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)Cl 1458a_100000210656_200025704644 [1,1,0,0,0,0|2,0,0]=4 1515 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)F 1458a_100000210369_200025704644 [1,1,0,0,0,0|2,0,0]=4 1516 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)O 1458a_100000745519_200025704644 [1,1,0,0,0,0|2,0,0]=4 1517 B11R1.156 [13CH3]C(=O)c1c(cccc1F)F 1458a_100000210804_200025704644 [1,1,0,0,0,0|2,0,0]=4 1518 B11R1.156 [13CH3]C(=O)c1c(cccc1F)O 1458a_100000763259_200025704644 [1,1,0,0,0,0|2,0,0]=4 1519 B11R1.156 [13CH3]C(=O)c1c(cccc1I)Br 1458a_100010232521_200025704644 [1,1,0,0,0,0|2,0,0]=4 1520 B11R1.156 [13CH3]C(=O)c1c(cccc1I)Cl 1458a_100000702859_200025704644 [1,1,0,0,0,0|2,0,0]=4 1521 B11R1.156 [13CH3]C(=O)c1c(cccc1I)F 1458a_100000023732_200025704644 [1,1,0,0,0,0|2,0,0]=4 1522 B11R1.156 [13CH3]C(=O)c1c(cccc1O)O 1458a_100000755285_200025704644 [1,1,0,0,0,0|2,0,0]=4 1523 B11R1.166 C=C(C)c1ccc(cc1N)Br 271570a_100000694244_100000743836 [1,1,0,0,0,0|2,0,0]=4 1524 B11R1.166 C=C(C)c1ccc(cc1N)C 271570a_100000694244_100011216686 [1,1,0,0,0,0|2,0,0]=4 1525 B11R1.166 C=C(C)c1ccc(cc1N)Cl 271570a_100000694244_100000761886 [1,1,0,0,0,0|2,0,0]=4 1526 B11R1.166 C=C(C)c1ccc(cc1N)F 271570a_100000694244_100011218093 [1,1,0,0,0,0|2,0,0]=4 1527 B11R1.166 C=C(C)c1ccc(cc1N)N 271570a_100000694244_200012175722 [1,1,0,0,0,0|2,0,0]=4 1528 B11R1.166 C=C(C)c1ccc(cc1N)O 271570a_100000694244_100011999798 [1,1,0,0,0,0|2,0,0]=4 1529 B11R1.166 CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_200000210301 [1,1,0,0,0,0|2,0,0]=4 1530 B11R1.166 CC(=O)c1ccc(cc1Br)C 1458a_100000685072_200000210301 [1,1,0,0,0,0|2,0,0]=4 1531 B11R1.166 CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200000210301 [1,1,0,0,0,0|2,0,0]=4 1532 B11R1.166 CC(=O)c1ccc(cc1Br)F 1458a_100000212304_200000210301 [1,1,0,0,0,0|2,0,0]=4 1533 B11R1.166 CC(=O)c1ccc(cc1Br)I 1458a_100012360512_200000210301 [1,1,0,0,0,0|2,0,0]=4 1534 B11R1.166 CC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000210301 [1,1,0,0,0,0|2,0,0]=4 1535 B11R1.166 CC(=O)c1ccc(cc1C)Br 1458a_100000741311_200000210301 [1,1,0,0,0,0|2,0,0]=4 1536 B11R1.166 CC(=O)c1ccc(cc1C)C 1458a_100000211164_200000210301 [1,1,0,0,0,0|2,0,0]=4 1537 B11R1.166 CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_200000210301 [1,1,0,0,0,0|2,0,0]=4 1538 B11R1.166 CC(=O)c1ccc(cc1C)F 1458a_100000686989_200000210301 [1,1,0,0,0,0|2,0,0]=4 1539 B11R1.166 CC(=O)c1ccc(cc1C)I 1458a_100010189873_200000210301 [1,1,0,0,0,0|2,0,0]=4 1540 B11R1.166 CC(=O)c1ccc(cc1C)O 1458a_100000692822_200000210301 [1,1,0,0,0,0|2,0,0]=4 1541 B11R1.166 CC(=O)c1ccc(cc1C)O 271570a_203496583355_100012360112 [1,1,0,0,0,0|2,0,0]=4 1542 B11R1.166 CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200000210301 [1,1,0,0,0,0|2,0,0]=4 1543 B11R1.166 CC(=O)c1ccc(cc1Cl)C 1458a_100000766932_200000210301 [1,1,0,0,0,0|2,0,0]=4 1544 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200000210301 [1,1,0,0,0,0|2,0,0]=4 1545 B11R1.166 CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_200000210301 [1,1,0,0,0,0|2,0,0]=4 1546 B11R1.166 CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_200000210301 [1,1,0,0,0,0|2,0,0]=4 1547 B11R1.166 CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000210301 [1,1,0,0,0,0|2,0,0]=4 1548 B11R1.166 CC(=O)c1ccc(cc1F)Br 1458a_100000214689_200000210301 [1,1,0,0,0,0|2,0,0]=4 1549 B11R1.166 CC(=O)c1ccc(cc1F)C 1458a_100000766033_200000210301 [1,1,0,0,0,0|2,0,0]=4 1550 B11R1.166 CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_200000210301 [1,1,0,0,0,0|2,0,0]=4 1551 B11R1.166 CC(=O)c1ccc(cc1F)F 1458a_100000211022_200000210301 [1,1,0,0,0,0|2,0,0]=4 1552 B11R1.166 CC(=O)c1ccc(cc1F)I 1458a_100000037189_200000210301 [1,1,0,0,0,0|2,0,0]=4 1553 B11R1.166 CC(=O)c1ccc(cc1F)O 1458a_100000689029_200000210301 [1,1,0,0,0,0|2,0,0]=4 1554 B11R1.166 CC(=O)c1ccc(cc1F)O 271570a_203496583355_100000690205 [1,1,0,0,0,0|2,0,0]=4 1555 B11R1.166 CC(=O)c1ccc(cc1I)Br 1458a_100000751167_200000210301 [1,1,0,0,0,0|2,0,0]=4 1556 B11R1.166 CC(=O)c1ccc(cc1I)C 1458a_100009999607_200000210301 [1,1,0,0,0,0|2,0,0]=4 1557 B11R1.166 CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_200000210301 [1,1,0,0,0,0|2,0,0]=4 1558 B11R1.166 CC(=O)c1ccc(cc1I)F 1458a_100000739341_200000210301 [1,1,0,0,0,0|2,0,0]=4 1559 B11R1.166 CC(=O)c1ccc(cc1N)O 271570a_203496583355_100011590516 [1,1,0,0,0,0|1,0,0]=3 1560 B11R1.166 CC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000210301 [1,1,0,0,0,0|2,0,0]=4 1561 B11R1.166 CC(=O)c1ccc(cc1O)C 1458a_100000212137_200000210301 [1,1,0,0,0,0|2,0,0]=4 1562 B11R1.166 CC(=O)c1ccc(cc1O)C 271570a_203496583355_100012353930 [1,1,0,0,0,0|2,0,0]=4 1563 B11R1.166 CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000210301 [1,1,0,0,0,0|2,0,0]=4 1564 B11R1.166 CC(=O)c1ccc(cc1O)F 1458a_100000746061_200000210301 [1,1,0,0,0,0|2,0,0]=4 1565 B11R1.166 CC(=O)c1ccc(cc1O)F 271570a_203496583355_100000686192 [1,1,0,0,0,0|2,0,0]=4 1566 B11R1.166 CC(=O)c1ccc(cc1O)I 1458a_100000091984_200000210301 [1,1,0,0,0,0|2,0,0]=4 1567 B11R1.166 CC(=O)c1ccc(cc1O)O 1458a_100000212172_200000210301 [1,1,0,0,0,0|2,0,0]=4 1568 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100000188348 [1,1,0,0,0,0|2,0,0]=4 1569 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100012340537 [1,1,0,0,0,0|2,0,0]=4 1570 B11R1.166 Cc1cc(ccc1C(=O)N)O 271570a_203496583355_100011327924 [1,1,0,0,0,0|2,0,0]=4 1571 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Br 1458a_100000741311_200025704644 [1,1,0,0,0,0|2,0,0]=4 1572 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000688705_200025704644 [1,1,0,0,0,0|2,0,0]=4 1573 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])F 1458a_100000686989_200025704644 [1,1,0,0,0,0|2,0,0]=4 1574 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])I 1458a_100010189873_200025704644 [1,1,0,0,0,0|2,0,0]=4 1575 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])O 1458a_100000692822_200025704644 [1,1,0,0,0,0|2,0,0]=4 1576 B11R1.166 Cc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000685072_200025704644 [1,1,0,0,0,0|2,0,0]=4 1577 B11R1.166 Cc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000211164_200025704644 [1,1,0,0,0,0|2,0,0]=4 1578 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000766932_200025704644 [1,1,0,0,0,0|2,0,0]=4 1579 B11R1.166 Cc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000766033_200025704644 [1,1,0,0,0,0|2,0,0]=4 1580 B11R1.166 Cc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100009999607_200025704644 [1,1,0,0,0,0|2,0,0]=4 1581 B11R1.166 Cc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212137_200025704644 [1,1,0,0,0,0|2,0,0]=4 1582 B11R1.166 NC(=O)c1ccc(cc1Br)O 271570a_203496583355_200010146565 [1,1,0,0,0,0|2,0,0]=4 1583 B11R1.166 NC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216903 [1,1,0,0,0,0|2,0,0]=4 1584 B11R1.166 NC(=O)c1ccc(cc1N)O 271570a_203496583355_100012349972 [1,1,0,0,0,0|1,0,0]=3 1585 B11R1.166 NC(=O)c1ccc(cc1O)Br 271570a_203496583355_100009815748 [1,1,0,0,0,0|2,0,0]=4 1586 B11R1.166 NC(=O)c1ccc(cc1O)F 271570a_203496583355_100000206404 [1,1,0,0,0,0|2,0,0]=4 1587 B11R1.166 NC(=O)c1ccc(cc1O)O 271570a_203496583355_100011550861 [1,1,0,0,0,0|2,0,0]=4 1588 B11R1.166 NC(=O)c1ccc(nc1N)O 271570a_203496583355_100009875182 [1,1,0,0,0,0|2,0,0]=4 1589 B11R1.166 NC(=O)c1ncc(cc1N)O 271570a_203496583355_100010235749 [1,1,0,0,0,0|2,0,0]=4 1590 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Br 1458a_100000762965_200025704644 [1,1,0,0,0,0|2,0,0]=4 1591 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200025704644 [1,1,0,0,0,0|2,0,0]=4 1592 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)F 1458a_100000212304_200025704644 [1,1,0,0,0,0|2,0,0]=4 1593 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)I 1458a_100012360512_200025704644 [1,1,0,0,0,0|2,0,0]=4 1594 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)O 1458a_100012344906_200025704644 [1,1,0,0,0,0|2,0,0]=4 1595 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200025704644 [1,1,0,0,0,0|2,0,0]=4 1596 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200025704644 [1,1,0,0,0,0|2,0,0]=4 1597 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)F 1458a_100000211397_200025704644 [1,1,0,0,0,0|2,0,0]=4 1598 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)I 1458a_100000751301_200025704644 [1,1,0,0,0,0|2,0,0]=4 1599 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)O 1458a_100000702456_200025704644 [1,1,0,0,0,0|2,0,0]=4 1600 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Br 1458a_100000214689_200025704644 [1,1,0,0,0,0|2,0,0]=4 1601 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Cl 1458a_100000212326_200025704644 [1,1,0,0,0,0|2,0,0]=4 1602 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)F 1458a_100000211022_200025704644 [1,1,0,0,0,0|2,0,0]=4 1603 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)I 1458a_100000037189_200025704644 [1,1,0,0,0,0|2,0,0]=4 1604 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)O 1458a_100000689029_200025704644 [1,1,0,0,0,0|2,0,0]=4 1605 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Br 1458a_100000751167_200025704644 [1,1,0,0,0,0|2,0,0]=4 1606 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Cl 1458a_100000739380_200025704644 [1,1,0,0,0,0|2,0,0]=4 1607 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)F 1458a_100000739341_200025704644 [1,1,0,0,0,0|2,0,0]=4 1608 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Br 1458a_100000744433_200025704644 [1,1,0,0,0,0|2,0,0]=4 1609 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Cl 1458a_100000188622_200025704644 [1,1,0,0,0,0|2,0,0]=4 1610 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)F 1458a_100000746061_200025704644 [1,1,0,0,0,0|2,0,0]=4 1611 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)I 1458a_100000091984_200025704644 [1,1,0,0,0,0|2,0,0]=4 1612 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)O 1458a_100000212172_200025704644 [1,1,0,0,0,0|2,0,0]=4 1613 B11R1.167 C=C(C)c1cc(ccc1N)Br 271570a_100000694244_100000187925 [1,1,0,0,0,0|2,0,0]=4 1614 B11R1.167 C=C(C)c1cc(ccc1N)C 271570a_100000694244_100000210942 [1,1,0,0,0,0|2,0,0]=4 1615 B11R1.167 C=C(C)c1cc(ccc1N)Cl 271570a_100000694244_100000761889 [1,1,0,0,0,0|2,0,0]=4 1616 B11R1.167 C=C(C)c1cc(ccc1N)F 271570a_100000694244_100000760547 [1,1,0,0,0,0|2,0,0]=4 1617 B11R1.167 C=C(C)c1cc(ccc1N)N 271570a_100000694244_100011534242 [1,1,0,0,0,0|2,0,0]=4 1618 B11R1.167 C=C(C)c1cc(ccc1N)O 271570a_100000694244_100012001276 [1,1,0,0,0,0|2,0,0]=4 1619 B11R1.167 CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_200000210301 [1,1,0,0,0,0|2,0,0]=4 1620 B11R1.167 CC(=O)c1cc(ccc1Br)C 1458a_100000689033_200000210301 [1,1,0,0,0,0|2,0,0]=4 1621 B11R1.167 CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200000210301 [1,1,0,0,0,0|2,0,0]=4 1622 B11R1.167 CC(=O)c1cc(ccc1Br)F 1458a_100000212315_200000210301 [1,1,0,0,0,0|2,0,0]=4 1623 B11R1.167 CC(=O)c1cc(ccc1Br)I 1458a_100000698340_200000210301 [1,1,0,0,0,0|2,0,0]=4 1624 B11R1.167 CC(=O)c1cc(ccc1Br)O 1458a_100012352043_200000210301 [1,1,0,0,0,0|2,0,0]=4 1625 B11R1.167 CC(=O)c1cc(ccc1C)Br 1458a_100000759961_200000210301 [1,1,0,0,0,0|2,0,0]=4 1626 B11R1.167 CC(=O)c1cc(ccc1C)C 1458a_100000195421_200000210301 [1,1,0,0,0,0|2,0,0]=4 1627 B11R1.167 CC(=O)c1cc(ccc1C)Cl 1458a_100000692595_200000210301 [1,1,0,0,0,0|2,0,0]=4 1628 B11R1.167 CC(=O)c1cc(ccc1C)F 1458a_100000240043_200000210301 [1,1,0,0,0,0|2,0,0]=4 1629 B11R1.167 CC(=O)c1cc(ccc1C)I 1458a_100000688012_200000210301 [1,1,0,0,0,0|2,0,0]=4 1630 B11R1.167 CC(=O)c1cc(ccc1C)O 1458a_100000687834_200000210301 [1,1,0,0,0,0|2,0,0]=4 1631 B11R1.167 CC(=O)c1cc(ccc1C)O 271570a_203496583355_100012706819 [1,1,0,0,0,0|2,0,0]=4 1632 B11R1.167 CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200000210301 [1,1,0,0,0,0|2,0,0]=4 1633 B11R1.167 CC(=O)c1cc(ccc1Cl)C 1458a_100011290873_200000210301 [1,1,0,0,0,0|2,0,0]=4 1634 B11R1.167 CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200000210301 [1,1,0,0,0,0|2,0,0]=4 1635 B11R1.167 CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_200000210301 [1,1,0,0,0,0|2,0,0]=4 1636 B11R1.167 CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_200000210301 [1,1,0,0,0,0|2,0,0]=4 1637 B11R1.167 CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_200000210301 [1,1,0,0,0,0|2,0,0]=4 1638 B11R1.167 CC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100010712560 [1,1,0,0,0,0|2,0,0]=4 1639 B11R1.167 CC(=O)c1cc(ccc1F)Br 1458a_100000212322_200000210301 [1,1,0,0,0,0|2,0,0]=4 1640 B11R1.167 CC(=O)c1cc(ccc1F)C 1458a_100000749327_200000210301 [1,1,0,0,0,0|2,0,0]=4 1641 B11R1.167 CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_200000210301 [1,1,0,0,0,0|2,0,0]=4 1642 B11R1.167 CC(=O)c1cc(ccc1F)F 1458a_100000198512_200000210301 [1,1,0,0,0,0|2,0,0]=4 1643 B11R1.167 CC(=O)c1cc(ccc1F)I 1458a_100000688014_200000210301 [1,1,0,0,0,0|2,0,0]=4 1644 B11R1.167 CC(=O)c1cc(ccc1F)O 1458a_100000037260_200000210301 [1,1,0,0,0,0|2,0,0]=4 1645 B11R1.167 CC(=O)c1cc(ccc1F)O 271570a_203496583355_100000689017 [1,1,0,0,0,0|2,0,0]=4 1646 B11R1.167 CC(=O)c1cc(ccc1I)Br 1458a_100000183945_200000210301 [1,1,0,0,0,0|2,0,0]=4 1647 B11R1.167 CC(=O)c1cc(ccc1I)C 1458a_100000057929_200000210301 [1,1,0,0,0,0|2,0,0]=4 1648 B11R1.167 CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_200000210301 [1,1,0,0,0,0|2,0,0]=4 1649 B11R1.167 CC(=O)c1cc(ccc1I)F 1458a_100000748905_200000210301 [1,1,0,0,0,0|2,0,0]=4 1650 B11R1.167 CC(=O)c1cc(ccc1I)I 1458a_100000750460_200000210301 [1,1,0,0,0,0|2,0,0]=4 1651 B11R1.167 CC(=O)c1cc(ccc1I)O 1458a_200009995701_200000210301 [1,1,0,0,0,0|2,0,0]=4 1652 B11R1.167 CC(=O)c1cc(ccc1N)O 271570a_203496583355_100000695420 [1,1,0,0,0,0|1,0,0]=3 1653 B11R1.167 CC(=O)c1cc(ccc1O)Br 1458a_100000212140_200000210301 [1,1,0,0,0,0|2,0,0]=4 1654 B11R1.167 CC(=O)c1cc(ccc1O)Br 271570a_203496583355_100012349576 [1,1,0,0,0,0|2,0,0]=4 1655 B11R1.167 CC(=O)c1cc(ccc1O)C 1458a_100000229998_200000210301 [1,1,0,0,0,0|2,0,0]=4 1656 B11R1.167 CC(=O)c1cc(ccc1O)C 271570a_203496583355_100012361225 [1,1,0,0,0,0|2,0,0]=4 1657 B11R1.167 CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_200000210301 [1,1,0,0,0,0|2,0,0]=4 1658 B11R1.167 CC(=O)c1cc(ccc1O)F 1458a_100000742286_200000210301 [1,1,0,0,0,0|2,0,0]=4 1659 B11R1.167 CC(=O)c1cc(ccc1O)F 271570a_203496583355_100012353695 [1,1,0,0,0,0|2,0,0]=4 1660 B11R1.167 CC(=O)c1cc(ccc1O)I 1458a_100000212111_200000210301 [1,1,0,0,0,0|2,0,0]=4 1661 B11R1.167 CC(=O)c1cc(ccc1O)N 271570a_203496583355_100012349454 [1,1,0,0,0,0|2,0,0]=4 1662 B11R1.167 CC(=O)c1cc(ccc1O)O 1458a_100000758025_200000210301 [1,1,0,0,0,0|2,0,0]=4 1663 B11R1.167 CC(=O)c1cc(ccc1O)O 271570a_203496583355_100000212127 [1,1,0,0,0,0|2,0,0]=4 1664 B11R1.167 CC(=O)c1cc(cnc1N)O 271570a_203496583355_100010173950 [1,1,0,0,0,0|2,0,0]=4 1665 B11R1.167 Cc1ccc(c(c1)C(=O)N)O 271570a_203496583355_200012349609 [1,1,0,0,0,0|2,0,0]=4 1666 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Br 1458a_100000689033_200025704644 [1,1,0,0,0,0|2,0,0]=4 1667 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])C 1458a_100000195421_200025704644 [1,1,0,0,0,0|2,0,0]=4 1668 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100011290873_200025704644 [1,1,0,0,0,0|2,0,0]=4 1669 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])F 1458a_100000749327_200025704644 [1,1,0,0,0,0|2,0,0]=4 1670 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])I 1458a_100000057929_200025704644 [1,1,0,0,0,0|2,0,0]=4 1671 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000229998_200025704644 [1,1,0,0,0,0|2,0,0]=4 1672 B11R1.167 Cc1ccc(cc1C(=O)N)O 271570a_203496583355_100012257281 [1,1,0,0,0,0|2,0,0]=4 1673 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Br 1458a_100000759961_200025704644 [1,1,0,0,0,0|2,0,0]=4 1674 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Cl 1458a_100000692595_200025704644 [1,1,0,0,0,0|2,0,0]=4 1675 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])F 1458a_100000240043_200025704644 [1,1,0,0,0,0|2,0,0]=4 1676 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])I 1458a_100000688012_200025704644 [1,1,0,0,0,0|2,0,0]=4 1677 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])O 1458a_100000687834_200025704644 [1,1,0,0,0,0|2,0,0]=4 1678 B11R1.167 NC(=O)c1cc(ccc1F)O 271570a_203496583355_100000162119 [1,1,0,0,0,0|2,0,0]=4 1679 B11R1.167 NC(=O)c1cc(ccc1N)O 271570a_203496583355_100000740421 [1,1,0,0,0,0|1,0,0]=3 1680 B11R1.167 NC(=O)c1cc(ccc1O)Br 271570a_203496583355_200000162314 [1,1,0,0,0,0|2,0,0]=4 1681 B11R1.167 NC(=O)c1cc(ccc1O)F 271570a_203496583355_100000206434 [1,1,0,0,0,0|2,0,0]=4 1682 B11R1.167 NC(=O)c1cc(ccc1O)N 271570a_203496583355_100015186447 [1,1,0,0,0,0|2,0,0]=4 1683 B11R1.167 NC(=O)c1cc(ccc1O)O 271570a_203496583355_100000192807 [1,1,0,0,0,0|2,0,0]=4 1684 B11R1.167 NC(=O)c1cc(cnc1N)O 271570a_203496583355_100000701294 [1,1,0,0,0,0|2,0,0]=4 1685 B11R1.167 NC(=O)c1cc(ncc1N)O 271570a_203496583355_100012003536 [1,1,0,0,0,0|2,0,0]=4 1686 B11R1.167 NC(=O)c1nc(ccc1N)O 271570a_203496583355_100000093116 [1,1,0,0,0,0|2,0,0]=4 1687 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Br 1458a_100000690610_200025704644 [1,1,0,0,0,0|2,0,0]=4 1688 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200025704644 [1,1,0,0,0,0|2,0,0]=4 1689 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)F 1458a_100000212315_200025704644 [1,1,0,0,0,0|2,0,0]=4 1690 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)I 1458a_100000698340_200025704644 [1,1,0,0,0,0|2,0,0]=4 1691 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)O 1458a_100012352043_200025704644 [1,1,0,0,0,0|2,0,0]=4 1692 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200025704644 [1,1,0,0,0,0|2,0,0]=4 1693 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200025704644 [1,1,0,0,0,0|2,0,0]=4 1694 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)F 1458a_100011219680_200025704644 [1,1,0,0,0,0|2,0,0]=4 1695 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)I 1458a_100000688013_200025704644 [1,1,0,0,0,0|2,0,0]=4 1696 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)O 1458a_100000719527_200025704644 [1,1,0,0,0,0|2,0,0]=4 1697 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Br 1458a_100000212322_200025704644 [1,1,0,0,0,0|2,0,0]=4 1698 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Cl 1458a_100000214954_200025704644 [1,1,0,0,0,0|2,0,0]=4 1699 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)F 1458a_100000198512_200025704644 [1,1,0,0,0,0|2,0,0]=4 1700 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)I 1458a_100000688014_200025704644 [1,1,0,0,0,0|2,0,0]=4 1701 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)O 1458a_100000037260_200025704644 [1,1,0,0,0,0|2,0,0]=4 1702 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Br 1458a_100000183945_200025704644 [1,1,0,0,0,0|2,0,0]=4 1703 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Cl 1458a_100000739379_200025704644 [1,1,0,0,0,0|2,0,0]=4 1704 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)F 1458a_100000748905_200025704644 [1,1,0,0,0,0|2,0,0]=4 1705 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)I 1458a_100000750460_200025704644 [1,1,0,0,0,0|2,0,0]=4 1706 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)O 1458a_200009995701_200025704644 [1,1,0,0,0,0|2,0,0]=4 1707 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Br 1458a_100000212140_200025704644 [1,1,0,0,0,0|2,0,0]=4 1708 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Cl 1458a_100000212143_200025704644 [1,1,0,0,0,0|2,0,0]=4 1709 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)F 1458a_100000742286_200025704644 [1,1,0,0,0,0|2,0,0]=4 1710 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)I 1458a_100000212111_200025704644 [1,1,0,0,0,0|2,0,0]=4 1711 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)O 1458a_100000758025_200025704644 [1,1,0,0,0,0|2,0,0]=4 1712 B11R1.222 CC(O[13CH3])c1ccccc1N 7a_100011405641_200025704644 [1,1,0,0,0,0|1,0,1]=4 1713 B11R1.222 CCC(=O)c1ccccc1Br 1458a_100000188424_100000210202 [1,1,0,0,0,0|2,0,0]=4 1714 B11R1.222 CCC(=O)c1ccccc1C 1458a_100000212026_100000210202 [1,1,0,0,0,0|2,0,0]=4 1715 B11R1.222 CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210202 [1,1,0,0,0,0|2,0,0]=4 1716 B11R1.222 CCC(=O)c1ccccc1F 1458a_100000188656_100000210202 [1,1,0,0,0,0|2,0,0]=4 1717 B11R1.222 CCC(=O)c1ccccc1I 1458a_100000187884_100000210202 [1,1,0,0,0,0|2,0,0]=4 1718 B11R1.222 CCC(=O)c1ccccc1O 1458a_100015234032_100000210202 [1,1,0,0,0,0|2,0,0]=4 1719 B11R1.222 CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210202 [1,1,0,0,0,0|2,0,0]=4 1720 B11R1.222 CNC(=O)c1ccccc1Br 11a_106832991635_100000188424 [1,1,0,0,0,0|2,0,0]=4 1721 B11R1.222 CNC(=O)c1ccccc1Br 1626a_100102657272_100000188424 [1,1,0,0,0,0|2,0,0]=4 1722 B11R1.222 CNC(=O)c1ccccc1Br 240690a_100102657272_100000188424 [1,1,0,0,0,0|2,0,0]=4 1723 B11R1.222 CNC(=O)c1ccccc1Br 527a_100102657272_100000188424 [1,1,0,0,0,0|2,0,0]=4 1724 B11R1.222 CNC(=O)c1ccccc1C 11a_106832991635_100000212026 [1,1,0,0,0,0|2,0,0]=4 1725 B11R1.222 CNC(=O)c1ccccc1C 1626a_100102657272_100000212026 [1,1,0,0,0,0|2,0,0]=4 1726 B11R1.222 CNC(=O)c1ccccc1C 240690a_100102657272_100000212026 [1,1,0,0,0,0|2,0,0]=4 1727 B11R1.222 CNC(=O)c1ccccc1C 527a_100102657272_100000212026 [1,1,0,0,0,0|2,0,0]=4 1728 B11R1.222 CNC(=O)c1ccccc1Cl 11a_106832991635_100000185844 [1,1,0,0,0,0|2,0,0]=4 1729 B11R1.222 CNC(=O)c1ccccc1Cl 1626a_100102657272_100000185844 [1,1,0,0,0,0|2,0,0]=4 1730 B11R1.222 CNC(=O)c1ccccc1Cl 240690a_100102657272_100000185844 [1,1,0,0,0,0|2,0,0]=4 1731 B11R1.222 CNC(=O)c1ccccc1Cl 527a_100102657272_100000185844 [1,1,0,0,0,0|2,0,0]=4 1732 B11R1.222 CNC(=O)c1ccccc1F 11a_106832991635_100000188656 [1,1,0,0,0,0|2,0,0]=4 1733 B11R1.222 CNC(=O)c1ccccc1F 1626a_100102657272_100000188656 [1,1,0,0,0,0|2,0,0]=4 1734 B11R1.222 CNC(=O)c1ccccc1F 240690a_100102657272_100000188656 [1,1,0,0,0,0|2,0,0]=4 1735 B11R1.222 CNC(=O)c1ccccc1F 527a_100102657272_100000188656 [1,1,0,0,0,0|2,0,0]=4 1736 B11R1.222 CNC(=O)c1ccccc1I 11a_106832991635_100000187884 [1,1,0,0,0,0|2,0,0]=4 1737 B11R1.222 CNC(=O)c1ccccc1I 1626a_100102657272_100000187884 [1,1,0,0,0,0|2,0,0]=4 1738 B11R1.222 CNC(=O)c1ccccc1I 240690a_100102657272_100000187884 [1,1,0,0,0,0|2,0,0]=4 1739 B11R1.222 CNC(=O)c1ccccc1I 527a_100102657272_100000187884 [1,1,0,0,0,0|2,0,0]=4 1740 B11R1.222 CNC(=O)c1ccccc1O 240690a_100102657272_100015234032 [1,1,0,0,0,0|2,0,0]=4 1741 B11R1.222 CNC(=O)c1ccccc1O 271570a_203496583355_100000155073 [1,1,0,0,0,0|2,0,0]=4 1742 B11R1.222 CNC(=O)c1ccccc1[O-] 1626a_100102657272_100009911694 [1,1,0,0,0,0|2,0,0]=4 1743 B11R1.222 CNC(=O)c1ccccc1[O-] 240690a_100102657272_100009911694 [1,1,0,0,0,0|2,0,0]=4 1744 B11R1.222 CNC(=O)c1ccccc1[O-] 527a_100102657272_100009911694 [1,1,0,0,0,0|2,0,0]=4 1745 B11R1.222 COC(=O)c1ccccc1O 271570a_203496583355_100000148710 [1,1,0,0,0,0|1,0,0]=3 1746 B11R1.222 COC(=O)c1cccnc1O 271570a_203496583355_100000150852 [1,1,0,0,0,0|2,0,0]=4 1747 B11R1.222 COC(=O)c1ccncc1O 271570a_203496583355_100010008606 [1,1,0,0,0,0|2,0,0]=4 1748 B11R1.222 COC(=O)c1cnccc1O 271570a_203496583355_100020629055 [1,1,0,0,0,0|2,0,0]=4 1749 B11R1.222 COC(=O)c1ncccc1O 271570a_203496583355_100011935214 [1,1,0,0,0,0|2,0,0]=4 1750 B11R1.222 COC(C)c1ccccc1N 7a_100011405641_200000210301 [1,1,0,0,0,0|1,0,1]=4 1751 B11R1.222 Cc1ccccc1C(=O)CF 1458a_100000212026_100015361967 [1,1,0,0,0,0|2,0,0]=4 1752 B11R1.222 NNC(=O)c1ccccc1O 271570a_203496583355_100000190081 [1,1,0,0,0,0|2,0,0]=4 1753 B11R1.222 O=C(CF)c1ccccc1Br 1458a_100000188424_100015361967 [1,1,0,0,0,0|2,0,0]=4 1754 B11R1.222 O=C(CF)c1ccccc1Cl 1458a_100000185844_100015361967 [1,1,0,0,0,0|2,0,0]=4 1755 B11R1.222 O=C(CF)c1ccccc1F 1458a_100000188656_100015361967 [1,1,0,0,0,0|2,0,0]=4 1756 B11R1.222 O=C(CF)c1ccccc1I 1458a_100000187884_100015361967 [1,1,0,0,0,0|2,0,0]=4 1757 B11R1.222 O=C(CF)c1ccccc1O 1458a_100015234032_100015361967 [1,1,0,0,0,0|2,0,0]=4 1758 B11R1.222 O=C(CF)c1ccccc1[O-] 1458a_100009911694_100015361967 [1,1,0,0,0,0|2,0,0]=4 1759 B11R1.21 C=C(C)c1ccc(c(c1)O)Br 271570a_100000694244_100012356990 [1,1,0,0,0,0|2,0,0]=4 1760 B11R1.21 C=C(C)c1ccc(c(c1)O)C 271570a_100000694244_100000766334 [1,1,0,0,0,0|2,0,0]=4 1761 B11R1.21 C=C(C)c1ccc(c(c1)O)Cl 271570a_100000694244_100011356854 [1,1,0,0,0,0|2,0,0]=4 1762 B11R1.21 C=C(C)c1ccc(c(c1)O)F 271570a_100000694244_100000686035 [1,1,0,0,0,0|2,0,0]=4 1763 B11R1.21 C=C(C)c1ccc(c(c1)O)N 271570a_100000694244_100000739049 [1,1,0,0,0,0|2,0,0]=4 1764 B11R1.21 C=C(C)c1ccc(c(c1)O)O 271570a_100000694244_100009813601 [1,1,0,0,0,0|2,0,0]=4 1765 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200000210301 [1,1,0,0,0,0|2,0,0]=4 1766 B11R1.21 CC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_200000210301 [1,1,0,0,0,0|2,0,0]=4 1767 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200000210301 [1,1,0,0,0,0|2,0,0]=4 1768 B11R1.21 CC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200000210301 [1,1,0,0,0,0|2,0,0]=4 1769 B11R1.21 CC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200000210301 [1,1,0,0,0,0|2,0,0]=4 1770 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200000210301 [1,1,0,0,0,0|2,0,0]=4 1771 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100010146554 [1,1,0,0,0,0|2,0,0]=4 1772 B11R1.21 CC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_200000210301 [1,1,0,0,0,0|2,0,0]=4 1773 B11R1.21 CC(=O)c1ccc(c(c1)C)C 1458a_100000210898_200000210301 [1,1,0,0,0,0|2,0,0]=4 1774 B11R1.21 CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_200000210301 [1,1,0,0,0,0|2,0,0]=4 1775 B11R1.21 CC(=O)c1ccc(c(c1)C)F 1458a_100000751819_200000210301 [1,1,0,0,0,0|2,0,0]=4 1776 B11R1.21 CC(=O)c1ccc(c(c1)C)I 1458a_100000751300_200000210301 [1,1,0,0,0,0|2,0,0]=4 1777 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [1,1,0,0,0,0|2,0,0]=4 1778 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [1,1,0,0,0,0|2,0,0]=4 1779 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200000210301 [1,1,0,0,0,0|2,0,0]=4 1780 B11R1.21 CC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_200000210301 [1,1,0,0,0,0|2,0,0]=4 1781 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200000210301 [1,1,0,0,0,0|2,0,0]=4 1782 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200000210301 [1,1,0,0,0,0|2,0,0]=4 1783 B11R1.21 CC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200000210301 [1,1,0,0,0,0|2,0,0]=4 1784 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200000210301 [1,1,0,0,0,0|2,0,0]=4 1785 B11R1.21 CC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200000210301 [1,1,0,0,0,0|2,0,0]=4 1786 B11R1.21 CC(=O)c1ccc(c(c1)F)C 1458a_100000212313_200000210301 [1,1,0,0,0,0|2,0,0]=4 1787 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200000210301 [1,1,0,0,0,0|2,0,0]=4 1788 B11R1.21 CC(=O)c1ccc(c(c1)F)F 1458a_100000209822_200000210301 [1,1,0,0,0,0|2,0,0]=4 1789 B11R1.21 CC(=O)c1ccc(c(c1)F)I 1458a_100000062624_200000210301 [1,1,0,0,0,0|2,0,0]=4 1790 B11R1.21 CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_200000210301 [1,1,0,0,0,0|2,0,0]=4 1791 B11R1.21 CC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000690002 [1,1,0,0,0,0|2,0,0]=4 1792 B11R1.21 CC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200000210301 [1,1,0,0,0,0|2,0,0]=4 1793 B11R1.21 CC(=O)c1ccc(c(c1)I)C 1458a_100000751299_200000210301 [1,1,0,0,0,0|2,0,0]=4 1794 B11R1.21 CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200000210301 [1,1,0,0,0,0|2,0,0]=4 1795 B11R1.21 CC(=O)c1ccc(c(c1)I)F 1458a_100000688015_200000210301 [1,1,0,0,0,0|2,0,0]=4 1796 B11R1.21 CC(=O)c1ccc(c(c1)I)I 1458a_100000725830_200000210301 [1,1,0,0,0,0|2,0,0]=4 1797 B11R1.21 CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_200000210301 [1,1,0,0,0,0|2,0,0]=4 1798 B11R1.21 CC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100009816534 [1,1,0,0,0,0|2,0,0]=4 1799 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200000210301 [1,1,0,0,0,0|1,0,0]=3 1800 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100010146556 [1,1,0,0,0,0|1,0,0]=3 1801 B11R1.21 CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_200000210301 [1,1,0,0,0,0|1,0,0]=3 1802 B11R1.21 CC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011934287 [1,1,0,0,0,0|1,0,0]=3 1803 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200000210301 [1,1,0,0,0,0|1,0,0]=3 1804 B11R1.21 CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_200000210301 [1,1,0,0,0,0|1,0,0]=3 1805 B11R1.21 CC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000239719 [1,1,0,0,0,0|1,0,0]=3 1806 B11R1.21 CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_200000210301 [1,1,0,0,0,0|1,0,0]=3 1807 B11R1.21 CC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100012029215 [1,1,0,0,0,0|1,0,0]=3 1808 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [1,1,0,0,0,0|1,0,0]=3 1809 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [1,1,0,0,0,0|1,0,0]=3 1810 B11R1.21 CC(=O)c1cnc(c(c1)O)F 271570a_203496583355_200010135287 [1,1,0,0,0,0|2,0,0]=4 1811 B11R1.21 CC(O)c1ccc(c(c1)O)F 271570a_203496583355_100011191524 [1,1,0,0,0,0|1,0,1]=4 1812 B11R1.21 Cc1cc(ccc1Br)C(=O)[13CH3] 1458a_100000692631_200025704644 [1,1,0,0,0,0|2,0,0]=4 1813 B11R1.21 Cc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000686306_200025704644 [1,1,0,0,0,0|2,0,0]=4 1814 B11R1.21 Cc1cc(ccc1F)C(=O)[13CH3] 1458a_100000751819_200025704644 [1,1,0,0,0,0|2,0,0]=4 1815 B11R1.21 Cc1cc(ccc1I)C(=O)[13CH3] 1458a_100000751300_200025704644 [1,1,0,0,0,0|2,0,0]=4 1816 B11R1.21 Cc1cc(ccc1O)C(=O)N 271570a_203496583355_100011218126 [1,1,0,0,0,0|2,0,0]=4 1817 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [1,1,0,0,0,0|2,0,0]=4 1818 B11R1.21 Cc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000186397_200025704644 [1,1,0,0,0,0|2,0,0]=4 1819 B11R1.21 Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100000210898_200025704644 [1,1,0,0,0,0|2,0,0]=4 1820 B11R1.21 Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000751740_200025704644 [1,1,0,0,0,0|2,0,0]=4 1821 B11R1.21 Cc1ccc(cc1F)C(=O)[13CH3] 1458a_100000212313_200025704644 [1,1,0,0,0,0|2,0,0]=4 1822 B11R1.21 Cc1ccc(cc1I)C(=O)[13CH3] 1458a_100000751299_200025704644 [1,1,0,0,0,0|2,0,0]=4 1823 B11R1.21 Cc1ccc(cc1O)B(O)O 271570a_203496583355_200010223333 [1,1,0,0,0,0|1,0,1]=4 1824 B11R1.21 Cc1ccc(cc1O)C(=O)N 271570a_203496583355_100000186401 [1,1,0,0,0,0|1,0,0]=3 1825 B11R1.21 Cc1ccc(cc1O)C(=O)[13CH3] 1458a_100000233767_200025704644 [1,1,0,0,0,0|1,0,0]=3 1826 B11R1.21 NC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100009814583 [1,1,0,0,0,0|2,0,0]=4 1827 B11R1.21 NC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000686215 [1,1,0,0,0,0|2,0,0]=4 1828 B11R1.21 NC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011202321 [1,1,0,0,0,0|1,0,0]=3 1829 B11R1.21 NC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012344895 [1,1,0,0,0,0|1,0,0]=3 1830 B11R1.21 OB(O)c1ccc(c(c1)O)F 271570a_203496583355_100010175509 [1,1,0,0,0,0|1,0,1]=4 1831 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200025704644 [1,1,0,0,0,0|2,0,0]=4 1832 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200025704644 [1,1,0,0,0,0|2,0,0]=4 1833 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200025704644 [1,1,0,0,0,0|2,0,0]=4 1834 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200025704644 [1,1,0,0,0,0|2,0,0]=4 1835 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200025704644 [1,1,0,0,0,0|2,0,0]=4 1836 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200025704644 [1,1,0,0,0,0|2,0,0]=4 1837 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200025704644 [1,1,0,0,0,0|2,0,0]=4 1838 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200025704644 [1,1,0,0,0,0|2,0,0]=4 1839 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200025704644 [1,1,0,0,0,0|2,0,0]=4 1840 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200025704644 [1,1,0,0,0,0|2,0,0]=4 1841 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200025704644 [1,1,0,0,0,0|2,0,0]=4 1842 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200025704644 [1,1,0,0,0,0|2,0,0]=4 1843 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)F 1458a_100000209822_200025704644 [1,1,0,0,0,0|2,0,0]=4 1844 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)I 1458a_100000062624_200025704644 [1,1,0,0,0,0|2,0,0]=4 1845 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)O 1458a_100000185466_200025704644 [1,1,0,0,0,0|2,0,0]=4 1846 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200025704644 [1,1,0,0,0,0|2,0,0]=4 1847 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200025704644 [1,1,0,0,0,0|2,0,0]=4 1848 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)F 1458a_100000688015_200025704644 [1,1,0,0,0,0|2,0,0]=4 1849 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)I 1458a_100000725830_200025704644 [1,1,0,0,0,0|2,0,0]=4 1850 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)O 1458a_100000037485_200025704644 [1,1,0,0,0,0|2,0,0]=4 1851 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200025704644 [1,1,0,0,0,0|1,0,0]=3 1852 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200025704644 [1,1,0,0,0,0|1,0,0]=3 1853 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)F 1458a_100000035894_200025704644 [1,1,0,0,0,0|1,0,0]=3 1854 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)I 1458a_100000239334_200025704644 [1,1,0,0,0,0|1,0,0]=3 1855 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [1,1,0,0,0,0|1,0,0]=3 1856 B11R1.23 CCC(=O)c1cc(ccn1)O 271570a_203496583355_200000094848 [1,1,0,0,0,0|2,0,0]=4 1857 B11R1.23 CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210202 [1,1,0,0,0,0|2,0,0]=4 1858 B11R1.23 CCC(=O)c1cccc(c1)C 1458a_100000189346_100000210202 [1,1,0,0,0,0|2,0,0]=4 1859 B11R1.23 CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210202 [1,1,0,0,0,0|2,0,0]=4 1860 B11R1.23 CCC(=O)c1cccc(c1)F 1458a_100000210950_100000210202 [1,1,0,0,0,0|2,0,0]=4 1861 B11R1.23 CCC(=O)c1cccc(c1)I 1458a_100000184098_100000210202 [1,1,0,0,0,0|2,0,0]=4 1862 B11R1.23 CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210202 [1,1,0,0,0,0|1,0,0]=3 1863 B11R1.23 CCC(=O)c1cccc(c1)O 271570a_203496583355_100000211677 [1,1,0,0,0,0|1,0,0]=3 1864 B11R1.23 CCC(=O)c1cccc(n1)O 271570a_203496583355_100011004013 [1,1,0,0,0,0|2,0,0]=4 1865 B11R1.23 CCC(O)c1cccc(c1)O 271570a_203496583355_200013212081 [1,1,0,0,0,0|1,0,1]=4 1866 B11R1.23 CNC(=O)c1cc(ccn1)O 271570a_203496583355_100000204654 [1,1,0,0,0,0|2,0,0]=4 1867 B11R1.23 CNC(=O)c1cccc(c1)Br 11a_106832991635_100000210664 [1,1,0,0,0,0|2,0,0]=4 1868 B11R1.23 CNC(=O)c1cccc(c1)Br 1626a_100102657272_100000210664 [1,1,0,0,0,0|2,0,0]=4 1869 B11R1.23 CNC(=O)c1cccc(c1)Br 240690a_100102657272_100000210664 [1,1,0,0,0,0|2,0,0]=4 1870 B11R1.23 CNC(=O)c1cccc(c1)Br 527a_100102657272_100000210664 [1,1,0,0,0,0|2,0,0]=4 1871 B11R1.23 CNC(=O)c1cccc(c1)C 11a_106832991635_100000189346 [1,1,0,0,0,0|2,0,0]=4 1872 B11R1.23 CNC(=O)c1cccc(c1)C 1626a_100102657272_100000189346 [1,1,0,0,0,0|2,0,0]=4 1873 B11R1.23 CNC(=O)c1cccc(c1)C 240690a_100102657272_100000189346 [1,1,0,0,0,0|2,0,0]=4 1874 B11R1.23 CNC(=O)c1cccc(c1)C 527a_100102657272_100000189346 [1,1,0,0,0,0|2,0,0]=4 1875 B11R1.23 CNC(=O)c1cccc(c1)Cl 11a_106832991635_100000210390 [1,1,0,0,0,0|2,0,0]=4 1876 B11R1.23 CNC(=O)c1cccc(c1)Cl 1626a_100102657272_100000210390 [1,1,0,0,0,0|2,0,0]=4 1877 B11R1.23 CNC(=O)c1cccc(c1)Cl 240690a_100102657272_100000210390 [1,1,0,0,0,0|2,0,0]=4 1878 B11R1.23 CNC(=O)c1cccc(c1)Cl 527a_100102657272_100000210390 [1,1,0,0,0,0|2,0,0]=4 1879 B11R1.23 CNC(=O)c1cccc(c1)F 11a_106832991635_100000210950 [1,1,0,0,0,0|2,0,0]=4 1880 B11R1.23 CNC(=O)c1cccc(c1)F 1626a_100102657272_100000210950 [1,1,0,0,0,0|2,0,0]=4 1881 B11R1.23 CNC(=O)c1cccc(c1)F 240690a_100102657272_100000210950 [1,1,0,0,0,0|2,0,0]=4 1882 B11R1.23 CNC(=O)c1cccc(c1)F 527a_100102657272_100000210950 [1,1,0,0,0,0|2,0,0]=4 1883 B11R1.23 CNC(=O)c1cccc(c1)I 11a_106832991635_100000184098 [1,1,0,0,0,0|2,0,0]=4 1884 B11R1.23 CNC(=O)c1cccc(c1)I 1626a_100102657272_100000184098 [1,1,0,0,0,0|2,0,0]=4 1885 B11R1.23 CNC(=O)c1cccc(c1)I 240690a_100102657272_100000184098 [1,1,0,0,0,0|2,0,0]=4 1886 B11R1.23 CNC(=O)c1cccc(c1)I 527a_100102657272_100000184098 [1,1,0,0,0,0|2,0,0]=4 1887 B11R1.23 CNC(=O)c1cccc(c1)O 240690a_100102657272_100000183914 [1,1,0,0,0,0|1,0,0]=3 1888 B11R1.23 CNC(=O)c1cccc(c1)O 271570a_203496583355_100000155082 [1,1,0,0,0,0|1,0,0]=3 1889 B11R1.23 CNC(=O)c1cccc(c1)O 527a_100102657272_100000183914 [1,1,0,0,0,0|1,0,0]=3 1890 B11R1.23 CNC(=O)c1cccc(n1)O 271570a_203496583355_100000755456 [1,1,0,0,0,0|2,0,0]=4 1891 B11R1.23 CNC(=O)c1ccnc(c1)O 271570a_203496583355_100011196506 [1,1,0,0,0,0|2,0,0]=4 1892 B11R1.23 CNC(=O)c1cncc(c1)O 271570a_203496583355_200000155086 [1,1,0,0,0,0|2,0,0]=4 1893 B11R1.23 COC(=O)c1cc(ccn1)O 271570a_203496583355_100000693414 [1,1,0,0,0,0|1,0,0]=3 1894 B11R1.23 COC(=O)c1cc(ncn1)O 271570a_203496583355_100000051410 [1,1,0,0,0,0|2,0,0]=4 1895 B11R1.23 COC(=O)c1cccc(c1)O 271570a_203496583355_100000148679 [1,1,0,0,0,0|0,0,0]=2 1896 B11R1.23 COC(=O)c1cccc(n1)O 271570a_203496583355_100000708286 [1,1,0,0,0,0|1,0,0]=3 1897 B11R1.23 COC(=O)c1ccnc(c1)O 271570a_203496583355_100011934382 [1,1,0,0,0,0|1,0,0]=3 1898 B11R1.23 COC(=O)c1ccnc(n1)O 271570a_203496583355_100000070389 [1,1,0,0,0,0|2,0,0]=4 1899 B11R1.23 COC(=O)c1cncc(c1)O 271570a_203496583355_100000148912 [1,1,0,0,0,0|1,0,0]=3 1900 B11R1.23 COC(=O)c1cncc(n1)O 271570a_203496583355_100000765340 [1,1,0,0,0,0|2,0,0]=4 1901 B11R1.23 COC(=O)c1cnnc(c1)O 271570a_203496583355_100009862058 [1,1,0,0,0,0|2,0,0]=4 1902 B11R1.23 Cc1cccc(c1)C(=O)CF 1458a_100000189346_100015361967 [1,1,0,0,0,0|2,0,0]=4 1903 B11R1.23 N#CC(=O)c1cccc(c1)O 271570a_203496583355_100010169886 [1,1,0,0,0,0|1,0,0]=3 1904 B11R1.23 NC(CO)c1cccc(c1)O 271570a_203496583355_100000690078 [1,1,0,0,0,0|1,0,1]=4 1905 B11R1.23 NCC(=O)c1cccc(c1)O 271570a_203496583355_100020587001 [1,1,0,0,0,0|1,0,0]=3 1906 B11R1.23 NNC(=O)c1cc(ccn1)O 271570a_203496583355_100000017052 [1,1,0,0,0,0|2,0,0]=4 1907 B11R1.23 NNC(=O)c1cccc(c1)O 271570a_203496583355_100000189783 [1,1,0,0,0,0|1,0,0]=3 1908 B11R1.23 NNC(=O)c1cccc(n1)O 271570a_203496583355_100011631096 [1,1,0,0,0,0|2,0,0]=4 1909 B11R1.23 NNC(=O)c1ccnc(c1)O 271570a_203496583355_100000021280 [1,1,0,0,0,0|2,0,0]=4 1910 B11R1.23 NNC(=O)c1cncc(c1)O 271570a_203496583355_100000189809 [1,1,0,0,0,0|2,0,0]=4 1911 B11R1.23 O=C(CF)c1cccc(c1)Br 1458a_100000210664_100015361967 [1,1,0,0,0,0|2,0,0]=4 1912 B11R1.23 O=C(CF)c1cccc(c1)Cl 1458a_100000210390_100015361967 [1,1,0,0,0,0|2,0,0]=4 1913 B11R1.23 O=C(CF)c1cccc(c1)F 1458a_100000210950_100015361967 [1,1,0,0,0,0|2,0,0]=4 1914 B11R1.23 O=C(CF)c1cccc(c1)I 1458a_100000184098_100015361967 [1,1,0,0,0,0|2,0,0]=4 1915 B11R1.23 O=C(CF)c1cccc(c1)O 1458a_100000183914_100015361967 [1,1,0,0,0,0|1,0,0]=3 1916 B11R1.23 O=CC(=O)c1cccc(c1)O 271570a_203496583355_100000726164 [1,1,0,0,0,0|0,0,1]=3 1917 B11R1.74 C=C(C)c1cc(cc(c1)Br)O 271570a_100000694244_100010068917 [1,1,0,0,0,0|2,0,0]=4 1918 B11R1.74 C=C(C)c1cc(cc(c1)Cl)O 271570a_100000694244_100010068924 [1,1,0,0,0,0|2,0,0]=4 1919 B11R1.74 C=C(C)c1cc(cc(c1)F)O 271570a_100000694244_100000717995 [1,1,0,0,0,0|2,0,0]=4 1920 B11R1.74 C=C(C)c1cc(cc(c1)O)C 271570a_100000694244_100011999630 [1,1,0,0,0,0|2,0,0]=4 1921 B11R1.74 C=C(C)c1cc(cc(c1)O)O 271570a_100000694244_100009868816 [1,1,0,0,0,0|2,0,0]=4 1922 B11R1.74 CC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200000210301 [1,1,0,0,0,0|2,0,0]=4 1923 B11R1.74 CC(=O)c1cc(cc(c1)Br)C 1458a_100000760426_200000210301 [1,1,0,0,0,0|2,0,0]=4 1924 B11R1.74 CC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200000210301 [1,1,0,0,0,0|2,0,0]=4 1925 B11R1.74 CC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200000210301 [1,1,0,0,0,0|2,0,0]=4 1926 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200000210301 [1,1,0,0,0,0|1,0,0]=3 1927 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 271570a_203496583355_100010005435 [1,1,0,0,0,0|1,0,0]=3 1928 B11R1.74 CC(=O)c1cc(cc(c1)C)C 1458a_100000210874_200000210301 [1,1,0,0,0,0|2,0,0]=4 1929 B11R1.74 CC(=O)c1cc(cc(c1)Cl)C 1458a_100000684526_200000210301 [1,1,0,0,0,0|2,0,0]=4 1930 B11R1.74 CC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200000210301 [1,1,0,0,0,0|2,0,0]=4 1931 B11R1.74 CC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200000210301 [1,1,0,0,0,0|2,0,0]=4 1932 B11R1.74 CC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200000210301 [1,1,0,0,0,0|1,0,0]=3 1933 B11R1.74 CC(=O)c1cc(cc(c1)F)C 1458a_100000763163_200000210301 [1,1,0,0,0,0|2,0,0]=4 1934 B11R1.74 CC(=O)c1cc(cc(c1)F)F 1458a_100000211655_200000210301 [1,1,0,0,0,0|2,0,0]=4 1935 B11R1.74 CC(=O)c1cc(cc(c1)F)O 1458a_100012017291_200000210301 [1,1,0,0,0,0|1,0,0]=3 1936 B11R1.74 CC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100012361402 [1,1,0,0,0,0|1,0,0]=3 1937 B11R1.74 CC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200000210301 [1,1,0,0,0,0|2,0,0]=4 1938 B11R1.74 CC(=O)c1cc(cc(c1)I)C 1458a_100000729426_200000210301 [1,1,0,0,0,0|2,0,0]=4 1939 B11R1.74 CC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200000210301 [1,1,0,0,0,0|2,0,0]=4 1940 B11R1.74 CC(=O)c1cc(cc(c1)I)F 1458a_100012047268_200000210301 [1,1,0,0,0,0|2,0,0]=4 1941 B11R1.74 CC(=O)c1cc(cc(c1)I)I 1458a_100011204819_200000210301 [1,1,0,0,0,0|2,0,0]=4 1942 B11R1.74 CC(=O)c1cc(cc(c1)O)C 1458a_100000094094_200000210301 [1,1,0,0,0,0|1,0,0]=3 1943 B11R1.74 CC(=O)c1cc(cc(c1)O)C 271570a_203496583355_100000694479 [1,1,0,0,0,0|1,0,0]=3 1944 B11R1.74 CC(=O)c1cc(nc(c1)O)C 271570a_203496583355_100009884196 [1,1,0,0,0,0|2,0,0]=4 1945 B11R1.74 Cc1cc(cc(c1)B(O)O)O 271570a_203496583355_100009814731 [1,1,0,0,0,0|1,0,1]=4 1946 B11R1.74 Cc1cc(cc(c1)C(=O)N)O 271570a_203496583355_200012348365 [1,1,0,0,0,0|1,0,0]=3 1947 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Br 1458a_100000760426_200025704644 [1,1,0,0,0,0|2,0,0]=4 1948 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])C 1458a_100000210874_200025704644 [1,1,0,0,0,0|2,0,0]=4 1949 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Cl 1458a_100000684526_200025704644 [1,1,0,0,0,0|2,0,0]=4 1950 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])F 1458a_100000763163_200025704644 [1,1,0,0,0,0|2,0,0]=4 1951 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])I 1458a_100000729426_200025704644 [1,1,0,0,0,0|2,0,0]=4 1952 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])O 1458a_100000094094_200025704644 [1,1,0,0,0,0|1,0,0]=3 1953 B11R1.74 NC(=O)c1cc(cc(c1)F)O 271570a_203496583355_200011280034 [1,1,0,0,0,0|1,0,0]=3 1954 B11R1.74 NC(=O)c1cc(cc(c1)O)O 271570a_203496583355_100010084318 [1,1,0,0,0,0|1,0,0]=3 1955 B11R1.74 OB(O)c1cc(cc(c1)F)O 271570a_203496583355_100009814746 [1,1,0,0,0,0|1,0,1]=4 1956 B11R1.74 OB(O)c1cc(cc(c1)O)O 271570a_203496583355_100010062373 [1,1,0,0,0,0|1,0,1]=4 1957 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200025704644 [1,1,0,0,0,0|2,0,0]=4 1958 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200025704644 [1,1,0,0,0,0|2,0,0]=4 1959 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200025704644 [1,1,0,0,0,0|2,0,0]=4 1960 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200025704644 [1,1,0,0,0,0|1,0,0]=3 1961 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200025704644 [1,1,0,0,0,0|2,0,0]=4 1962 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200025704644 [1,1,0,0,0,0|2,0,0]=4 1963 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200025704644 [1,1,0,0,0,0|1,0,0]=3 1964 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)F 1458a_100000211655_200025704644 [1,1,0,0,0,0|2,0,0]=4 1965 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)O 1458a_100012017291_200025704644 [1,1,0,0,0,0|1,0,0]=3 1966 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200025704644 [1,1,0,0,0,0|2,0,0]=4 1967 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200025704644 [1,1,0,0,0,0|2,0,0]=4 1968 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)F 1458a_100012047268_200025704644 [1,1,0,0,0,0|2,0,0]=4 1969 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)I 1458a_100011204819_200025704644 [1,1,0,0,0,0|2,0,0]=4 1970 B11R1.155 CC(C)(O)c1cccc(c1)O 271570a_203496583355_100011346009 [1,1,0,0,0,0|1,0,1]=4 1971 B11R1.155 CS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100009815773 [1,1,0,0,0,0|1,0,1]=4 1972 B11R1.155 NS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100000164563 [1,1,0,0,0,0|1,0,1]=4 1973 B11R1.266 C#Cc1cccc(c1)C(=O)C 1458a_100011997762_200000210301 [1,1,0,0,0,0|2,0,0]=4 1974 B11R1.266 C#Cc1cccc(c1)C(=O)[13CH3] 1458a_100011997762_200025704644 [1,1,0,0,0,0|2,0,0]=4 1975 B11R1.266 C=C(C)c1cccc(c1)CO 271570a_100000694244_100000687537 [1,1,0,0,0,0|2,0,0]=4 1976 B11R1.266 C=C(C)c1cccc(c1)OC 271570a_100000694244_100000170001 [1,1,0,0,0,0|2,0,0]=4 1977 B11R1.266 C=Cc1cccc(c1)C(=O)C 1458a_100011215009_200000210301 [1,1,0,0,0,0|2,0,0]=4 1978 B11R1.266 C=Cc1cccc(c1)C(=O)C 271570a_100011290941_100000210093 [1,1,0,0,0,0|2,0,0]=4 1979 B11R1.266 C=Cc1cccc(c1)C(=O)N 271570a_100011290941_100000162208 [1,1,0,0,0,0|2,0,0]=4 1980 B11R1.266 C=Cc1cccc(c1)C(=O)[13CH3] 1458a_100011215009_200025704644 [1,1,0,0,0,0|2,0,0]=4 1981 B11R1.266 CC(=O)c1cccc(c1)C#N 1458a_100000183950_200000210301 [1,1,0,0,0,0|2,0,0]=4 1982 B11R1.266 CC(=O)c1cccc(c1)CO 1458a_100000746274_200000210301 [1,1,0,0,0,0|1,0,0]=3 1983 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 34a_100000211620_200025704644 [1,1,0,0,0,0|1,0,0]=3 1984 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 7a_100000211620_200025704644 [1,1,0,0,0,0|1,0,0]=3 1985 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_100000210093_200025704644 [1,1,0,0,0,0|1,1,0]=4 1986 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000210093 [1,1,0,0,0,0|1,1,0]=4 1987 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 34a_100000748013_200025704644 [1,1,0,0,0,0|1,0,1]=4 1988 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 7a_100000748013_200025704644 [1,1,0,0,0,0|1,0,1]=4 1989 B11R1.266 CCc1cccc(c1)C(=O)C 1458a_100011933908_200000210301 [1,1,0,0,0,0|2,0,0]=4 1990 B11R1.266 CCc1cccc(c1)C(=O)[13CH3] 1458a_100011933908_200025704644 [1,1,0,0,0,0|2,0,0]=4 1991 B11R1.266 CNc1cccc(c1)C(=O)N 34a_100000217337_200000210301 [1,1,0,0,0,0|2,0,0]=4 1992 B11R1.266 COc1cccc(c1)C(=O)C 1458a_100000188888_200000210301 [1,1,0,0,0,0|1,0,0]=3 1993 B11R1.266 COc1cccc(c1)C(=O)C 34a_100000211620_200000210301 [1,1,0,0,0,0|1,0,0]=3 1994 B11R1.266 COc1cccc(c1)C(=O)C 7a_100000211620_200000210301 [1,1,0,0,0,0|1,0,0]=3 1995 B11R1.266 COc1cccc(c1)C(=O)N 34a_100000162170_200000210301 [1,1,0,0,0,0|1,0,0]=3 1996 B11R1.266 COc1cccc(c1)C(=O)N 7a_100000162170_200000210301 [1,1,0,0,0,0|1,0,0]=3 1997 B11R1.266 COc1cccc(c1)C(=O)[13CH3] 1458a_100000188888_200025704644 [1,1,0,0,0,0|1,0,0]=3 1998 B11R1.266 COc1cccc(c1)C(=S)N 7a_100000738086_200000210301 [1,1,0,0,0,0|1,1,0]=4 1999 B11R1.266 COc1cccc(c1)C(C)O 34a_100000748013_200000210301 [1,1,0,0,0,0|1,0,1]=4 2000 B11R1.266 COc1cccc(c1)C(C)O 7a_100000748013_200000210301 [1,1,0,0,0,0|1,0,1]=4 2001 B11R1.266 COc1cccc(c1)[N+](=O)[O-] 34a_100000185994_200000210301 [1,1,0,0,0,0|1,0,1]=4 2002 B11R1.266 COc1cccc(c1)[N+](=O)[O-] 7a_100000185994_200000210301 [1,1,0,0,0,0|1,0,1]=4 2003 B11R1.266 COc1cncc(c1)C(=O)N 7a_100000698036_200000210301 [1,1,0,0,0,0|2,0,0]=4 2004 B11R1.266 CSc1cccc(c1)C(=O)C 1458a_100011217804_200000210301 [1,1,0,0,0,0|1,1,0]=4 2005 B11R1.266 CSc1cccc(c1)C(=O)C 62a_100000210093_200000210301 [1,1,0,0,0,0|1,1,0]=4 2006 B11R1.266 CSc1cccc(c1)C(=O)C 62a_200000210301_100000210093 [1,1,0,0,0,0|1,1,0]=4 2007 B11R1.266 CSc1cccc(c1)C(=O)N 62a_100000162208_200000210301 [1,1,0,0,0,0|1,1,0]=4 2008 B11R1.266 CSc1cccc(c1)C(=O)N 62a_200000210301_100000162208 [1,1,0,0,0,0|1,1,0]=4 2009 B11R1.266 CSc1cccc(c1)C(=O)[13CH3] 1458a_100011217804_200025704644 [1,1,0,0,0,0|1,1,0]=4 2010 B11R1.266 [13CH3]C(=O)c1cccc(c1)C#N 1458a_100000183950_200025704644 [1,1,0,0,0,0|2,0,0]=4 2011 B11R1.266 [13CH3]C(=O)c1cccc(c1)CO 1458a_100000746274_200025704644 [1,1,0,0,0,0|1,0,0]=3 2012 B11R1.266 [13CH3]Nc1cccc(c1)C(=O)N 34a_100000217337_200025704644 [1,1,0,0,0,0|2,0,0]=4 2013 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 34a_100000162170_200025704644 [1,1,0,0,0,0|1,0,0]=3 2014 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 7a_100000162170_200025704644 [1,1,0,0,0,0|1,0,0]=3 2015 B11R1.266 [13CH3]Oc1cccc(c1)C(=S)N 7a_100000738086_200025704644 [1,1,0,0,0,0|1,1,0]=4 2016 B11R1.266 [13CH3]Oc1cccc(c1)[N+](=O)[O-] 34a_100000185994_200025704644 [1,1,0,0,0,0|1,0,1]=4 2017 B11R1.266 [13CH3]Oc1cccc(c1)[N+](=O)[O-] 7a_100000185994_200025704644 [1,1,0,0,0,0|1,0,1]=4 2018 B11R1.266 [13CH3]Oc1cncc(c1)C(=O)N 7a_100000698036_200025704644 [1,1,0,0,0,0|2,0,0]=4 2019 B11R1.266 [13CH3]Sc1cccc(c1)C(=O)N 62a_100000162208_200025704644 [1,1,0,0,0,0|1,1,0]=4 2020 B11R1.266 [13CH3]Sc1cccc(c1)C(=O)N 62a_200025704644_100000162208 [1,1,0,0,0,0|1,1,0]=4 2021 B11R1.865 COC(=O)c1ccc(n1C)O 271570a_203496583355_100010124797 [0,1,0,0,1,0|2,0,0]=4 2022 B11R1.865 COC(=O)c1scc(c1C)O 271570a_203496583355_100010184805 [0,1,0,0,1,0|2,0,0]=4 2023 B11R1.865 COC(=O)c1scc(c1N)O 271570a_203496583355_100010201200 [0,1,0,0,1,0|1,0,0]=3 2024 B11R1.865 COC(=O)c1scc(c1O)O 271570a_203496583355_100009812821 [0,1,0,0,1,0|2,0,0]=4 2025 B13R1.40 C=CC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000185746 [0,1,0,0,0,1|2,0,0]=4 2026 B13R1.40 C=CC(=O)Nc1cccc(c1C)O 22a_100011216573_100000185746 [0,1,0,0,0,1|2,0,0]=4 2027 B13R1.40 C=CC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000185746 [0,1,0,0,0,1|2,0,0]=4 2028 B13R1.40 CC(CO)Sc1cccc(c1N)O 62a_100012180447_100011934926 [0,1,0,0,0,1|1,0,1]=4 2029 B13R1.40 CCC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000210414 [0,1,0,0,0,1|2,0,0]=4 2030 B13R1.40 CCC(=O)Nc1cccc(c1C)O 11a_100011216573_100000210414 [0,1,0,0,0,1|2,0,0]=4 2031 B13R1.40 CCC(=O)Nc1cccc(c1C)O 22a_100011216573_100000210414 [0,1,0,0,0,1|2,0,0]=4 2032 B13R1.40 CCC(=O)Nc1cccc(c1C)O 527a_100011216573_100000210414 [0,1,0,0,0,1|2,0,0]=4 2033 B13R1.40 CCC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000210414 [0,1,0,0,0,1|2,0,0]=4 2034 B13R1.40 CNC(=O)Nc1cccc(c1Br)O 2430a_100012183704_100102657272 [0,1,0,0,0,1|2,0,0]=4 2035 B13R1.40 CNC(=O)Nc1cccc(c1C)O 2430a_100011216573_100102657272 [0,1,0,0,0,1|2,0,0]=4 2036 B13R1.40 CNC(=O)Nc1cccc(c1Cl)O 2430a_100012002038_100102657272 [0,1,0,0,0,1|2,0,0]=4 2037 B13R1.40 COC(=O)Cc1cccc(c1F)O 271570a_203496583355_100010741560 [0,1,0,0,0,1|1,0,0]=3 2038 B13R1.40 COC(=O)Cc1cccc(c1O)C 271570a_203496583355_200010150888 [0,1,0,0,0,1|2,0,0]=4 2039 B13R1.40 COC(=O)Cc1cccc(c1O)O 271570a_203496583355_100010150830 [0,1,0,0,0,1|1,0,0]=3 2040 B13R1.40 COC(C)Sc1cccc(c1N)O 62a_100009879195_100011934926 [0,1,0,0,0,1|1,0,1]=4 2041 B13R1.40 C[C@H](CO)Sc1cccc(c1N)O 62a_100016084084_100011934926 [0,1,0,0,0,1|1,0,1]=4 2042 B13R1.40 Cc1c(cccc1CC(=O)CO)Br 1458a_100000210174_100000694682 [0,1,0,0,0,1|2,0,0]=4 2043 B13R1.40 Cc1c(cccc1CC(=O)CO)Cl 1458a_100000210174_100012186920 [0,1,0,0,0,1|2,0,0]=4 2044 B13R1.40 Cc1c(cccc1CC(=O)CO)F 1458a_100000210174_100009813626 [0,1,0,0,0,1|2,0,0]=4 2045 B13R1.40 Cc1c(cccc1CC(=O)CO)I 1458a_100000210174_100010150147 [0,1,0,0,0,1|2,0,0]=4 2046 B13R1.40 Cc1c(cccc1NC(=O)CO)Br 22a_100000750434_100000210174 [0,1,0,0,0,1|2,0,0]=4 2047 B13R1.40 Cc1c(cccc1NC(=O)CO)Br 527a_100000750434_100000210174 [0,1,0,0,0,1|2,0,0]=4 2048 B13R1.40 Cc1c(cccc1NC(=O)CO)Cl 22a_100000210441_100000210174 [0,1,0,0,0,1|2,0,0]=4 2049 B13R1.40 Cc1c(cccc1NC(=O)CO)Cl 527a_100000210441_100000210174 [0,1,0,0,0,1|2,0,0]=4 2050 B13R1.40 Cc1c(cccc1NC(=O)CO)F 22a_100000745574_100000210174 [0,1,0,0,0,1|2,0,0]=4 2051 B13R1.40 Cc1c(cccc1NC(=O)CO)F 527a_100000745574_100000210174 [0,1,0,0,0,1|2,0,0]=4 2052 B13R1.40 Cc1c(cccc1NC(=O)CO)I 22a_100000761887_100000210174 [0,1,0,0,0,1|2,0,0]=4 2053 B13R1.40 Cc1c(cccc1NC(=O)CO)I 527a_100000761887_100000210174 [0,1,0,0,0,1|2,0,0]=4 2054 B13R1.40 Cc1c(cccc1NC(=O)CO)O 22a_100011216573_100000210174 [0,1,0,0,0,1|1,0,0]=3 2055 B13R1.40 Cc1c(cccc1NC(=O)CO)O 527a_100011216573_100000210174 [0,1,0,0,0,1|1,0,0]=3 2056 B13R1.40 Cc1cccc(c1Br)CC(=O)CO 1458a_100000210174_200012349612 [0,1,0,0,0,1|2,0,0]=4 2057 B13R1.40 Cc1cccc(c1Br)NC(=O)CO 22a_100000684715_100000210174 [0,1,0,0,0,1|2,0,0]=4 2058 B13R1.40 Cc1cccc(c1C)CC(=O)CO 1458a_100000210174_100011515928 [0,1,0,0,0,1|2,0,0]=4 2059 B13R1.40 Cc1cccc(c1C)NC(=O)CO 22a_100000210026_100000210174 [0,1,0,0,0,1|2,0,0]=4 2060 B13R1.40 Cc1cccc(c1C)NC(=O)CO 527a_100000210026_100000210174 [0,1,0,0,0,1|2,0,0]=4 2061 B13R1.40 Cc1cccc(c1Cl)NC(=O)CO 22a_100000765562_100000210174 [0,1,0,0,0,1|2,0,0]=4 2062 B13R1.40 Cc1cccc(c1F)CC(=O)CO 1458a_100000210174_100011216058 [0,1,0,0,0,1|2,0,0]=4 2063 B13R1.40 Cc1cccc(c1F)NC(=O)CO 527a_100000697159_100000210174 [0,1,0,0,0,1|2,0,0]=4 2064 B13R1.40 Cc1cccc(c1O)NC(=O)CO 22a_100000756359_100000210174 [0,1,0,0,0,1|2,0,0]=4 2065 B13R1.40 Cc1cccc(c1O)NC(=O)CO 527a_100000756359_100000210174 [0,1,0,0,0,1|2,0,0]=4 2066 B13R1.40 O=C(CO)Cc1cccc(c1Br)Cl 1458a_100000210174_100010145525 [0,1,0,0,0,1|2,0,0]=4 2067 B13R1.40 O=C(CO)Cc1cccc(c1Br)F 1458a_100000210174_100012351116 [0,1,0,0,0,1|2,0,0]=4 2068 B13R1.40 O=C(CO)Cc1cccc(c1Br)I 1458a_100000210174_100010254545 [0,1,0,0,0,1|2,0,0]=4 2069 B13R1.40 O=C(CO)Cc1cccc(c1Cl)Br 1458a_100000210174_100012349491 [0,1,0,0,0,1|2,0,0]=4 2070 B13R1.40 O=C(CO)Cc1cccc(c1Cl)Cl 1458a_100000210174_100000720918 [0,1,0,0,0,1|2,0,0]=4 2071 B13R1.40 O=C(CO)Cc1cccc(c1Cl)F 1458a_100000210174_100000696688 [0,1,0,0,0,1|2,0,0]=4 2072 B13R1.40 O=C(CO)Cc1cccc(c1F)Br 1458a_100000210174_100012356507 [0,1,0,0,0,1|2,0,0]=4 2073 B13R1.40 O=C(CO)Cc1cccc(c1F)Cl 1458a_100000210174_100000716733 [0,1,0,0,0,1|2,0,0]=4 2074 B13R1.40 O=C(CO)Cc1cccc(c1F)F 1458a_100000210174_100000217499 [0,1,0,0,0,1|2,0,0]=4 2075 B13R1.40 O=C(CO)Cc1cccc(c1I)F 1458a_100000210174_100010149603 [0,1,0,0,0,1|2,0,0]=4 2076 B13R1.40 O=C(CO)Nc1cccc(c1Br)O 22a_100012183704_100000210174 [0,1,0,0,0,1|1,0,0]=3 2077 B13R1.40 O=C(CO)Nc1cccc(c1Cl)Br 527a_100000687075_100000210174 [0,1,0,0,0,1|2,0,0]=4 2078 B13R1.40 O=C(CO)Nc1cccc(c1Cl)F 22a_100000692321_100000210174 [0,1,0,0,0,1|2,0,0]=4 2079 B13R1.40 O=C(CO)Nc1cccc(c1Cl)O 22a_100012002038_100000210174 [0,1,0,0,0,1|1,0,0]=3 2080 B13R1.40 O=C(CO)Nc1cccc(c1F)Br 22a_100011935091_100000210174 [0,1,0,0,0,1|2,0,0]=4 2081 B13R1.40 O=C(CO)Nc1cccc(c1F)Br 527a_100011935091_100000210174 [0,1,0,0,0,1|2,0,0]=4 2082 B13R1.40 O=C(CO)Nc1cccc(c1F)Cl 22a_100000199060_100000210174 [0,1,0,0,0,1|2,0,0]=4 2083 B13R1.40 O=C(CO)Nc1cccc(c1F)F 22a_100000743855_100000210174 [0,1,0,0,0,1|2,0,0]=4 2084 B13R1.40 O=C(CO)Nc1cccc(c1O)Br 22a_100011934915_100000210174 [0,1,0,0,0,1|2,0,0]=4 2085 B13R1.40 O=C(CO)Nc1cccc(c1O)Br 527a_100011934915_100000210174 [0,1,0,0,0,1|2,0,0]=4 2086 B13R1.40 O=C(CO)Nc1cccc(c1O)Cl 22a_100000754742_100000210174 [0,1,0,0,0,1|2,0,0]=4 2087 B13R1.40 O=C(CO)Nc1cccc(c1O)Cl 527a_100000754742_100000210174 [0,1,0,0,0,1|2,0,0]=4 2088 B13R1.40 O=C(CO)Nc1cccc(c1O)F 22a_100011934987_100000210174 [0,1,0,0,0,1|2,0,0]=4 2089 B13R1.40 O=C(CO)Nc1cccc(c1O)F 527a_100011934987_100000210174 [0,1,0,0,0,1|2,0,0]=4 2090 B13R1.40 O=C(CO)Nc1cccc(c1O)I 22a_100010084371_100000210174 [0,1,0,0,0,1|2,0,0]=4 2091 B13R1.40 O=C(CO)Nc1cccc(c1O)I 527a_100010084371_100000210174 [0,1,0,0,0,1|2,0,0]=4 2092 B13R1.641 CC(=Cc1cccc(c1N)CO)C 271570a_100102525489_100012349457 [0,1,0,0,0,1|2,0,0]=4 2093 B13R1.641 CC(=O)Nc1cccc(c1C)CO 22a_102495339961_100000070787 [0,1,0,0,0,1|2,0,0]=4 2094 B13R1.641 CC(=O)Nc1cccc(c1C)CO 527a_102495339961_100103153847 [0,1,0,0,0,1|2,0,0]=4 2095 B13R1.641 COc1cccc(c1Br)NC(=O)C 11a_100000703447_100015343762 [0,1,0,0,0,1|2,0,0]=4 2096 B13R1.641 COc1cccc(c1Br)NC(=O)C 1626a_100000703447_100015343762 [0,1,0,0,0,1|2,0,0]=4 2097 B13R1.641 COc1cccc(c1Br)NC(=O)C 22a_100000703447_100000070787 [0,1,0,0,0,1|2,0,0]=4 2098 B13R1.641 COc1cccc(c1Br)NC(=O)C 527a_100000703447_100103153847 [0,1,0,0,0,1|2,0,0]=4 2099 B13R1.641 COc1cccc(c1C)CC(=O)C 1458a_100000070787_100009876938 [0,1,0,0,0,1|2,0,0]=4 2100 B13R1.641 COc1cccc(c1C)NC(=O)C 11a_100011244893_100015343762 [0,1,0,0,0,1|2,0,0]=4 2101 B13R1.641 COc1cccc(c1C)NC(=O)C 1626a_100011244893_100015343762 [0,1,0,0,0,1|2,0,0]=4 2102 B13R1.641 COc1cccc(c1C)NC(=O)C 22a_100011244893_100000070787 [0,1,0,0,0,1|2,0,0]=4 2103 B13R1.641 COc1cccc(c1C)NC(=O)C 527a_100011244893_100103153847 [0,1,0,0,0,1|2,0,0]=4 2104 B13R1.641 COc1cccc(c1Cl)CC(=O)C 1458a_100000070787_200010147866 [0,1,0,0,0,1|2,0,0]=4 2105 B13R1.641 COc1cccc(c1Cl)NC(=O)C 11a_100000089720_100015343762 [0,1,0,0,0,1|2,0,0]=4 2106 B13R1.641 COc1cccc(c1Cl)NC(=O)C 1626a_100000089720_100015343762 [0,1,0,0,0,1|2,0,0]=4 2107 B13R1.641 COc1cccc(c1Cl)NC(=O)C 22a_100000089720_100000070787 [0,1,0,0,0,1|2,0,0]=4 2108 B13R1.641 COc1cccc(c1Cl)NC(=O)C 527a_100000089720_100103153847 [0,1,0,0,0,1|2,0,0]=4 2109 B13R1.641 COc1cccc(c1F)CC(=O)C 1458a_100000070787_100011260763 [0,1,0,0,0,1|2,0,0]=4 2110 B13R1.641 COc1cccc(c1F)CC(=O)C 1458a_100000698549_200000210301 [0,1,0,0,0,1|2,0,0]=4 2111 B13R1.641 COc1cccc(c1F)CC(=O)[13CH3] 1458a_100000698549_200025704644 [0,1,0,0,0,1|2,0,0]=4 2112 B13R1.641 COc1cccc(c1F)NC(=O)C 11a_100000100910_100015343762 [0,1,0,0,0,1|2,0,0]=4 2113 B13R1.641 COc1cccc(c1F)NC(=O)C 1626a_100000100910_100015343762 [0,1,0,0,0,1|2,0,0]=4 2114 B13R1.641 COc1cccc(c1F)NC(=O)C 22a_100000100910_100000070787 [0,1,0,0,0,1|2,0,0]=4 2115 B13R1.641 COc1cccc(c1F)NC(=O)C 527a_100000100910_100103153847 [0,1,0,0,0,1|2,0,0]=4 2116 B13R1.641 COc1cccc(c1I)NC(=O)C 11a_100010245509_100015343762 [0,1,0,0,0,1|2,0,0]=4 2117 B13R1.641 COc1cccc(c1I)NC(=O)C 1626a_100010245509_100015343762 [0,1,0,0,0,1|2,0,0]=4 2118 B13R1.641 COc1cccc(c1N)C=C(C)C 271570a_100102525489_100000708083 [0,1,0,0,0,1|2,0,0]=4 2119 B13R1.641 COc1cccc(c1O)NC(=O)C 22a_100000123586_100000070787 [0,1,0,0,0,1|2,0,0]=4 2120 B13R1.641 COc1cccc(c1O)NC(=O)C 527a_100000123586_100103153847 [0,1,0,0,0,1|2,0,0]=4 2121 B13R1.3528 CC(=Cc1ccc(c(c1N)O)Br)C 271570a_100102525489_100020748643 [0,1,0,0,0,1|2,0,0]=4 2122 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)O)C 11a_100000036876_100015343762 [0,1,0,0,0,1|2,0,0]=4 2123 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)O)C 22a_100000036876_100000070787 [0,1,0,0,0,1|2,0,0]=4 2124 B13R1.3768 CC(=C(C)c1cccc(c1N)O)C 271570a_200000049429_100011934926 [0,1,0,0,0,1|2,0,0]=4 2125 B13R1.12 C#CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000184674 [0,2,0,0,0,0|2,0,0]=4 2126 B13R1.12 C#CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000184674 [0,2,0,0,0,0|2,0,0]=4 2127 B13R1.12 C#CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000184674 [0,2,0,0,0,0|2,0,0]=4 2128 B13R1.12 C#CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000184674 [0,2,0,0,0,0|2,0,0]=4 2129 B13R1.12 C#CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000184674 [0,2,0,0,0,0|2,0,0]=4 2130 B13R1.12 C#CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000184674 [0,2,0,0,0,0|2,0,0]=4 2131 B13R1.12 C=CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210623 [0,2,0,0,0,0|2,0,0]=4 2132 B13R1.12 C=CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210623 [0,2,0,0,0,0|2,0,0]=4 2133 B13R1.12 C=CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210623 [0,2,0,0,0,0|2,0,0]=4 2134 B13R1.12 C=CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210623 [0,2,0,0,0,0|2,0,0]=4 2135 B13R1.12 C=CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210623 [0,2,0,0,0,0|2,0,0]=4 2136 B13R1.12 C=CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210623 [0,2,0,0,0,0|2,0,0]=4 2137 B13R1.12 CCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210303 [0,2,0,0,0,0|2,0,0]=4 2138 B13R1.12 CCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210303 [0,2,0,0,0,0|2,0,0]=4 2139 B13R1.12 CCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210303 [0,2,0,0,0,0|2,0,0]=4 2140 B13R1.12 CCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210303 [0,2,0,0,0,0|2,0,0]=4 2141 B13R1.12 CCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210303 [0,2,0,0,0,0|2,0,0]=4 2142 B13R1.12 CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210303 [0,2,0,0,0,0|2,0,0]=4 2143 B13R1.12 CCNC(=O)c1cccc(c1Br)O 240690a_100015525214_100010230362 [0,2,0,0,0,0|2,0,0]=4 2144 B13R1.12 CCNC(=O)c1cccc(c1Br)O 527a_100015525214_100010230362 [0,2,0,0,0,0|2,0,0]=4 2145 B13R1.12 CCNC(=O)c1cccc(c1C)O 240690a_100015525214_100000766327 [0,2,0,0,0,0|2,0,0]=4 2146 B13R1.12 CCNC(=O)c1cccc(c1C)O 527a_100015525214_100000766327 [0,2,0,0,0,0|2,0,0]=4 2147 B13R1.12 CCNC(=O)c1cccc(c1Cl)O 240690a_100015525214_100000092362 [0,2,0,0,0,0|2,0,0]=4 2148 B13R1.12 CCNC(=O)c1cccc(c1Cl)O 527a_100015525214_100000092362 [0,2,0,0,0,0|2,0,0]=4 2149 B13R1.12 CCNC(=O)c1cccc(c1F)O 240690a_100015525214_100000037433 [0,2,0,0,0,0|2,0,0]=4 2150 B13R1.12 CCNC(=O)c1cccc(c1F)O 527a_100015525214_100000037433 [0,2,0,0,0,0|2,0,0]=4 2151 B13R1.12 CCNC(=O)c1cccc(c1I)O 527a_100015525214_100010084636 [0,2,0,0,0,0|2,0,0]=4 2152 B13R1.12 CCNC(=O)c1cccc(c1O)O 527a_100015525214_100000690420 [0,2,0,0,0,0|2,0,0]=4 2153 B13R1.12 CCOC(=O)c1cccc(c1C)O 271570a_203496583355_100012298221 [0,2,0,0,0,0|1,0,0]=3 2154 B13R1.12 CCOC(=O)c1cccc(c1F)O 271570a_203496583355_100012350793 [0,2,0,0,0,0|1,0,0]=3 2155 B13R1.12 CCOC(=O)c1cccc(c1N)O 271570a_203496583355_200011356557 [0,2,0,0,0,0|0,0,0]=2 2156 B13R1.12 CCOC(=O)c1cccc(c1O)C 271570a_203496583355_200012184857 [0,2,0,0,0,0|2,0,0]=4 2157 B13R1.12 CCOC(=O)c1cccc(c1O)F 271570a_203496583355_100012357632 [0,2,0,0,0,0|2,0,0]=4 2158 B13R1.12 CCOC(=O)c1ccnc(c1C)O 271570a_203496583355_100000080207 [0,2,0,0,0,0|2,0,0]=4 2159 B13R1.12 CCOC(=O)c1cncc(c1C)O 271570a_203496583355_100000726969 [0,2,0,0,0,0|2,0,0]=4 2160 B13R1.12 CCOC(=O)c1cncc(c1N)O 271570a_203496583355_100010080842 [0,2,0,0,0,0|1,0,0]=3 2161 B13R1.12 CCOC(=O)c1nccc(c1F)O 271570a_203496583355_100010222487 [0,2,0,0,0,0|2,0,0]=4 2162 B13R1.12 CNNC(=O)c1cccc(c1Br)O 22a_100016993582_100010230362 [0,2,0,0,0,0|2,0,0]=4 2163 B13R1.12 CNNC(=O)c1cccc(c1C)O 22a_100016993582_100000766327 [0,2,0,0,0,0|2,0,0]=4 2164 B13R1.12 CNNC(=O)c1cccc(c1Cl)O 22a_100016993582_100000092362 [0,2,0,0,0,0|2,0,0]=4 2165 B13R1.12 CNNC(=O)c1cccc(c1F)O 22a_100016993582_100000037433 [0,2,0,0,0,0|2,0,0]=4 2166 B13R1.12 CNNC(=O)c1cccc(c1I)O 22a_100016993582_100010084636 [0,2,0,0,0,0|2,0,0]=4 2167 B13R1.12 CNNC(=O)c1cccc(c1O)O 22a_100016993582_100000690420 [0,2,0,0,0,0|2,0,0]=4 2168 B13R1.12 COCC(=O)c1cccc(c1C)I 34a_100138415774_100160470822 [0,2,0,0,0,0|2,0,0]=4 2169 B13R1.12 COCC(=O)c1cccc(c1F)Br 34a_100138415774_100012356374 [0,2,0,0,0,0|2,0,0]=4 2170 B13R1.12 COCC(=O)c1cccc(c1F)Cl 34a_100138415774_200012351890 [0,2,0,0,0,0|2,0,0]=4 2171 B13R1.12 Cc1c(cccc1C(=O)CC#N)O 1458a_100000766327_100011214920 [0,2,0,0,0,0|2,0,0]=4 2172 B13R1.12 Cc1c(cccc1C(=O)CCF)O 1458a_100000766327_100011217306 [0,2,0,0,0,0|2,0,0]=4 2173 B13R1.12 Cc1c(cccc1C(=O)CCO)Br 1458a_100000760464_100000211926 [0,2,0,0,0,0|2,0,0]=4 2174 B13R1.12 Cc1c(cccc1C(=O)CCO)Cl 1458a_100000690184_100000211926 [0,2,0,0,0,0|2,0,0]=4 2175 B13R1.12 Cc1c(cccc1C(=O)CCO)F 1458a_100011218272_100000211926 [0,2,0,0,0,0|2,0,0]=4 2176 B13R1.12 Cc1c(cccc1C(=O)CCO)I 1458a_100000751865_100000211926 [0,2,0,0,0,0|2,0,0]=4 2177 B13R1.12 Cc1c(cccc1C(=O)CCO)O 1458a_100000766327_100000211926 [0,2,0,0,0,0|1,0,0]=3 2178 B13R1.12 Cc1cccc(c1Br)C(=O)CCO 1458a_100000692419_100000211926 [0,2,0,0,0,0|2,0,0]=4 2179 B13R1.12 Cc1cccc(c1C)C(=O)CCO 1458a_100000183679_100000211926 [0,2,0,0,0,0|2,0,0]=4 2180 B13R1.12 Cc1cccc(c1Cl)C(=O)CCO 1458a_100000693142_100000211926 [0,2,0,0,0,0|2,0,0]=4 2181 B13R1.12 Cc1cccc(c1F)C(=O)CCO 1458a_100000766181_100000211926 [0,2,0,0,0,0|2,0,0]=4 2182 B13R1.12 Cc1cccc(c1I)C(=O)CCO 1458a_100000739377_100000211926 [0,2,0,0,0,0|2,0,0]=4 2183 B13R1.12 Cc1cccc(c1O)C(=O)CCO 1458a_100000183896_100000211926 [0,2,0,0,0,0|2,0,0]=4 2184 B13R1.12 N#CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100011214920 [0,2,0,0,0,0|2,0,0]=4 2185 B13R1.12 N#CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100011214920 [0,2,0,0,0,0|2,0,0]=4 2186 B13R1.12 N#CCC(=O)c1cccc(c1F)O 1458a_100000037433_100011214920 [0,2,0,0,0,0|2,0,0]=4 2187 B13R1.12 N#CCC(=O)c1cccc(c1I)O 1458a_100010084636_100011214920 [0,2,0,0,0,0|2,0,0]=4 2188 B13R1.12 N#CCC(=O)c1cccc(c1O)O 1458a_100000690420_100011214920 [0,2,0,0,0,0|2,0,0]=4 2189 B13R1.12 O=C(CCF)c1cccc(c1Br)O 1458a_100010230362_100011217306 [0,2,0,0,0,0|2,0,0]=4 2190 B13R1.12 O=C(CCF)c1cccc(c1Cl)O 1458a_100000092362_100011217306 [0,2,0,0,0,0|2,0,0]=4 2191 B13R1.12 O=C(CCF)c1cccc(c1F)O 1458a_100000037433_100011217306 [0,2,0,0,0,0|2,0,0]=4 2192 B13R1.12 O=C(CCF)c1cccc(c1I)O 1458a_100010084636_100011217306 [0,2,0,0,0,0|2,0,0]=4 2193 B13R1.12 O=C(CCF)c1cccc(c1O)O 1458a_100000690420_100011217306 [0,2,0,0,0,0|2,0,0]=4 2194 B13R1.12 O=C(CCO)c1cccc(c1Br)Br 1458a_100012360534_100000211926 [0,2,0,0,0,0|2,0,0]=4 2195 B13R1.12 O=C(CCO)c1cccc(c1Br)Cl 1458a_100012339722_100000211926 [0,2,0,0,0,0|2,0,0]=4 2196 B13R1.12 O=C(CCO)c1cccc(c1Br)F 1458a_100011217547_100000211926 [0,2,0,0,0,0|2,0,0]=4 2197 B13R1.12 O=C(CCO)c1cccc(c1Br)I 1458a_100010232522_100000211926 [0,2,0,0,0,0|2,0,0]=4 2198 B13R1.12 O=C(CCO)c1cccc(c1Br)O 1458a_100010230362_100000211926 [0,2,0,0,0,0|1,0,0]=3 2199 B13R1.12 O=C(CCO)c1cccc(c1Cl)Br 1458a_100000760540_100000211926 [0,2,0,0,0,0|2,0,0]=4 2200 B13R1.12 O=C(CCO)c1cccc(c1Cl)Cl 1458a_100000183631_100000211926 [0,2,0,0,0,0|2,0,0]=4 2201 B13R1.12 O=C(CCO)c1cccc(c1Cl)F 1458a_100000759904_100000211926 [0,2,0,0,0,0|2,0,0]=4 2202 B13R1.12 O=C(CCO)c1cccc(c1Cl)I 1458a_100010176783_100000211926 [0,2,0,0,0,0|2,0,0]=4 2203 B13R1.12 O=C(CCO)c1cccc(c1Cl)O 1458a_100000092362_100000211926 [0,2,0,0,0,0|1,0,0]=3 2204 B13R1.12 O=C(CCO)c1cccc(c1F)Br 1458a_100000756403_100000211926 [0,2,0,0,0,0|2,0,0]=4 2205 B13R1.12 O=C(CCO)c1cccc(c1F)Cl 1458a_100000688816_100000211926 [0,2,0,0,0,0|2,0,0]=4 2206 B13R1.12 O=C(CCO)c1cccc(c1F)F 1458a_100000748134_100000211926 [0,2,0,0,0,0|2,0,0]=4 2207 B13R1.12 O=C(CCO)c1cccc(c1F)I 1458a_100010185205_100000211926 [0,2,0,0,0,0|2,0,0]=4 2208 B13R1.12 O=C(CCO)c1cccc(c1F)O 1458a_100000037433_100000211926 [0,2,0,0,0,0|1,0,0]=3 2209 B13R1.12 O=C(CCO)c1cccc(c1I)Br 1458a_100000688019_100000211926 [0,2,0,0,0,0|2,0,0]=4 2210 B13R1.12 O=C(CCO)c1cccc(c1I)Cl 1458a_100010176784_100000211926 [0,2,0,0,0,0|2,0,0]=4 2211 B13R1.12 O=C(CCO)c1cccc(c1I)F 1458a_100000690930_100000211926 [0,2,0,0,0,0|2,0,0]=4 2212 B13R1.12 O=C(CCO)c1cccc(c1I)O 1458a_100010084636_100000211926 [0,2,0,0,0,0|1,0,0]=3 2213 B13R1.12 O=C(CCO)c1cccc(c1O)Br 1458a_100000752940_100000211926 [0,2,0,0,0,0|2,0,0]=4 2214 B13R1.12 O=C(CCO)c1cccc(c1O)Cl 1458a_100000742801_100000211926 [0,2,0,0,0,0|2,0,0]=4 2215 B13R1.12 O=C(CCO)c1cccc(c1O)F 1458a_100011217230_100000211926 [0,2,0,0,0,0|2,0,0]=4 2216 B13R1.12 O=C(CCO)c1cccc(c1O)O 1458a_100000690420_100000211926 [0,2,0,0,0,0|1,0,0]=3 2217 B13R1.82 C=Cc1cccc(c1Br)C(=O)OC 271570a_100011290941_100010240208 [0,2,0,0,0,0|2,0,0]=4 2218 B13R1.82 C=Cc1cccc(c1C)C(=O)OC 271570a_100011290941_100012298220 [0,2,0,0,0,0|2,0,0]=4 2219 B13R1.82 C=Cc1cccc(c1F)C(=O)OC 271570a_100011290941_100012355674 [0,2,0,0,0,0|2,0,0]=4 2220 B13R1.82 C=Cc1cccc(c1N)C(=O)OC 271570a_100011290941_100011356556 [0,2,0,0,0,0|1,0,0]=3 2221 B13R1.82 C=Cc1cccc(c1O)C(=O)OC 271570a_100011290941_100009816214 [0,2,0,0,0,0|2,0,0]=4 2222 B13R1.82 C=Cc1nccc(c1N)C(=O)OC 271570a_100011290941_100000067308 [0,2,0,0,0,0|2,0,0]=4 2223 B13R1.82 CCC(=O)c1cccc(c1Br)OC 1458a_100010245468_100000210202 [0,2,0,0,0,0|2,0,0]=4 2224 B13R1.82 CCC(=O)c1cccc(c1C)OC 1458a_100011217801_100000210202 [0,2,0,0,0,0|2,0,0]=4 2225 B13R1.82 CCC(=O)c1cccc(c1Cl)OC 1458a_100000068443_100000210202 [0,2,0,0,0,0|2,0,0]=4 2226 B13R1.82 CCC(=O)c1cccc(c1F)OC 1458a_100000766180_100000210202 [0,2,0,0,0,0|2,0,0]=4 2227 B13R1.82 CCC(=O)c1cccc(c1I)OC 1458a_100010075502_100000210202 [0,2,0,0,0,0|2,0,0]=4 2228 B13R1.82 CCC(=O)c1cccc(c1O)OC 1458a_100000212136_100000210202 [0,2,0,0,0,0|2,0,0]=4 2229 B13R1.82 CCc1cccc(c1O)C(=O)OC 271570a_203496583355_200009992460 [0,2,0,0,0,0|2,0,0]=4 2230 B13R1.82 CNC(=O)c1cccc(c1Br)OC 11a_106832991635_100010245468 [0,2,0,0,0,0|2,0,0]=4 2231 B13R1.82 CNC(=O)c1cccc(c1Br)OC 1626a_100102657272_100010245468 [0,2,0,0,0,0|2,0,0]=4 2232 B13R1.82 CNC(=O)c1cccc(c1Br)OC 240690a_100102657272_100010245468 [0,2,0,0,0,0|2,0,0]=4 2233 B13R1.82 CNC(=O)c1cccc(c1Br)OC 527a_100102657272_100010245468 [0,2,0,0,0,0|2,0,0]=4 2234 B13R1.82 CNC(=O)c1cccc(c1C)OC 11a_106832991635_100011217801 [0,2,0,0,0,0|2,0,0]=4 2235 B13R1.82 CNC(=O)c1cccc(c1C)OC 1626a_100102657272_100011217801 [0,2,0,0,0,0|2,0,0]=4 2236 B13R1.82 CNC(=O)c1cccc(c1C)OC 240690a_100102657272_100011217801 [0,2,0,0,0,0|2,0,0]=4 2237 B13R1.82 CNC(=O)c1cccc(c1C)OC 527a_100102657272_100011217801 [0,2,0,0,0,0|2,0,0]=4 2238 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 11a_106832991635_100000068443 [0,2,0,0,0,0|2,0,0]=4 2239 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 1626a_100102657272_100000068443 [0,2,0,0,0,0|2,0,0]=4 2240 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 240690a_100102657272_100000068443 [0,2,0,0,0,0|2,0,0]=4 2241 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 527a_100102657272_100000068443 [0,2,0,0,0,0|2,0,0]=4 2242 B13R1.82 CNC(=O)c1cccc(c1F)OC 11a_106832991635_100000766180 [0,2,0,0,0,0|2,0,0]=4 2243 B13R1.82 CNC(=O)c1cccc(c1F)OC 1626a_100102657272_100000766180 [0,2,0,0,0,0|2,0,0]=4 2244 B13R1.82 CNC(=O)c1cccc(c1F)OC 240690a_100102657272_100000766180 [0,2,0,0,0,0|2,0,0]=4 2245 B13R1.82 CNC(=O)c1cccc(c1F)OC 527a_100102657272_100000766180 [0,2,0,0,0,0|2,0,0]=4 2246 B13R1.82 CNC(=O)c1cccc(c1I)OC 11a_106832991635_100010075502 [0,2,0,0,0,0|2,0,0]=4 2247 B13R1.82 CNC(=O)c1cccc(c1I)OC 1626a_100102657272_100010075502 [0,2,0,0,0,0|2,0,0]=4 2248 B13R1.82 CNC(=O)c1cccc(c1I)OC 240690a_100102657272_100010075502 [0,2,0,0,0,0|2,0,0]=4 2249 B13R1.82 CNC(=O)c1cccc(c1I)OC 527a_100102657272_100010075502 [0,2,0,0,0,0|2,0,0]=4 2250 B13R1.82 CNC(=O)c1cccc(c1O)OC 240690a_100102657272_100000212136 [0,2,0,0,0,0|2,0,0]=4 2251 B13R1.82 CNC(=O)c1cccc(c1O)OC 527a_100102657272_100000212136 [0,2,0,0,0,0|2,0,0]=4 2252 B13R1.82 COC(=O)c1cccc(c1Br)OC 34a_200010230364_200000210301 [0,2,0,0,0,0|1,0,0]=3 2253 B13R1.82 COC(=O)c1cccc(c1Br)OC 7a_200010230364_200000210301 [0,2,0,0,0,0|1,0,0]=3 2254 B13R1.82 COC(=O)c1cccc(c1Br)O[13CH3] 34a_200010230364_200025704644 [0,2,0,0,0,0|1,0,0]=3 2255 B13R1.82 COC(=O)c1cccc(c1Br)O[13CH3] 7a_200010230364_200025704644 [0,2,0,0,0,0|1,0,0]=3 2256 B13R1.82 COC(=O)c1cccc(c1Br)SC 62a_100010240208_200000210301 [0,2,0,0,0,0|1,1,0]=4 2257 B13R1.82 COC(=O)c1cccc(c1Br)SC 62a_200000210301_100010240208 [0,2,0,0,0,0|1,1,0]=4 2258 B13R1.82 COC(=O)c1cccc(c1Br)S[13CH3] 62a_100010240208_200025704644 [0,2,0,0,0,0|1,1,0]=4 2259 B13R1.82 COC(=O)c1cccc(c1Br)S[13CH3] 62a_200025704644_100010240208 [0,2,0,0,0,0|1,1,0]=4 2260 B13R1.82 COC(=O)c1cccc(c1C)OC 34a_100011999632_200000210301 [0,2,0,0,0,0|1,0,0]=3 2261 B13R1.82 COC(=O)c1cccc(c1C)OC 7a_100011999632_200000210301 [0,2,0,0,0,0|1,0,0]=3 2262 B13R1.82 COC(=O)c1cccc(c1C)O[13CH3] 34a_100011999632_200025704644 [0,2,0,0,0,0|1,0,0]=3 2263 B13R1.82 COC(=O)c1cccc(c1C)O[13CH3] 7a_100011999632_200025704644 [0,2,0,0,0,0|1,0,0]=3 2264 B13R1.82 COC(=O)c1cccc(c1C)SC 62a_100012298220_200000210301 [0,2,0,0,0,0|1,1,0]=4 2265 B13R1.82 COC(=O)c1cccc(c1C)SC 62a_200000210301_100012298220 [0,2,0,0,0,0|1,1,0]=4 2266 B13R1.82 COC(=O)c1cccc(c1C)S[13CH3] 62a_100012298220_200025704644 [0,2,0,0,0,0|1,1,0]=4 2267 B13R1.82 COC(=O)c1cccc(c1C)S[13CH3] 62a_200025704644_100012298220 [0,2,0,0,0,0|1,1,0]=4 2268 B13R1.82 COC(=O)c1cccc(c1Cl)OC 34a_100009866855_200000210301 [0,2,0,0,0,0|1,0,0]=3 2269 B13R1.82 COC(=O)c1cccc(c1Cl)OC 7a_100009866855_200000210301 [0,2,0,0,0,0|1,0,0]=3 2270 B13R1.82 COC(=O)c1cccc(c1Cl)O[13CH3] 34a_100009866855_200025704644 [0,2,0,0,0,0|1,0,0]=3 2271 B13R1.82 COC(=O)c1cccc(c1Cl)O[13CH3] 7a_100009866855_200025704644 [0,2,0,0,0,0|1,0,0]=3 2272 B13R1.82 COC(=O)c1cccc(c1F)OC 34a_100009854753_200000210301 [0,2,0,0,0,0|1,0,0]=3 2273 B13R1.82 COC(=O)c1cccc(c1F)OC 7a_100009854753_200000210301 [0,2,0,0,0,0|1,0,0]=3 2274 B13R1.82 COC(=O)c1cccc(c1F)O[13CH3] 34a_100009854753_200025704644 [0,2,0,0,0,0|1,0,0]=3 2275 B13R1.82 COC(=O)c1cccc(c1F)O[13CH3] 7a_100009854753_200025704644 [0,2,0,0,0,0|1,0,0]=3 2276 B13R1.82 COC(=O)c1cccc(c1F)SC 62a_100012355674_200000210301 [0,2,0,0,0,0|1,1,0]=4 2277 B13R1.82 COC(=O)c1cccc(c1F)SC 62a_200000210301_100012355674 [0,2,0,0,0,0|1,1,0]=4 2278 B13R1.82 COC(=O)c1cccc(c1F)S[13CH3] 62a_100012355674_200025704644 [0,2,0,0,0,0|1,1,0]=4 2279 B13R1.82 COC(=O)c1cccc(c1F)S[13CH3] 62a_200025704644_100012355674 [0,2,0,0,0,0|1,1,0]=4 2280 B13R1.82 COC(=O)c1cccc(c1N)OC 34a_100015205654_200000210301 [0,2,0,0,0,0|0,0,0]=2 2281 B13R1.82 COC(=O)c1cccc(c1N)OC 7a_100015205654_200000210301 [0,2,0,0,0,0|0,0,0]=2 2282 B13R1.82 COC(=O)c1cccc(c1N)O[13CH3] 34a_100015205654_200025704644 [0,2,0,0,0,0|0,0,0]=2 2283 B13R1.82 COC(=O)c1cccc(c1N)O[13CH3] 7a_100015205654_200025704644 [0,2,0,0,0,0|0,0,0]=2 2284 B13R1.82 COC(=O)c1cccc(c1N)SC 62a_100011356556_200000210301 [0,2,0,0,0,0|0,1,0]=3 2285 B13R1.82 COC(=O)c1cccc(c1N)S[13CH3] 62a_100011356556_200025704644 [0,2,0,0,0,0|0,1,0]=3 2286 B13R1.82 COC(=O)c1cccc(c1O)OC 271570a_203496583355_100010189551 [0,2,0,0,0,0|1,0,0]=3 2287 B13R1.82 COC(=O)c1cccc(c1O)SC 62a_100009816214_200000210301 [0,2,0,0,0,0|1,1,0]=4 2288 B13R1.82 COC(=O)c1cccc(c1O)S[13CH3] 62a_100009816214_200025704644 [0,2,0,0,0,0|1,1,0]=4 2289 B13R1.82 COC(=O)c1ccnc(c1N)SC 62a_100000067308_200000210301 [0,2,0,0,0,0|1,1,0]=4 2290 B13R1.82 COC(=O)c1ccnc(c1N)SC 62a_200000210301_100000067308 [0,2,0,0,0,0|1,1,0]=4 2291 B13R1.82 COC(=O)c1ccnc(c1N)S[13CH3] 62a_100000067308_200025704644 [0,2,0,0,0,0|1,1,0]=4 2292 B13R1.82 COC(=O)c1ccnc(c1N)S[13CH3] 62a_200025704644_100000067308 [0,2,0,0,0,0|1,1,0]=4 2293 B13R1.82 COc1cccc(c1Br)C(=O)CF 1458a_100010245468_100015361967 [0,2,0,0,0,0|2,0,0]=4 2294 B13R1.82 COc1cccc(c1C)C(=O)CF 1458a_100011217801_100015361967 [0,2,0,0,0,0|2,0,0]=4 2295 B13R1.82 COc1cccc(c1Cl)C(=O)CF 1458a_100000068443_100015361967 [0,2,0,0,0,0|2,0,0]=4 2296 B13R1.82 COc1cccc(c1F)C(=O)CF 1458a_100000766180_100015361967 [0,2,0,0,0,0|2,0,0]=4 2297 B13R1.82 COc1cccc(c1I)C(=O)CF 1458a_100010075502_100015361967 [0,2,0,0,0,0|2,0,0]=4 2298 B13R1.82 COc1cccc(c1O)C(=O)CF 1458a_100000212136_100015361967 [0,2,0,0,0,0|2,0,0]=4 2299 B13R1.107 C=Cc1c(cccc1C(=O)OC)Br 271570a_100011290941_100010150843 [0,2,0,0,0,0|2,0,0]=4 2300 B13R1.107 C=Cc1c(cccc1C(=O)OC)C 271570a_100011290941_100012002529 [0,2,0,0,0,0|2,0,0]=4 2301 B13R1.107 C=Cc1c(cccc1C(=O)OC)F 271570a_100011290941_100012357630 [0,2,0,0,0,0|2,0,0]=4 2302 B13R1.107 C=Cc1c(cccc1C(=O)OC)N 271570a_100011290941_100000719424 [0,2,0,0,0,0|2,0,0]=4 2303 B13R1.107 C=Cc1c(cccc1C(=O)OC)O 271570a_100011290941_200010230364 [0,2,0,0,0,0|1,0,0]=3 2304 B13R1.107 CCC(=O)c1cccc(c1OC)O 1458a_100000080799_100000210202 [0,2,0,0,0,0|2,0,0]=4 2305 B13R1.107 CNC(=O)c1cccc(c1NC)C 34a_100000223168_200000210301 [0,2,0,0,0,0|2,0,0]=4 2306 B13R1.107 CNC(=O)c1cccc(c1NC)Cl 34a_200012181065_200000210301 [0,2,0,0,0,0|2,0,0]=4 2307 B13R1.107 CNC(=O)c1cccc(c1N[13CH3])C 34a_100000223168_200025704644 [0,2,0,0,0,0|2,0,0]=4 2308 B13R1.107 CNC(=O)c1cccc(c1N[13CH3])Cl 34a_200012181065_200025704644 [0,2,0,0,0,0|2,0,0]=4 2309 B13R1.107 COC(=O)c1cccc(c1C#N)O 271570a_203496583355_100000766541 [0,2,0,0,0,0|0,0,1]=3 2310 B13R1.107 COC(=O)c1cccc(c1OC)Br 34a_100009816214_200000210301 [0,2,0,0,0,0|2,0,0]=4 2311 B13R1.107 COC(=O)c1cccc(c1OC)C 34a_100000149854_200000210301 [0,2,0,0,0,0|2,0,0]=4 2312 B13R1.107 COC(=O)c1cccc(c1OC)C 7a_100000149854_200000210301 [0,2,0,0,0,0|2,0,0]=4 2313 B13R1.107 COC(=O)c1cccc(c1OC)Cl 34a_100000074923_200000210301 [0,2,0,0,0,0|2,0,0]=4 2314 B13R1.107 COC(=O)c1cccc(c1OC)Cl 7a_100000074923_200000210301 [0,2,0,0,0,0|2,0,0]=4 2315 B13R1.107 COC(=O)c1cccc(c1OC)F 34a_100000082593_200000210301 [0,2,0,0,0,0|2,0,0]=4 2316 B13R1.107 COC(=O)c1cccc(c1OC)F 7a_100000082593_200000210301 [0,2,0,0,0,0|2,0,0]=4 2317 B13R1.107 COC(=O)c1cccc(c1OC)N 34a_100000750886_200000210301 [0,2,0,0,0,0|2,0,0]=4 2318 B13R1.107 COC(=O)c1cccc(c1OC)O 271570a_203496583355_100010233336 [0,2,0,0,0,0|1,0,0]=3 2319 B13R1.107 COC(=O)c1cccc(c1O[13CH3])Br 34a_100009816214_200025704644 [0,2,0,0,0,0|2,0,0]=4 2320 B13R1.107 COC(=O)c1cccc(c1O[13CH3])C 34a_100000149854_200025704644 [0,2,0,0,0,0|2,0,0]=4 2321 B13R1.107 COC(=O)c1cccc(c1O[13CH3])C 7a_100000149854_200025704644 [0,2,0,0,0,0|2,0,0]=4 2322 B13R1.107 COC(=O)c1cccc(c1O[13CH3])Cl 34a_100000074923_200025704644 [0,2,0,0,0,0|2,0,0]=4 2323 B13R1.107 COC(=O)c1cccc(c1O[13CH3])Cl 7a_100000074923_200025704644 [0,2,0,0,0,0|2,0,0]=4 2324 B13R1.107 COC(=O)c1cccc(c1O[13CH3])F 34a_100000082593_200025704644 [0,2,0,0,0,0|2,0,0]=4 2325 B13R1.107 COC(=O)c1cccc(c1O[13CH3])F 7a_100000082593_200025704644 [0,2,0,0,0,0|2,0,0]=4 2326 B13R1.107 COC(=O)c1cccc(c1O[13CH3])N 34a_100000750886_200025704644 [0,2,0,0,0,0|2,0,0]=4 2327 B13R1.107 COC(=O)c1cccc(c1SC)Br 62a_100010150843_200000210301 [0,2,0,0,0,0|2,0,0]=4 2328 B13R1.107 COC(=O)c1cccc(c1SC)Br 62a_200000210301_100010150843 [0,2,0,0,0,0|2,0,0]=4 2329 B13R1.107 COC(=O)c1cccc(c1SC)C 62a_100012002529_200000210301 [0,2,0,0,0,0|2,0,0]=4 2330 B13R1.107 COC(=O)c1cccc(c1SC)C 62a_200000210301_100012002529 [0,2,0,0,0,0|2,0,0]=4 2331 B13R1.107 COC(=O)c1cccc(c1SC)F 62a_100012357630_200000210301 [0,2,0,0,0,0|2,0,0]=4 2332 B13R1.107 COC(=O)c1cccc(c1SC)F 62a_200000210301_100012357630 [0,2,0,0,0,0|2,0,0]=4 2333 B13R1.107 COC(=O)c1cccc(c1SC)N 62a_100000719424_200000210301 [0,2,0,0,0,0|2,0,0]=4 2334 B13R1.107 COC(=O)c1cccc(c1SC)O 62a_200000210301_200010230364 [0,2,0,0,0,0|1,0,0]=3 2335 B13R1.107 COC(=O)c1cccc(c1SC)O 62a_200010230364_200000210301 [0,2,0,0,0,0|1,0,0]=3 2336 B13R1.107 COC(=O)c1cccc(c1S[13CH3])Br 62a_100010150843_200025704644 [0,2,0,0,0,0|2,0,0]=4 2337 B13R1.107 COC(=O)c1cccc(c1S[13CH3])Br 62a_200025704644_100010150843 [0,2,0,0,0,0|2,0,0]=4 2338 B13R1.107 COC(=O)c1cccc(c1S[13CH3])C 62a_100012002529_200025704644 [0,2,0,0,0,0|2,0,0]=4 2339 B13R1.107 COC(=O)c1cccc(c1S[13CH3])C 62a_200025704644_100012002529 [0,2,0,0,0,0|2,0,0]=4 2340 B13R1.107 COC(=O)c1cccc(c1S[13CH3])F 62a_100012357630_200025704644 [0,2,0,0,0,0|2,0,0]=4 2341 B13R1.107 COC(=O)c1cccc(c1S[13CH3])F 62a_200025704644_100012357630 [0,2,0,0,0,0|2,0,0]=4 2342 B13R1.107 COC(=O)c1cccc(c1S[13CH3])N 62a_100000719424_200025704644 [0,2,0,0,0,0|2,0,0]=4 2343 B13R1.107 COC(=O)c1cccc(c1S[13CH3])O 62a_200010230364_200025704644 [0,2,0,0,0,0|1,0,0]=3 2344 B13R1.107 COC(=O)c1cccc(c1S[13CH3])O 62a_200025704644_200010230364 [0,2,0,0,0,0|1,0,0]=3 2345 B13R1.107 COc1c(cccc1C(=O)CF)O 1458a_100000080799_100015361967 [0,2,0,0,0,0|2,0,0]=4 2346 B13R1.1808 CCC(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_100000210202 [0,2,0,0,0,0|2,0,0]=4 2347 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_100000210202 [0,2,0,0,0,0|2,0,0]=4 2348 B13R1.1808 CCC(=O)c1ccc(c(c1F)O)F 1458a_100000084588_100000210202 [0,2,0,0,0,0|2,0,0]=4 2349 B13R1.1808 CCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000210202 [0,2,0,0,0,0|2,0,0]=4 2350 B13R1.1808 CNC(=O)c1ccc(c(c1Br)O)Br 240690a_100102657272_100016068111 [0,2,0,0,0,0|2,0,0]=4 2351 B13R1.1808 CNC(=O)c1ccc(c(c1Br)O)Br 527a_100102657272_100016068111 [0,2,0,0,0,0|2,0,0]=4 2352 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)O)O 240690a_100102657272_100009910189 [0,2,0,0,0,0|2,0,0]=4 2353 B13R1.1808 CNC(=O)c1ccc(c(c1F)O)F 240690a_100102657272_100000084588 [0,2,0,0,0,0|2,0,0]=4 2354 B13R1.1808 COC(=O)c1ccc(c(c1C)C)O 271570a_203496583355_100010761469 [0,2,0,0,0,0|2,0,0]=4 2355 B13R1.1808 COC(=O)c1ccc(c(c1C)F)O 271570a_203496583355_100010291505 [0,2,0,0,0,0|2,0,0]=4 2356 B13R1.1808 COC(=O)c1ccc(c(c1C)O)C 271570a_203496583355_200010734123 [0,2,0,0,0,0|1,0,0]=3 2357 B13R1.1808 COC(=O)c1ccc(c(c1C)O)N 271570a_203496583355_100010764323 [0,2,0,0,0,0|1,0,0]=3 2358 B13R1.1808 COC(=O)c1ccc(c(c1C)O)O 271570a_203496583355_100010889012 [0,2,0,0,0,0|1,0,0]=3 2359 B13R1.1808 COC(=O)c1ccc(c(c1Cl)O)N 271570a_203496583355_200016031531 [0,2,0,0,0,0|1,0,0]=3 2360 B13R1.1808 COC(=O)c1ccc(c(c1F)C)O 271570a_203496583355_100010172522 [0,2,0,0,0,0|2,0,0]=4 2361 B13R1.1808 COC(=O)c1ccc(c(c1F)F)O 271570a_203496583355_100010982024 [0,2,0,0,0,0|2,0,0]=4 2362 B13R1.1808 COC(=O)c1ccc(c(c1F)O)F 271570a_203496583355_100000697099 [0,2,0,0,0,0|1,0,0]=3 2363 B13R1.1808 COC(=O)c1ccc(c(c1F)O)O 271570a_203496583355_100011096176 [0,2,0,0,0,0|1,0,0]=3 2364 B13R1.1808 COC(=O)c1ccc(c(c1N)C)O 271570a_203496583355_100000764893 [0,2,0,0,0,0|1,0,0]=3 2365 B13R1.1808 COC(=O)c1ccc(c(c1N)F)O 271570a_203496583355_100022009169 [0,2,0,0,0,0|1,0,0]=3 2366 B13R1.1808 COC(=O)c1ccc(c(c1O)F)F 271570a_203496583355_100010710315 [0,2,0,0,0,0|2,0,0]=4 2367 B13R1.1808 COC(=O)c1ccc(c(c1O)F)O 271570a_203496583355_100011092008 [0,2,0,0,0,0|2,0,0]=4 2368 B13R1.1808 O=C(CF)c1ccc(c(c1Br)O)Br 1458a_100016068111_100015361967 [0,2,0,0,0,0|2,0,0]=4 2369 B13R1.1808 O=C(CF)c1ccc(c(c1Cl)O)O 1458a_100009910189_100015361967 [0,2,0,0,0,0|2,0,0]=4 2370 B13R1.1808 O=C(CF)c1ccc(c(c1F)O)F 1458a_100000084588_100015361967 [0,2,0,0,0,0|2,0,0]=4 2371 B13R1.1808 O=C(CF)c1ccc(c(c1O)O)O 1458a_100000037941_100015361967 [0,2,0,0,0,0|2,0,0]=4 2372 B13R1.1822 CCC(=O)c1c(ccc(c1F)O)F 1458a_100000068660_100000210202 [0,2,0,0,0,0|2,0,0]=4 2373 B13R1.1822 CNC(=O)c1c(ccc(c1F)O)F 240690a_100102657272_100000068660 [0,2,0,0,0,0|2,0,0]=4 2374 B13R1.1822 CNC(=O)c1c(ccc(c1F)O)F 527a_100102657272_100000068660 [0,2,0,0,0,0|2,0,0]=4 2375 B13R1.1822 COC(=O)c1c(ccc(c1C)F)O 271570a_203496583355_100015681208 [0,2,0,0,0,0|2,0,0]=4 2376 B13R1.1822 COC(=O)c1c(ccc(c1C)N)O 271570a_203496583355_100000718917 [0,2,0,0,0,0|2,0,0]=4 2377 B13R1.1822 COC(=O)c1c(ccc(c1C)O)C 271570a_203496583355_100016100700 [0,2,0,0,0,0|1,0,0]=3 2378 B13R1.1822 COC(=O)c1c(ccc(c1C)O)N 271570a_203496583355_100010203172 [0,2,0,0,0,0|1,0,0]=3 2379 B13R1.1822 COC(=O)c1c(ccc(c1C)O)O 271570a_203496583355_100010074912 [0,2,0,0,0,0|1,0,0]=3 2380 B13R1.1822 COC(=O)c1c(ccc(c1F)Br)O 271570a_203496583355_100015883209 [0,2,0,0,0,0|2,0,0]=4 2381 B13R1.1822 COC(=O)c1c(ccc(c1F)C)O 271570a_203496583355_100010782293 [0,2,0,0,0,0|2,0,0]=4 2382 B13R1.1822 COC(=O)c1c(ccc(c1F)O)F 271570a_203496583355_100000721510 [0,2,0,0,0,0|1,0,0]=3 2383 B13R1.1822 COC(=O)c1c(ccc(c1O)F)F 271570a_203496583355_100011071027 [0,2,0,0,0,0|2,0,0]=4 2384 B13R1.1822 O=C(CF)c1c(ccc(c1F)O)F 1458a_100000068660_100015361967 [0,2,0,0,0,0|2,0,0]=4 2385 B13R1.4789 CCC(=O)c1cc(cc(c1C)O)Br 1458a_100011101721_100000210202 [0,2,0,0,0,0|2,0,0]=4 2386 B13R1.4789 CCC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_100000210202 [0,2,0,0,0,0|2,0,0]=4 2387 B13R1.4789 CNC(=O)c1cc(cc(c1C)O)Br 240690a_100102657272_100011101721 [0,2,0,0,0,0|2,0,0]=4 2388 B13R1.4789 CNC(=O)c1cc(cc(c1C)O)Br 527a_100102657272_100011101721 [0,2,0,0,0,0|2,0,0]=4 2389 B13R1.4789 CNC(=O)c1cc(cc(c1N)C)O 271570a_203496583355_100010284104 [0,2,0,0,0,0|2,0,0]=4 2390 B13R1.4789 COC(=O)c1cc(cc(c1C)Br)O 271570a_203496583355_100012569200 [0,2,0,0,0,0|2,0,0]=4 2391 B13R1.4789 COC(=O)c1cc(cc(c1C)F)O 271570a_203496583355_100015527428 [0,2,0,0,0,0|2,0,0]=4 2392 B13R1.4789 COC(=O)c1cc(cc(c1C)N)O 271570a_203496583355_100012257200 [0,2,0,0,0,0|2,0,0]=4 2393 B13R1.4789 COC(=O)c1cc(cc(c1C)O)F 271570a_203496583355_100012347598 [0,2,0,0,0,0|1,0,0]=3 2394 B13R1.4789 COC(=O)c1cc(cc(c1C)O)O 271570a_203496583355_200011012443 [0,2,0,0,0,0|1,0,0]=3 2395 B13R1.4789 COC(=O)c1cc(cc(c1F)C)O 271570a_203496583355_200012928940 [0,2,0,0,0,0|2,0,0]=4 2396 B13R1.4789 COC(=O)c1cc(cc(c1F)F)O 271570a_203496583355_100012362532 [0,2,0,0,0,0|2,0,0]=4 2397 B13R1.4789 COC(=O)c1cc(cc(c1F)N)O 271570a_203496583355_100011794250 [0,2,0,0,0,0|2,0,0]=4 2398 B13R1.4789 COC(=O)c1cc(cc(c1N)C)O 271570a_203496583355_100011356660 [0,2,0,0,0,0|1,0,0]=3 2399 B13R1.4789 COC(=O)c1cc(cc(c1N)N)O 271570a_203496583355_100010127340 [0,2,0,0,0,0|1,0,0]=3 2400 B13R1.4789 COC(=O)c1cc(cc(c1N)O)Br 271570a_203496583355_100010726126 [0,2,0,0,0,0|0,0,0]=2 2401 B13R1.4789 COC(=O)c1cc(cc(c1N)O)C 271570a_203496583355_100000216481 [0,2,0,0,0,0|0,0,0]=2 2402 B13R1.4789 COC(=O)c1cc(cc(c1N)O)Cl 271570a_203496583355_100000043629 [0,2,0,0,0,0|0,0,0]=2 2403 B13R1.4789 COC(=O)c1cc(cc(c1O)C)F 271570a_203496583355_100016049047 [0,2,0,0,0,0|2,0,0]=4 2404 B13R1.4789 COC(=O)c1cc(cc(c1O)F)F 271570a_203496583355_100010155431 [0,2,0,0,0,0|2,0,0]=4 2405 B13R1.4789 COC(=O)c1cc(cc(c1O)N)F 271570a_203496583355_100011794234 [0,2,0,0,0,0|2,0,0]=4 2406 B13R1.4789 COC(=O)c1cc(cc(c1O)O)Br 271570a_203496583355_100009996593 [0,2,0,0,0,0|1,0,0]=3 2407 B13R1.4789 Cc1c(cc(cc1C(=O)CF)Br)O 1458a_100011101721_100015361967 [0,2,0,0,0,0|2,0,0]=4 2408 B13R1.4789 O=C(CF)c1cc(cc(c1O)O)Br 1458a_200010196872_100015361967 [0,2,0,0,0,0|2,0,0]=4 2409 B13R1.295 CC(=O)c1cccc(c1[N+](=O)[O-])O 1458a_100000688640_200000210301 [0,2,0,0,0,0|1,0,1]=4 2410 B13R1.295 [13CH3]C(=O)c1cccc(c1[N+](=O)[O-])O 1458a_100000688640_200025704644 [0,2,0,0,0,0|1,0,1]=4 2411 B13R1.2137 CCc1c(cccc1C(=O)C)OC 1458a_100000101922_200000210301 [0,2,0,0,0,0|2,0,0]=4 2412 B13R1.2137 CCc1c(cccc1C(=O)[13CH3])OC 1458a_100000101922_200025704644 [0,2,0,0,0,0|2,0,0]=4 2413 B13R1.2137 COc1cccc(c1OC)C(=O)C 1458a_100000210806_200000210301 [0,2,0,0,0,0|2,0,0]=4 2414 B13R1.2137 COc1cccc(c1OC)C(=O)[13CH3] 1458a_100000210806_200025704644 [0,2,0,0,0,0|2,0,0]=4 2415 B13R1.3255 CNc1c(cc(cc1C(=O)N)Cl)C 34a_200000101212_200000210301 [0,2,0,0,0,0|2,0,0]=4 2416 B13R1.3255 CNc1c(cc(cc1C(=O)N)Cl)C 7a_200000101212_200000210301 [0,2,0,0,0,0|2,0,0]=4 2417 B13R1.3255 Cc1cc(cc(c1N[13CH3])C(=O)N)Cl 34a_200000101212_200025704644 [0,2,0,0,0,0|2,0,0]=4 2418 B13R1.3255 Cc1cc(cc(c1N[13CH3])C(=O)N)Cl 7a_200000101212_200025704644 [0,2,0,0,0,0|2,0,0]=4 2419 B13R1.4012 CCNc1c(cccc1C(=O)N)C 34a_100000223273_100000210202 [0,2,0,0,0,0|2,0,0]=4 2420 B13R1.4012 CCNc1c(cccc1C(=O)N)Cl 34a_200011997947_100000210202 [0,2,0,0,0,0|2,0,0]=4 2421 B13R1.4012 CCNc1c(cccc1C(=O)N)F 34a_100011722151_100000210202 [0,2,0,0,0,0|2,0,0]=4 2422 B13R1.4012 CNCc1c(cccc1C(=O)C)Br 26a_100102657272_100009815558 [0,2,0,0,0,0|2,0,0]=4 2423 B13R1.4012 Cc1cccc(c1NCF)C(=O)N 34a_100000223273_100015361967 [0,2,0,0,0,0|2,0,0]=4 2424 B13R1.4012 NC(=O)c1cccc(c1NCF)Cl 34a_200011997947_100015361967 [0,2,0,0,0,0|2,0,0]=4 2425 B13R1.4012 NC(=O)c1cccc(c1NCF)F 34a_100011722151_100015361967 [0,2,0,0,0,0|2,0,0]=4 2426 B13R1.299 C=C(C)c1cc(cc(c1N)CO)F 271570a_100000694244_200010775858 [0,2,0,0,0,0|2,0,0]=4 2427 B13R1.299 C=C(C)c1cc(cc(c1N)OC)F 271570a_100000694244_100011004115 [0,2,0,0,0,0|2,0,0]=4 2428 B13R1.299 COc1cc(cc(c1Cl)C(=O)C)Br 1458a_100015568607_200000210301 [0,2,0,0,0,0|2,0,0]=4 2429 B13R1.299 COc1cc(cc(c1Cl)C(=O)[13CH3])Br 1458a_100015568607_200025704644 [0,2,0,0,0,0|2,0,0]=4 2430 B13R1.299 COc1cc(cc(c1O)C(=O)C)Br 1458a_100012340195_200000210301 [0,2,0,0,0,0|2,0,0]=4 2431 B13R1.299 COc1cc(cc(c1O)C(=O)[13CH3])Br 1458a_100012340195_200025704644 [0,2,0,0,0,0|2,0,0]=4 2432 B13R1.377 C=C(C)c1cccc(c1N)OCC 271570a_100000694244_200103155331 [0,2,0,0,0,0|2,0,0]=4 2433 B13R1.377 C=C=Cc1cccc(c1N)C(=O)N 271570a_100015277604_100010144993 [0,2,0,0,0,0|2,0,0]=4 2434 B13R1.377 CC(=O)c1cccc(c1C)OCF 34a_200009877264_100015361967 [0,2,0,0,0,0|2,0,0]=4 2435 B13R1.377 CC(=O)c1cccc(c1C)OCF 7a_200009877264_100015361967 [0,2,0,0,0,0|2,0,0]=4 2436 B13R1.377 CC(=O)c1cccc(c1F)OCF 34a_100009856408_100015361967 [0,2,0,0,0,0|2,0,0]=4 2437 B13R1.377 CC(=O)c1cccc(c1F)OCF 7a_100009856408_100015361967 [0,2,0,0,0,0|2,0,0]=4 2438 B13R1.377 CC(=O)c1cccc(c1N)OCF 7a_100000036053_100015361967 [0,2,0,0,0,0|1,0,0]=3 2439 B13R1.377 CC=Cc1cccc(c1N)C(=O)N 271570a_100016259895_100010144993 [0,2,0,0,0,0|2,0,0]=4 2440 B13R1.377 CCOc1cccc(c1C)C(=O)C 34a_200009877264_100000210202 [0,2,0,0,0,0|2,0,0]=4 2441 B13R1.377 CCOc1cccc(c1C)C(=O)C 7a_200009877264_100000210202 [0,2,0,0,0,0|2,0,0]=4 2442 B13R1.377 CCOc1cccc(c1F)C(=O)C 1458a_100000100213_200000210301 [0,2,0,0,0,0|2,0,0]=4 2443 B13R1.377 CCOc1cccc(c1F)C(=O)C 34a_100009856408_100000210202 [0,2,0,0,0,0|2,0,0]=4 2444 B13R1.377 CCOc1cccc(c1F)C(=O)C 7a_100009856408_100000210202 [0,2,0,0,0,0|2,0,0]=4 2445 B13R1.377 CCOc1cccc(c1F)C(=O)N 34a_100009841371_100000210202 [0,2,0,0,0,0|2,0,0]=4 2446 B13R1.377 CCOc1cccc(c1F)C(=O)N 7a_100009841371_100000210202 [0,2,0,0,0,0|2,0,0]=4 2447 B13R1.377 CCOc1cccc(c1F)C(=O)[13CH3] 1458a_100000100213_200025704644 [0,2,0,0,0,0|2,0,0]=4 2448 B13R1.377 CCOc1cccc(c1N)C(=O)C 7a_100000036053_100000210202 [0,2,0,0,0,0|1,0,0]=3 2449 B13R1.377 CCOc1cccc(c1N)[N+](=O)[O-] 7a_100000739591_100000210202 [0,2,0,0,0,0|1,0,1]=4 2450 B13R1.377 CCSc1cccc(c1N)C(=O)N 62a_100010144993_100000210202 [0,2,0,0,0,0|1,1,0]=4 2451 B13R1.377 NC(=O)c1cccc(c1F)OCF 34a_100009841371_100015361967 [0,2,0,0,0,0|2,0,0]=4 2452 B13R1.377 NC(=O)c1cccc(c1F)OCF 7a_100009841371_100015361967 [0,2,0,0,0,0|2,0,0]=4 2453 B13R1.377 NC(=O)c1cccc(c1N)SCF 62a_100010144993_100015361967 [0,2,0,0,0,0|1,1,0]=4 2454 B13R1.377 Nc1c(cccc1[N+](=O)[O-])OCF 7a_100000739591_100015361967 [0,2,0,0,0,0|1,0,1]=4 2455 B13R1.3097 COc1ccc(c(c1Br)C(=O)C)Br 1458a_200020932704_200000210301 [0,2,0,0,0,0|2,0,0]=4 2456 B13R1.3097 COc1ccc(c(c1Br)C(=O)[13CH3])Br 1458a_200020932704_200025704644 [0,2,0,0,0,0|2,0,0]=4 2457 B13R1.3097 COc1ccc(c(c1C)C(=O)C)Br 1458a_100010074600_200000210301 [0,2,0,0,0,0|2,0,0]=4 2458 B13R1.3097 COc1ccc(c(c1C)C(=O)[13CH3])Br 1458a_100010074600_200025704644 [0,2,0,0,0,0|2,0,0]=4 2459 B13R1.3097 COc1ccc(c(c1Cl)C(=O)C)Cl 1458a_200010760820_200000210301 [0,2,0,0,0,0|2,0,0]=4 2460 B13R1.3097 COc1ccc(c(c1Cl)C(=O)C)F 1458a_100000062076_200000210301 [0,2,0,0,0,0|2,0,0]=4 2461 B13R1.3097 COc1ccc(c(c1Cl)C(=O)[13CH3])Cl 1458a_200010760820_200025704644 [0,2,0,0,0,0|2,0,0]=4 2462 B13R1.3097 COc1ccc(c(c1Cl)C(=O)[13CH3])F 1458a_100000062076_200025704644 [0,2,0,0,0,0|2,0,0]=4 2463 B13R1.3097 COc1ccc(c(c1F)C(=O)C)Br 1458a_100010204293_200000210301 [0,2,0,0,0,0|2,0,0]=4 2464 B13R1.3097 COc1ccc(c(c1F)C(=O)C)Cl 1458a_100000062078_200000210301 [0,2,0,0,0,0|2,0,0]=4 2465 B13R1.3097 COc1ccc(c(c1F)C(=O)C)F 1458a_100000062053_200000210301 [0,2,0,0,0,0|2,0,0]=4 2466 B13R1.3097 COc1ccc(c(c1F)C(=O)N)F 34a_100009825046_200000210301 [0,2,0,0,0,0|2,0,0]=4 2467 B13R1.3097 COc1ccc(c(c1F)C(=O)N)F 7a_100009825046_200000210301 [0,2,0,0,0,0|2,0,0]=4 2468 B13R1.3097 COc1ccc(c(c1F)C(=O)[13CH3])Br 1458a_100010204293_200025704644 [0,2,0,0,0,0|2,0,0]=4 2469 B13R1.3097 COc1ccc(c(c1F)C(=O)[13CH3])Cl 1458a_100000062078_200025704644 [0,2,0,0,0,0|2,0,0]=4 2470 B13R1.3097 COc1ccc(c(c1F)C(=O)[13CH3])F 1458a_100000062053_200025704644 [0,2,0,0,0,0|2,0,0]=4 2471 B13R1.3097 [13CH3]Oc1ccc(c(c1F)C(=O)N)F 34a_100009825046_200025704644 [0,2,0,0,0,0|2,0,0]=4 2472 B13R1.3097 [13CH3]Oc1ccc(c(c1F)C(=O)N)F 7a_100009825046_200025704644 [0,2,0,0,0,0|2,0,0]=4 2473 B13R1.3230 COc1c(ccc(c1F)C(=O)C)Br 1458a_100009816242_200000210301 [0,2,0,0,0,0|2,0,0]=4 2474 B13R1.3230 COc1c(ccc(c1F)C(=O)C)Cl 1458a_100010116254_200000210301 [0,2,0,0,0,0|2,0,0]=4 2475 B13R1.3230 COc1c(ccc(c1F)C(=O)C)F 1458a_100000061937_200000210301 [0,2,0,0,0,0|2,0,0]=4 2476 B13R1.3230 COc1c(ccc(c1F)C(=O)[13CH3])Br 1458a_100009816242_200025704644 [0,2,0,0,0,0|2,0,0]=4 2477 B13R1.3230 COc1c(ccc(c1F)C(=O)[13CH3])Cl 1458a_100010116254_200025704644 [0,2,0,0,0,0|2,0,0]=4 2478 B13R1.3230 COc1c(ccc(c1F)C(=O)[13CH3])F 1458a_100000061937_200025704644 [0,2,0,0,0,0|2,0,0]=4 2479 B13R1.3801 C=C(C)c1cccc(c1N)C(=O)N 271570a_100000694244_100010144993 [0,2,0,0,0,0|2,0,0]=4 2480 B13R1.2811 CC(=O)c1cc(c(c(c1F)O)F)F 1458a_100000737090_200000210301 [0,2,0,0,0,0|2,0,0]=4 2481 B13R1.2811 NC(=O)c1cc(c(c(c1N)F)Br)O 271570a_203496583355_102495333281 [0,2,0,0,0,0|2,0,0]=4 2482 B13R1.2811 [13CH3]C(=O)c1cc(c(c(c1F)O)F)F 1458a_100000737090_200025704644 [0,2,0,0,0,0|2,0,0]=4 2483 B13R1.2812 CC(=O)c1c(cc(c(c1Br)O)Br)Br 1458a_100009813419_200000210301 [0,2,0,0,0,0|2,0,0]=4 2484 B13R1.2812 CC(=O)c1c(cc(c(c1Br)O)C)C 1458a_200009992459_200000210301 [0,2,0,0,0,0|2,0,0]=4 2485 B13R1.2812 Cc1cc(c(c(c1O)Br)C(=O)[13CH3])C 1458a_200009992459_200025704644 [0,2,0,0,0,0|2,0,0]=4 2486 B13R1.2812 [13CH3]C(=O)c1c(cc(c(c1Br)O)Br)Br 1458a_100009813419_200025704644 [0,2,0,0,0,0|2,0,0]=4 2487 B13R1.3096 COc1ccc(c(c1O)N)C(=O)C 271570a_203496583355_100010236346 [0,2,0,0,0,0|1,0,0]=3 2488 B13R1.3096 COc1ccc(c(c1O)O)C(=O)C 1458a_100000045701_200000210301 [0,2,0,0,0,0|2,0,0]=4 2489 B13R1.3096 COc1ccc(c(c1O)O)C(=O)[13CH3] 1458a_100000045701_200025704644 [0,2,0,0,0,0|2,0,0]=4 2490 B11R2.106 Oc1cccc2c1CC=C2 271570a_203496583355_100009844718 [1,0,0,1,0,0|2,0,0]=4 2491 B11R2.106 Oc1cccc2c1COC2 271570a_203496583355_100010384907 [1,0,0,1,0,0|1,0,1]=4 2492 B11R2.106 Oc1cccc2c1NCC2 271570a_203496583355_100016995435 [1,0,0,1,0,0|1,0,1]=4 2493 B11R2.106 Oc1cccc2c1[nH]cc2 271570a_203496583355_100009813418 [1,0,0,1,0,0|1,0,0]=3 2494 B11R2.106 Oc1cccc2c1[nH]nc2 271570a_203496583355_100009816125 [1,0,0,1,0,0|1,0,0]=3 2495 B11R2.106 Oc1cccc2c1[nH]nn2 271570a_203496583355_100009820029 [1,0,0,1,0,0|2,0,0]=4 2496 B11R2.106 Oc1cccc2c1non2 271570a_203496583355_100009820244 [1,0,0,1,0,0|1,0,1]=4 2497 B11R2.106 Oc1cccc2c1occ2 271570a_203496583355_100011935138 [1,0,0,1,0,0|2,0,0]=4 2498 B11R2.106 Oc1cccc2c1onc2 271570a_203496583355_100000765530 [1,0,0,1,0,0|2,0,0]=4 2499 B11R2.106 Oc1cccc2c1scc2 271570a_203496583355_100000766737 [1,0,0,1,0,0|2,0,0]=4 2500 B11R2.106 Oc1ccnc2c1[nH]cc2 271570a_203496583355_100009863063 [1,0,0,1,0,0|2,0,0]=4 2501 B11R2.106 Oc1ccnc2c1[nH]nc2 271570a_203496583355_100000112858 [1,0,0,1,0,0|2,0,0]=4 2502 B11R2.106 Oc1cncc2c1[nH]cc2 271570a_203496583355_100000217057 [1,0,0,1,0,0|2,0,0]=4 2503 B11R2.106 Oc1cncc2c1[nH]nc2 271570a_203496583355_100009857261 [1,0,0,1,0,0|2,0,0]=4 2504 B11R2.106 Oc1nccc2c1[nH]cc2 271570a_203496583355_100009816714 [1,0,0,1,0,0|2,0,0]=4 2505 B11R2.106 Oc1nccc2c1[nH]nc2 271570a_203496583355_100009852419 [1,0,0,1,0,0|2,0,0]=4 2506 B11R2.1 Oc1c[nH]c2c1cccn2 271570a_203496583355_100011934613 [1,0,0,1,0,0|2,0,0]=4 2507 B11R2.1 Oc1c[nH]c2c1ccnc2 271570a_203496583355_100010232032 [1,0,0,1,0,0|2,0,0]=4 2508 B11R2.1 Oc1c[nH]c2c1cncc2 271570a_203496583355_100011934843 [1,0,0,1,0,0|2,0,0]=4 2509 B11R2.1 Oc1c[nH]c2c1nccc2 271570a_203496583355_100009817151 [1,0,0,1,0,0|2,0,0]=4 2510 B11R2.1 Oc1coc2c1cccc2 271570a_203496583355_100009812202 [1,0,0,1,0,0|2,0,0]=4 2511 B11R2.1 Oc1csc2c1cccc2 271570a_203496583355_100009813928 [1,0,0,1,0,0|2,0,0]=4 2512 B11R2.1 Oc1n[nH]c2c1cccc2 271570a_203496583355_100000050141 [1,0,0,1,0,0|1,0,0]=3 2513 B11R2.1 Oc1n[nH]c2c1cccn2 271570a_203496583355_100009888962 [1,0,0,1,0,0|2,0,0]=4 2514 B11R2.1 Oc1n[nH]c2c1ccnc2 271570a_203496583355_100010244369 [1,0,0,1,0,0|2,0,0]=4 2515 B11R2.1 Oc1n[nH]c2c1cncc2 271570a_203496583355_100010724670 [1,0,0,1,0,0|2,0,0]=4 2516 B11R2.1 Oc1n[nH]c2c1nccc2 271570a_203496583355_100009817118 [1,0,0,1,0,0|2,0,0]=4 2517 B13R2.5179 O=C1CCc2c(cccc2C1)O 271570a_203496583355_100010138409 [0,0,0,1,0,1|2,0,0]=4 2518 B13R2.5179 O=C1CCc2c(cccc2N1)O 271570a_203496583355_100010232564 [0,0,0,1,0,1|2,0,0]=4 2519 B13R2.5179 O=C1CCc2c(cccc2O1)O 271570a_203496583355_200015620928 [0,0,0,1,0,1|2,0,0]=4 2520 B13R2.5179 O=C1COc2c(cccc2N1)O 271570a_203496583355_100012355675 [0,0,0,1,0,1|2,0,0]=4 2521 B13R2.5179 O=c1ccc2c(cccc2[nH]1)O 271570a_203496583355_100000726145 [0,0,0,1,0,1|2,0,0]=4 2522 B13R2.5179 Oc1cc2cccc(c2cn1)O 271570a_203496583355_100009817091 [0,0,0,1,0,1|2,0,0]=4 2523 B13R2.5179 Oc1ccc2c(cccc2c1)O 271570a_203496583355_100010202202 [0,0,0,1,0,1|2,0,0]=4 2524 B13R2.9 C=Cc1n[nH]c2c1cccc2O 271570a_100011290941_200010988877 [0,1,0,1,0,0|2,0,0]=4 2525 B13R2.9 CSc1n[nH]c2c1cccc2O 62a_200000210301_200010988877 [0,1,0,1,0,0|1,1,0]=4 2526 B13R2.9 O=Cc1n[nH]c2c1cccc2O 271570a_203496583355_100009814788 [0,1,0,1,0,0|1,0,0]=3 2527 B13R2.9 [13CH3]Sc1n[nH]c2c1cccc2O 62a_200025704644_200010988877 [0,1,0,1,0,0|1,1,0]=4 2528 B13R2.342 O=C1CCCc2c1cccc2O 271570a_203496583355_100000691372 [0,1,0,1,0,0|2,0,0]=4 2529 B13R2.342 O=C1CCNc2c1cccc2O 271570a_203496583355_115082355814 [0,1,0,1,0,0|1,0,0]=3 2530 B13R2.342 O=C1CCOc2c1cccc2O 271570a_203496583355_100000744318 [0,1,0,1,0,0|2,0,0]=4 2531 B13R2.342 O=C1CCSc2c1cccc2O 271570a_203496583355_100011271337 [0,1,0,1,0,0|2,0,0]=4 2532 B13R2.342 O=C1NCCc2c1cccc2O 271570a_203496583355_100000695023 [0,1,0,1,0,0|2,0,0]=4 2533 B13R2.342 O=c1[nH]ccc2c1cccc2O 271570a_203496583355_100000703947 [0,1,0,1,0,0|2,0,0]=4 2534 B13R2.342 O=c1cc[nH]c2c1cccc2O 271570a_203496583355_100000749886 [0,1,0,1,0,0|1,0,0]=3 2535 B13R2.342 Oc1cccc2c1cccc2O 271570a_203496583355_100010003857 [0,1,0,1,0,0|2,0,0]=4 2536 B13R2.342 Oc1ccnc2c1cccc2O 271570a_203496583355_100000703299 [0,1,0,1,0,0|1,0,1]=4 2537 B13R2.342 Oc1ncnc2c1cccc2O 271570a_203496583355_100010201916 [0,1,0,1,0,0|1,0,1]=4 2538 B13R2.4825 CC1Cc2c(cccc2C1=O)O 271570a_203496583355_200012356775 [0,1,0,1,0,0|2,0,0]=4 2539 B13R2.4825 CN1Cc2c(cccc2C1=O)O 271570a_203496583355_100009817108 [0,1,0,1,0,0|2,0,0]=4 2540 B13R2.4825 O=C1Nc2c(cccc2C1=O)O 271570a_203496583355_100000183292 [0,1,0,1,0,0|0,0,1]=3 2541 B13R2.4857 O=C1NC(=O)c2c1cccc2O 271570a_203496583355_100010194295 [0,1,0,1,0,0|2,0,0]=4 2542 B13R2.4857 O=C1OC(=O)c2c1cccc2O 271570a_203496583355_100010195870 [0,1,0,1,0,0|1,0,0]=3 2543 B13R2.5569 CC(=O)c1cccc2c1OCO2 1458a_100000048783_200000210301 [0,1,0,1,0,0|2,0,0]=4 2544 B13R2.5569 CC(=O)c1cccc2c1[nH]cc2 1458a_100000027293_200000210301 [0,1,0,1,0,0|2,0,0]=4 2545 B13R2.5569 CC(=O)c1cccc2c1[nH]nc2 1458a_100000030479_200000210301 [0,1,0,1,0,0|2,0,0]=4 2546 B13R2.5569 CC(=O)c1cccc2c1cco2 1458a_100000045549_200000210301 [0,1,0,1,0,0|2,0,0]=4 2547 B13R2.5569 CC(=O)c1cccc2c1nco2 1458a_100012186847_200000210301 [0,1,0,1,0,0|1,0,1]=4 2548 B13R2.5569 [13CH3]C(=O)c1cccc2c1OCO2 1458a_100000048783_200025704644 [0,1,0,1,0,0|2,0,0]=4 2549 B13R2.5569 [13CH3]C(=O)c1cccc2c1[nH]cc2 1458a_100000027293_200025704644 [0,1,0,1,0,0|2,0,0]=4 2550 B13R2.5569 [13CH3]C(=O)c1cccc2c1[nH]nc2 1458a_100000030479_200025704644 [0,1,0,1,0,0|2,0,0]=4 2551 B13R2.5569 [13CH3]C(=O)c1cccc2c1cco2 1458a_100000045549_200025704644 [0,1,0,1,0,0|2,0,0]=4 2552 B13R2.5569 [13CH3]C(=O)c1cccc2c1nco2 1458a_100012186847_200025704644 [0,1,0,1,0,0|1,0,1]=4 2553 B13R2.573 C=Cc1cccc2c1COC2=O 271570a_100011290941_100010167076 [0,1,0,1,0,0|2,0,0]=4 2554 B13R2.573 C=Cc1cccc2c1[nH][nH]c2=O 271570a_100011290941_100012199144 [0,1,0,1,0,0|2,0,0]=4 2555 B13R2.573 COc1cccc2c1CCC2=O 34a_100000240044_200000210301 [0,1,0,1,0,0|2,0,0]=4 2556 B13R2.573 COc1cccc2c1CCC2=O 7a_100000240044_200000210301 [0,1,0,1,0,0|2,0,0]=4 2557 B13R2.573 COc1cccc2c1CNC2=O 34a_100000098541_200000210301 [0,1,0,1,0,0|2,0,0]=4 2558 B13R2.573 COc1cccc2c1[nH]nc2O 271570a_203496583355_100010231496 [0,1,0,1,0,0|1,0,0]=3 2559 B13R2.573 COc1nccc2c1[nH]cc2O 271570a_203496583355_100010168644 [0,1,0,1,0,0|2,0,0]=4 2560 B13R2.573 CSc1cccc2c1COC2=O 62a_100010167076_200000210301 [0,1,0,1,0,0|1,1,0]=4 2561 B13R2.573 N#Cc1cccc2c1[nH]nc2O 271570a_203496583355_100010245458 [0,1,0,1,0,0|2,0,0]=4 2562 B13R2.573 [13CH3]Oc1cccc2c1CCC2=O 34a_100000240044_200025704644 [0,1,0,1,0,0|2,0,0]=4 2563 B13R2.573 [13CH3]Oc1cccc2c1CCC2=O 7a_100000240044_200025704644 [0,1,0,1,0,0|2,0,0]=4 2564 B13R2.573 [13CH3]Oc1cccc2c1CNC2=O 34a_100000098541_200025704644 [0,1,0,1,0,0|2,0,0]=4 2565 B13R2.573 [13CH3]Sc1cccc2c1COC2=O 62a_100010167076_200025704644 [0,1,0,1,0,0|1,1,0]=4 2566 B13R2.3742 Cc1cc(c2c(c1)C(=O)CC2)O 271570a_203496583355_200012347971 [0,1,0,1,0,0|2,0,0]=4 2567 B13R2.3742 O=C1CCc2c1cc(cc2O)F 271570a_203496583355_100012355282 [0,1,0,1,0,0|2,0,0]=4 2568 B13R2.5180 Cc1c(ccc2c1COC2=O)O 271570a_203496583355_100010986288 [0,1,0,1,0,0|2,0,0]=4 2569 B13R2.5180 Cc1ccc2c(c1O)CCC2=O 271570a_203496583355_100010133459 [0,1,0,1,0,0|2,0,0]=4 2570 B13R2.5180 O=C1CCc2c1ccc(c2O)F 271570a_203496583355_200010133454 [0,1,0,1,0,0|2,0,0]=4 2571 B13R2.5151 Cc1ccc(c2c1C(=O)CC2)O 271570a_203496583355_100010091368 [0,1,0,1,0,0|2,0,0]=4 2572 B13R2.5151 O=C1CCc2c1c(ccc2O)F 271570a_203496583355_100012347972 [0,1,0,1,0,0|2,0,0]=4 2573 B13R2.5151 O=C1CCc2c1c(ccc2O)O 271570a_203496583355_100009816527 [0,1,0,1,0,0|2,0,0]=4 2574 B13R2.5151 O=C1CCc2c1c(ccc2O)O 271570a_203496583355_200010133748 [0,1,0,1,0,0|2,0,0]=4 2575 B9R1.35 CC(=O)c1cc(cs1)O 271570a_203496583355_100000718618 [1,0,0,0,1,0|2,0,0]=4 2576 B9R1.35 CC(=O)c1ccc([nH]1)O 271570a_203496583355_200010494458 [1,0,0,0,1,0|2,0,0]=4 2577 B9R1.35 CC(=O)c1ccc(o1)O 271570a_203496583355_100000229899 [1,0,0,0,1,0|2,0,0]=4 2578 B9R1.35 CC(=O)c1ccc(s1)O 271570a_203496583355_100000183331 [1,0,0,0,1,0|2,0,0]=4 2579 B9R1.35 CC(=O)c1csc(c1)O 271570a_203496583355_200012344231 [1,0,0,0,1,0|2,0,0]=4 2580 B9R1.35 NC(=O)c1cc(c[nH]1)O 271570a_203496583355_100000229580 [1,0,0,0,1,0|2,0,0]=4 2581 B9R1.35 NC(=O)c1cc(co1)O 271570a_203496583355_200009817131 [1,0,0,0,1,0|2,0,0]=4 2582 B9R1.35 NC(=O)c1cc(cs1)O 271570a_203496583355_100009812991 [1,0,0,0,1,0|2,0,0]=4 2583 B9R1.35 NC(=O)c1ccc(s1)O 271570a_203496583355_100000162267 [1,0,0,0,1,0|2,0,0]=4 2584 B9R1.35 NC(=O)c1csc(c1)O 271570a_203496583355_100000747962 [1,0,0,0,1,0|2,0,0]=4 2585 B11R1.157 CC(=Cc1cccc(c1)O)C 271570a_100102525489_100000211634 [1,0,0,0,0,1|2,0,0]=4 2586 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000070787_100000211773 [1,0,0,0,0,1|2,0,0]=4 2587 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000747190_200000210301 [1,0,0,0,0,1|2,0,0]=4 2588 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100000070787_100000211840 [1,0,0,0,0,1|2,0,0]=4 2589 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100011206899_200000210301 [1,0,0,0,0,1|2,0,0]=4 2590 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000070787_100000181238 [1,0,0,0,0,1|2,0,0]=4 2591 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000749307_200000210301 [1,0,0,0,0,1|2,0,0]=4 2592 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000070787_100000230114 [1,0,0,0,0,1|2,0,0]=4 2593 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000211661_200000210301 [1,0,0,0,0,1|2,0,0]=4 2594 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000070787_100011218688 [1,0,0,0,0,1|2,0,0]=4 2595 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000238430_200000210301 [1,0,0,0,0,1|2,0,0]=4 2596 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000070787_100011660834 [1,0,0,0,0,1|1,0,0]=3 2597 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000745134_200000210301 [1,0,0,0,0,1|1,0,0]=3 2598 B11R1.157 CC(=O)Cc1cccc(c1)O 271570a_203496583355_100000689217 [1,0,0,0,0,1|1,0,0]=3 2599 B11R1.157 CC(=O)Nc1cc(ccn1)O 271570a_203496583355_100012362434 [1,0,0,0,0,1|2,0,0]=4 2600 B11R1.157 CC(=O)Nc1cccc(c1)Br 11a_100000210019_100015343762 [1,0,0,0,0,1|2,0,0]=4 2601 B11R1.157 CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100015343762 [1,0,0,0,0,1|2,0,0]=4 2602 B11R1.157 CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000070787 [1,0,0,0,0,1|2,0,0]=4 2603 B11R1.157 CC(=O)Nc1cccc(c1)Br 527a_100000210019_100103153847 [1,0,0,0,0,1|2,0,0]=4 2604 B11R1.157 CC(=O)Nc1cccc(c1)C 11a_100000188690_100015343762 [1,0,0,0,0,1|2,0,0]=4 2605 B11R1.157 CC(=O)Nc1cccc(c1)C 1626a_100000188690_100015343762 [1,0,0,0,0,1|2,0,0]=4 2606 B11R1.157 CC(=O)Nc1cccc(c1)C 22a_100000188690_100000070787 [1,0,0,0,0,1|2,0,0]=4 2607 B11R1.157 CC(=O)Nc1cccc(c1)C 527a_100000188690_100103153847 [1,0,0,0,0,1|2,0,0]=4 2608 B11R1.157 CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100015343762 [1,0,0,0,0,1|2,0,0]=4 2609 B11R1.157 CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100015343762 [1,0,0,0,0,1|2,0,0]=4 2610 B11R1.157 CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000070787 [1,0,0,0,0,1|2,0,0]=4 2611 B11R1.157 CC(=O)Nc1cccc(c1)F 11a_100000210047_100015343762 [1,0,0,0,0,1|2,0,0]=4 2612 B11R1.157 CC(=O)Nc1cccc(c1)F 1626a_100000210047_100015343762 [1,0,0,0,0,1|2,0,0]=4 2613 B11R1.157 CC(=O)Nc1cccc(c1)F 22a_100000210047_100000070787 [1,0,0,0,0,1|2,0,0]=4 2614 B11R1.157 CC(=O)Nc1cccc(c1)F 527a_100000210047_100103153847 [1,0,0,0,0,1|2,0,0]=4 2615 B11R1.157 CC(=O)Nc1cccc(c1)I 11a_100000211102_100015343762 [1,0,0,0,0,1|2,0,0]=4 2616 B11R1.157 CC(=O)Nc1cccc(c1)I 1626a_100000211102_100015343762 [1,0,0,0,0,1|2,0,0]=4 2617 B11R1.157 CC(=O)Nc1cccc(c1)I 22a_100000211102_100000070787 [1,0,0,0,0,1|2,0,0]=4 2618 B11R1.157 CC(=O)Nc1cccc(c1)I 527a_100000211102_100103153847 [1,0,0,0,0,1|2,0,0]=4 2619 B11R1.157 CC(=O)Nc1cccc(c1)O 1626a_100000210217_100015343762 [1,0,0,0,0,1|1,0,0]=3 2620 B11R1.157 CC(=O)Nc1cccc(c1)O 22a_100000210217_100000070787 [1,0,0,0,0,1|1,0,0]=3 2621 B11R1.157 CC(=O)Nc1cccc(c1)O 271570a_203496583355_100000153616 [1,0,0,0,0,1|1,0,0]=3 2622 B11R1.157 CC(=O)Nc1cccc(c1)O 527a_100000210217_100103153847 [1,0,0,0,0,1|1,0,0]=3 2623 B11R1.157 CC(=O)Nc1cccc(n1)O 271570a_203496583355_200011307899 [1,0,0,0,0,1|2,0,0]=4 2624 B11R1.157 CC(=O)Nc1ccnc(c1)O 271570a_203496583355_100000238608 [1,0,0,0,0,1|2,0,0]=4 2625 B11R1.157 CC(=O)Nc1cncc(c1)O 271570a_203496583355_100012351681 [1,0,0,0,0,1|2,0,0]=4 2626 B11R1.157 CC(=O)Oc1cccc(c1)O 271570a_203496583355_100009811612 [1,0,0,0,0,1|1,0,0]=3 2627 B11R1.157 Cc1cccc(c1)CC(=O)[13CH3] 1458a_100011206899_200025704644 [1,0,0,0,0,1|2,0,0]=4 2628 B11R1.157 NC(=O)Cc1cccc(c1)O 271570a_203496583355_100011586816 [1,0,0,0,0,1|1,0,0]=3 2629 B11R1.157 NC(=O)Nc1cccc(c1)O 271570a_203496583355_100000238923 [1,0,0,0,0,1|1,0,0]=3 2630 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Br 1458a_100000747190_200025704644 [1,0,0,0,0,1|2,0,0]=4 2631 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Cl 1458a_100000749307_200025704644 [1,0,0,0,0,1|2,0,0]=4 2632 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)F 1458a_100000211661_200025704644 [1,0,0,0,0,1|2,0,0]=4 2633 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)I 1458a_100000238430_200025704644 [1,0,0,0,0,1|2,0,0]=4 2634 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)O 1458a_100000745134_200025704644 [1,0,0,0,0,1|1,0,0]=3 2635 B13R1.150 C=C(C)CSc1cccc(c1N)O 62a_100000748629_100011934926 [0,0,0,0,0,2|2,0,0]=4 2636 B13R1.150 C=C(F)CSc1cccc(c1N)O 62a_100000042424_100011934926 [0,0,0,0,0,2|2,0,0]=4 2637 B13R1.150 CC(=O)CCc1cccc(c1O)O 1458a_100009873524_200000210301 [0,0,0,0,0,2|2,0,0]=4 2638 B13R1.150 CC(=O)NCc1cccc(c1F)O 240690a_100025773512_100015343762 [0,0,0,0,0,2|2,0,0]=4 2639 B13R1.150 CC(=O)NCc1cccc(c1F)O 527a_100025773512_100103153847 [0,0,0,0,0,2|2,0,0]=4 2640 B13R1.150 CC(O)C=Cc1cccc(c1N)O 271570a_200011019289_100011934926 [0,0,0,0,0,2|1,0,1]=4 2641 B13R1.150 CC(O)CSc1cccc(c1N)O 62a_100011218427_100011934926 [0,0,0,0,0,2|1,0,1]=4 2642 B13R1.150 C[C@@H](O)CSc1cccc(c1N)O 62a_100009817552_100011934926 [0,0,0,0,0,2|1,0,1]=4 2643 B13R1.150 Cc1c(cccc1NCC(=O)N)O 34a_100011216573_100000187820 [0,0,0,0,0,2|2,0,0]=4 2644 B13R1.150 Cc1c(cccc1NCC(=O)N)O 7a_100011216573_100000187820 [0,0,0,0,0,2|2,0,0]=4 2645 B13R1.150 Cc1c(cccc1NCC(=O)[O-])O 34a_100011216573_100020667443 [0,0,0,0,0,2|1,0,1]=4 2646 B13R1.150 Cc1c(cccc1SCC(=O)N)O 62a_100000747473_100012002258 [0,0,0,0,0,2|2,0,0]=4 2647 B13R1.150 Cc1c(cccc1SCC(=O)N)O 62a_100012002258_100000747473 [0,0,0,0,0,2|2,0,0]=4 2648 B13R1.150 Cc1c(cccc1SCC(=O)[O-])O 62a_100012002258_100020667443 [0,0,0,0,0,2|1,0,1]=4 2649 B13R1.150 Cc1c(cccc1SCC(=O)[O-])O 62a_100020667443_100012002258 [0,0,0,0,0,2|1,0,1]=4 2650 B13R1.150 Cc1cccc(c1N)OCC(=O)N 34a_100000743429_100000187820 [0,0,0,0,0,2|2,0,0]=4 2651 B13R1.150 Cc1cccc(c1N)OCC(=O)N 7a_100000743429_100000187820 [0,0,0,0,0,2|2,0,0]=4 2652 B13R1.150 Cc1cccc(c1N)OCC(=O)[O-] 34a_100000743429_100020667443 [0,0,0,0,0,2|1,0,1]=4 2653 B13R1.150 Cc1cccc(c1N)SCC(=O)N 62a_100000747473_100011834072 [0,0,0,0,0,2|2,0,0]=4 2654 B13R1.150 Cc1cccc(c1N)SCC(=O)N 62a_100011834072_100000747473 [0,0,0,0,0,2|2,0,0]=4 2655 B13R1.150 Cc1cccc(c1N)SCC(=O)[O-] 62a_100011834072_100020667443 [0,0,0,0,0,2|1,0,1]=4 2656 B13R1.150 Cc1cccc(c1N)SCC(=O)[O-] 62a_100020667443_100011834072 [0,0,0,0,0,2|1,0,1]=4 2657 B13R1.150 NC(=O)CNc1cccc(c1Br)O 34a_100012183704_100000187820 [0,0,0,0,0,2|2,0,0]=4 2658 B13R1.150 NC(=O)CNc1cccc(c1Br)O 7a_100012183704_100000187820 [0,0,0,0,0,2|2,0,0]=4 2659 B13R1.150 NC(=O)CNc1cccc(c1Cl)O 34a_100012002038_100000187820 [0,0,0,0,0,2|2,0,0]=4 2660 B13R1.150 NC(=O)CNc1cccc(c1Cl)O 7a_100012002038_100000187820 [0,0,0,0,0,2|2,0,0]=4 2661 B13R1.150 NC(=O)COc1cccc(c1N)Br 34a_100011934926_100000187820 [0,0,0,0,0,2|2,0,0]=4 2662 B13R1.150 NC(=O)COc1cccc(c1N)Br 7a_100011934926_100000187820 [0,0,0,0,0,2|2,0,0]=4 2663 B13R1.150 NC(=O)COc1cccc(c1N)Cl 34a_100012022510_100000187820 [0,0,0,0,0,2|2,0,0]=4 2664 B13R1.150 NC(=O)COc1cccc(c1N)Cl 7a_100012022510_100000187820 [0,0,0,0,0,2|2,0,0]=4 2665 B13R1.150 NC(=O)COc1cccc(c1N)F 34a_100020591140_100000187820 [0,0,0,0,0,2|2,0,0]=4 2666 B13R1.150 NC(=O)COc1cccc(c1N)F 7a_100020591140_100000187820 [0,0,0,0,0,2|2,0,0]=4 2667 B13R1.150 NC(=O)COc1cccc(c1N)I 34a_200000049512_100000187820 [0,0,0,0,0,2|2,0,0]=4 2668 B13R1.150 NC(=O)COc1cccc(c1N)I 7a_200000049512_100000187820 [0,0,0,0,0,2|2,0,0]=4 2669 B13R1.150 NC(=O)COc1cccc(c1N)N 34a_100000033209_100000187820 [0,0,0,0,0,2|2,0,0]=4 2670 B13R1.150 NC(=O)CSc1cccc(c1Br)O 62a_100000747473_100010187914 [0,0,0,0,0,2|2,0,0]=4 2671 B13R1.150 NC(=O)CSc1cccc(c1Br)O 62a_100010187914_100000747473 [0,0,0,0,0,2|2,0,0]=4 2672 B13R1.150 NC(=O)CSc1cccc(c1Cl)O 62a_100000747473_100000049636 [0,0,0,0,0,2|2,0,0]=4 2673 B13R1.150 NC(=O)CSc1cccc(c1F)O 62a_100000747473_100009817021 [0,0,0,0,0,2|2,0,0]=4 2674 B13R1.150 NC(=O)CSc1cccc(c1F)O 62a_100009817021_100000747473 [0,0,0,0,0,2|2,0,0]=4 2675 B13R1.150 NC(=O)CSc1cccc(c1N)Br 62a_100000747473_100010146558 [0,0,0,0,0,2|2,0,0]=4 2676 B13R1.150 NC(=O)CSc1cccc(c1N)Br 62a_100010146558_100000747473 [0,0,0,0,0,2|2,0,0]=4 2677 B13R1.150 NC(=O)CSc1cccc(c1N)Cl 62a_100000747473_100010190421 [0,0,0,0,0,2|2,0,0]=4 2678 B13R1.150 NC(=O)CSc1cccc(c1N)Cl 62a_100010190421_100000747473 [0,0,0,0,0,2|2,0,0]=4 2679 B13R1.150 NC(=O)CSc1cccc(c1N)F 62a_100000042321_100000747473 [0,0,0,0,0,2|2,0,0]=4 2680 B13R1.150 NC(=O)CSc1cccc(c1N)F 62a_100000747473_100000042321 [0,0,0,0,0,2|2,0,0]=4 2681 B13R1.150 NC(=O)CSc1cccc(c1N)N 62a_100015191791_100000747473 [0,0,0,0,0,2|2,0,0]=4 2682 B13R1.150 NC(=O)CSc1cccc(c1N)O 62a_100000747473_100011934926 [0,0,0,0,0,2|1,0,0]=3 2683 B13R1.150 NC(=O)CSc1cccc(c1O)O 62a_100000747473_100009815950 [0,0,0,0,0,2|2,0,0]=4 2684 B13R1.150 Nc1c(cccc1OCC(=O)[O-])Br 34a_100011934926_100020667443 [0,0,0,0,0,2|1,0,1]=4 2685 B13R1.150 Nc1c(cccc1OCC(=O)[O-])Cl 34a_100012022510_100020667443 [0,0,0,0,0,2|1,0,1]=4 2686 B13R1.150 Nc1c(cccc1OCC(=O)[O-])F 34a_100020591140_100020667443 [0,0,0,0,0,2|1,0,1]=4 2687 B13R1.150 Nc1c(cccc1OCC(=O)[O-])I 34a_200000049512_100020667443 [0,0,0,0,0,2|1,0,1]=4 2688 B13R1.150 Nc1c(cccc1SCC(=O)[O-])Br 62a_100010146558_100020667443 [0,0,0,0,0,2|1,0,1]=4 2689 B13R1.150 Nc1c(cccc1SCC(=O)[O-])Br 62a_100020667443_100010146558 [0,0,0,0,0,2|1,0,1]=4 2690 B13R1.150 Nc1c(cccc1SCC(=O)[O-])Cl 62a_100010190421_100020667443 [0,0,0,0,0,2|1,0,1]=4 2691 B13R1.150 Nc1c(cccc1SCC(=O)[O-])Cl 62a_100020667443_100010190421 [0,0,0,0,0,2|1,0,1]=4 2692 B13R1.150 Nc1c(cccc1SCC(=O)[O-])F 62a_100000042321_100020667443 [0,0,0,0,0,2|1,0,1]=4 2693 B13R1.150 Nc1c(cccc1SCC(=O)[O-])F 62a_100020667443_100000042321 [0,0,0,0,0,2|1,0,1]=4 2694 B13R1.150 Nc1c(cccc1SCC(=O)[O-])O 62a_100020667443_100011934926 [0,0,0,0,0,2|0,0,1]=3 2695 B13R1.150 Nc1cccc(c1N)OCC(=O)[O-] 34a_100000033209_100020667443 [0,0,0,0,0,2|1,0,1]=4 2696 B13R1.150 Nc1cccc(c1N)SCC(=O)[O-] 62a_100015191791_100020667443 [0,0,0,0,0,2|1,0,1]=4 2697 B13R1.150 O=C([O-])CNc1cccc(c1Br)O 34a_100012183704_100020667443 [0,0,0,0,0,2|1,0,1]=4 2698 B13R1.150 O=C([O-])CNc1cccc(c1Cl)O 34a_100012002038_100020667443 [0,0,0,0,0,2|1,0,1]=4 2699 B13R1.150 O=C([O-])CSc1cccc(c1Br)O 62a_100010187914_100020667443 [0,0,0,0,0,2|1,0,1]=4 2700 B13R1.150 O=C([O-])CSc1cccc(c1Br)O 62a_100020667443_100010187914 [0,0,0,0,0,2|1,0,1]=4 2701 B13R1.150 O=C([O-])CSc1cccc(c1Cl)O 62a_100020667443_100000049636 [0,0,0,0,0,2|1,0,1]=4 2702 B13R1.150 O=C([O-])CSc1cccc(c1F)O 62a_100009817021_100020667443 [0,0,0,0,0,2|1,0,1]=4 2703 B13R1.150 O=C([O-])CSc1cccc(c1F)O 62a_100020667443_100009817021 [0,0,0,0,0,2|1,0,1]=4 2704 B13R1.150 O=C([O-])CSc1cccc(c1O)O 62a_100020667443_100009815950 [0,0,0,0,0,2|1,0,1]=4 2705 B13R1.150 [13CH3]C(=O)CCc1cccc(c1O)O 1458a_100009873524_200025704644 [0,0,0,0,0,2|2,0,0]=4