0 B12R1.511 C=C(C)c1cc(cc(c1O)Br)F 271570a_100000694244_200013085147 [0,0,0,0,0,0|2,2,0]=4 1 B12R1.511 C=C(C)c1cc(cc(c1O)C)C 271570a_100000694244_100011934984 [0,0,0,0,0,0|4,0,0]=4 2 B12R1.511 C=C(C)c1cc(cc(c1O)C)Cl 271570a_100000694244_100012343667 [0,0,0,0,0,0|3,1,0]=4 3 B12R1.511 C=C(C)c1cc(cc(c1O)C)N 271570a_100000694244_100010064301 [0,0,0,0,0,0|4,0,0]=4 4 B12R1.511 C=C(C)c1cc(cc(c1O)Cl)Cl 271570a_100000694244_200012339341 [0,0,0,0,0,0|2,2,0]=4 5 B12R1.511 C=C(C)c1cc(cc(c1O)F)Br 271570a_100000694244_100013354677 [0,0,0,0,0,0|2,2,0]=4 6 B12R1.511 C=C(C)c1cc(cc(c1O)F)C 271570a_100000694244_200135191068 [0,0,0,0,0,0|3,1,0]=4 7 B12R1.511 C=C(C)c1cc(cc(c1O)F)F 271570a_100000694244_100000688693 [0,0,0,0,0,0|2,2,0]=4 8 B12R1.511 C=C(C)c1cc(cc(c1O)N)F 271570a_100000694244_200011217456 [0,0,0,0,0,0|3,1,0]=4 9 B12R1.511 CC(=O)c1cc(cc(c1Br)Br)C 1458a_200012920551_200000210301 [0,0,0,0,0,0|3,1,0]=4 10 B12R1.511 CC(=O)c1cc(cc(c1Br)C)C 1458a_200000701928_200000210301 [0,0,0,0,0,0|4,0,0]=4 11 B12R1.511 CC(=O)c1cc(cc(c1Br)F)F 1458a_100010209673_200000210301 [0,0,0,0,0,0|2,2,0]=4 12 B12R1.511 CC(=O)c1cc(cc(c1C)Br)Br 1458a_100012356187_200000210301 [0,0,0,0,0,0|2,2,0]=4 13 B12R1.511 CC(=O)c1cc(cc(c1C)Br)F 1458a_100012347597_200000210301 [0,0,0,0,0,0|2,2,0]=4 14 B12R1.511 CC(=O)c1cc(cc(c1C)C)Br 1458a_100012920495_200000210301 [0,0,0,0,0,0|3,1,0]=4 15 B12R1.511 CC(=O)c1cc(cc(c1C)Cl)Br 1458a_100012921640_200000210301 [0,0,0,0,0,0|2,2,0]=4 16 B12R1.511 CC(=O)c1cc(cc(c1C)Cl)F 1458a_100012177191_200000210301 [0,0,0,0,0,0|2,2,0]=4 17 B12R1.511 CC(=O)c1cc(cc(c1C)F)Br 1458a_100010768523_200000210301 [0,0,0,0,0,0|2,2,0]=4 18 B12R1.511 CC(=O)c1cc(cc(c1C)O)Br 1458a_100011101721_200000210301 [0,0,0,0,0,0|3,1,0]=4 19 B12R1.511 CC(=O)c1cc(cc(c1Cl)Br)Cl 1458a_200012920481_200000210301 [0,0,0,0,0,0|2,2,0]=4 20 B12R1.511 CC(=O)c1cc(cc(c1Cl)Br)F 1458a_100011105905_200000210301 [0,0,0,0,0,0|2,2,0]=4 21 B12R1.511 CC(=O)c1cc(cc(c1Cl)C)F 1458a_200010768536_200000210301 [0,0,0,0,0,0|3,1,0]=4 22 B12R1.511 CC(=O)c1cc(cc(c1Cl)Cl)Cl 1458a_100011215521_200000210301 [0,0,0,0,0,0|2,2,0]=4 23 B12R1.511 CC(=O)c1cc(cc(c1Cl)Cl)F 1458a_200010244589_200000210301 [0,0,0,0,0,0|2,2,0]=4 24 B12R1.511 CC(=O)c1cc(cc(c1Cl)F)Cl 1458a_200012352169_200000210301 [0,0,0,0,0,0|2,2,0]=4 25 B12R1.511 CC(=O)c1cc(cc(c1Cl)F)F 1458a_100009888511_200000210301 [0,0,0,0,0,0|2,2,0]=4 26 B12R1.511 CC(=O)c1cc(cc(c1F)Br)C 1458a_100009996753_200000210301 [0,0,0,0,0,0|3,1,0]=4 27 B12R1.511 CC(=O)c1cc(cc(c1F)Br)Cl 1458a_100000720295_200000210301 [0,0,0,0,0,0|2,2,0]=4 28 B12R1.511 CC(=O)c1cc(cc(c1F)Br)F 1458a_100012920464_200000210301 [0,0,0,0,0,0|2,2,0]=4 29 B12R1.511 CC(=O)c1cc(cc(c1F)C)Br 1458a_100012928937_200000210301 [0,0,0,0,0,0|3,1,0]=4 30 B12R1.511 CC(=O)c1cc(cc(c1F)Cl)Br 1458a_100012920557_200000210301 [0,0,0,0,0,0|2,2,0]=4 31 B12R1.511 CC(=O)c1cc(cc(c1F)Cl)I 1458a_100012920558_200000210301 [0,0,0,0,0,0|2,1,0]=3 32 B12R1.511 CC(=O)c1cc(cc(c1F)F)Br 1458a_100012349847_200000210301 [0,0,0,0,0,0|2,2,0]=4 33 B12R1.511 CC(=O)c1cc(cc(c1F)F)C 1458a_100000094381_200000210301 [0,0,0,0,0,0|3,1,0]=4 34 B12R1.511 CC(=O)c1cc(cc(c1F)F)F 1458a_100011217470_200000210301 [0,0,0,0,0,0|2,2,0]=4 35 B12R1.511 CC(=O)c1cc(cc(c1F)F)I 1458a_100012344719_200000210301 [0,0,0,0,0,0|2,1,0]=3 36 B12R1.511 CC(=O)c1cc(cc(c1I)I)I 1458a_100000211575_200000210301 [0,0,0,0,0,0|2,0,0]=2 37 B12R1.511 CC(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_200000210301 [0,0,0,0,0,0|1,2,0]=3 38 B12R1.511 CC(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_200000210301 [0,0,0,0,0,0|1,2,0]=3 39 B12R1.511 CC(=O)c1cc(cc(c1O)C)Br 1458a_100011825902_200000210301 [0,0,0,0,0,0|2,1,0]=3 40 B12R1.511 CC(=O)c1cc(cc(c1O)C)Cl 1458a_100011255218_200000210301 [0,0,0,0,0,0|2,1,0]=3 41 B12R1.511 CC(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_200000210301 [0,0,0,0,0,0|1,2,0]=3 42 B12R1.511 CC(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_200000210301 [0,0,0,0,0,0|1,2,0]=3 43 B12R1.511 CC(=O)c1cc(cc(c1O)F)F 1458a_100011255242_200000210301 [0,0,0,0,0,0|1,2,0]=3 44 B12R1.511 CC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_200000210301 [0,0,0,0,0,0|1,0,0]=1 45 B12R1.511 CC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_200000210301 [0,0,0,0,0,0|2,1,0]=3 46 B12R1.511 CC(=O)c1cc(cc(c1O)O)C 271570a_203496583355_100011659362 [0,0,0,0,0,0|3,0,0]=3 47 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)Br 1458a_100012356187_200025704644 [0,0,0,0,0,0|2,2,0]=4 48 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)Cl 1458a_100012921640_200025704644 [0,0,0,0,0,0|2,2,0]=4 49 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)F 1458a_100010768523_200025704644 [0,0,0,0,0,0|2,2,0]=4 50 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)O 1458a_100011101721_200025704644 [0,0,0,0,0,0|3,1,0]=4 51 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])F)Br 1458a_100012347597_200025704644 [0,0,0,0,0,0|2,2,0]=4 52 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])F)Cl 1458a_100012177191_200025704644 [0,0,0,0,0,0|2,2,0]=4 53 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])Br)Br 1458a_200012920551_200025704644 [0,0,0,0,0,0|3,1,0]=4 54 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])Br)C 1458a_200000701928_200025704644 [0,0,0,0,0,0|4,0,0]=4 55 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])F)Br 1458a_100009996753_200025704644 [0,0,0,0,0,0|3,1,0]=4 56 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])F)F 1458a_100000094381_200025704644 [0,0,0,0,0,0|3,1,0]=4 57 B12R1.511 Cc1cc(cc(c1C)C(=O)[13CH3])Br 1458a_100012920495_200025704644 [0,0,0,0,0,0|3,1,0]=4 58 B12R1.511 Cc1cc(cc(c1Cl)C(=O)[13CH3])F 1458a_200010768536_200025704644 [0,0,0,0,0,0|3,1,0]=4 59 B12R1.511 Cc1cc(cc(c1F)C(=O)[13CH3])Br 1458a_100012928937_200025704644 [0,0,0,0,0,0|3,1,0]=4 60 B12R1.511 Cc1cc(cc(c1O)C(=O)[13CH3])Br 1458a_100011825902_200025704644 [0,0,0,0,0,0|2,1,0]=3 61 B12R1.511 Cc1cc(cc(c1O)C(=O)[13CH3])Cl 1458a_100011255218_200025704644 [0,0,0,0,0,0|2,1,0]=3 62 B12R1.511 NC(=O)c1cc(cc(c1O)O)F 271570a_203496583355_200135271384 [0,0,0,0,0,0|2,1,0]=3 63 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Br)F)F 1458a_100010209673_200025704644 [0,0,0,0,0,0|2,2,0]=4 64 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Br)Cl 1458a_200012920481_200025704644 [0,0,0,0,0,0|2,2,0]=4 65 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Br)F 1458a_100011105905_200025704644 [0,0,0,0,0,0|2,2,0]=4 66 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Cl)Cl 1458a_100011215521_200025704644 [0,0,0,0,0,0|2,2,0]=4 67 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Cl)F 1458a_200010244589_200025704644 [0,0,0,0,0,0|2,2,0]=4 68 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)F)Cl 1458a_200012352169_200025704644 [0,0,0,0,0,0|2,2,0]=4 69 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)F)F 1458a_100009888511_200025704644 [0,0,0,0,0,0|2,2,0]=4 70 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Br)Cl 1458a_100000720295_200025704644 [0,0,0,0,0,0|2,2,0]=4 71 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Br)F 1458a_100012920464_200025704644 [0,0,0,0,0,0|2,2,0]=4 72 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Cl)Br 1458a_100012920557_200025704644 [0,0,0,0,0,0|2,2,0]=4 73 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Cl)I 1458a_100012920558_200025704644 [0,0,0,0,0,0|2,1,0]=3 74 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)F)Br 1458a_100012349847_200025704644 [0,0,0,0,0,0|2,2,0]=4 75 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)F)F 1458a_100011217470_200025704644 [0,0,0,0,0,0|2,2,0]=4 76 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)F)I 1458a_100012344719_200025704644 [0,0,0,0,0,0|2,1,0]=3 77 B12R1.511 [13CH3]C(=O)c1cc(cc(c1I)I)I 1458a_100000211575_200025704644 [0,0,0,0,0,0|2,0,0]=2 78 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_200025704644 [0,0,0,0,0,0|1,2,0]=3 79 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_200025704644 [0,0,0,0,0,0|1,2,0]=3 80 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_200025704644 [0,0,0,0,0,0|1,2,0]=3 81 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_200025704644 [0,0,0,0,0,0|1,2,0]=3 82 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)F)F 1458a_100011255242_200025704644 [0,0,0,0,0,0|1,2,0]=3 83 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)I)I 1458a_100000748652_200025704644 [0,0,0,0,0,0|1,0,0]=1 84 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_200025704644 [0,0,0,0,0,0|2,1,0]=3 85 B11R1.8 C=Cc1cc(cc(c1O)Br)F 271570a_100011290941_200013085147 [1,0,0,0,0,0|1,2,0]=4 86 B11R1.8 C=Cc1cc(cc(c1O)C)C 271570a_100011290941_100011934984 [1,0,0,0,0,0|3,0,0]=4 87 B11R1.8 C=Cc1cc(cc(c1O)C)Cl 271570a_100011290941_100012343667 [1,0,0,0,0,0|2,1,0]=4 88 B11R1.8 C=Cc1cc(cc(c1O)C)N 271570a_100011290941_100010064301 [1,0,0,0,0,0|3,0,0]=4 89 B11R1.8 C=Cc1cc(cc(c1O)Cl)Cl 271570a_100011290941_200012339341 [1,0,0,0,0,0|1,2,0]=4 90 B11R1.8 C=Cc1cc(cc(c1O)F)Br 271570a_100011290941_100013354677 [1,0,0,0,0,0|1,2,0]=4 91 B11R1.8 C=Cc1cc(cc(c1O)F)C 271570a_100011290941_200135191068 [1,0,0,0,0,0|2,1,0]=4 92 B11R1.8 C=Cc1cc(cc(c1O)F)F 271570a_100011290941_100000688693 [1,0,0,0,0,0|1,2,0]=4 93 B11R1.8 C=Cc1cc(cc(c1O)N)F 271570a_100011290941_200011217456 [1,0,0,0,0,0|2,1,0]=4 94 B11R1.8 Cc1cc(c(c(c1)C=O)F)O 271570a_203496583355_100010161323 [1,0,0,0,0,0|3,0,0]=4 95 B11R1.8 Cc1cc(c(c(c1)C=O)O)O 271570a_203496583355_100000698970 [1,0,0,0,0,0|2,0,0]=3 96 B11R1.8 Cc1cc(cc(c1F)C=O)O 271570a_203496583355_100010235757 [1,0,0,0,0,0|3,0,0]=4 97 B11R1.8 O=Cc1cc(cc(c1F)F)O 271570a_203496583355_100009814787 [1,0,0,0,0,0|2,1,0]=4 98 B11R1.8 O=Cc1cc(cc(c1F)O)F 271570a_203496583355_100010890130 [1,0,0,0,0,0|2,1,0]=4 99 B11R1.8 O=Cc1cc(cc(c1O)F)O 271570a_203496583355_100011217654 [1,0,0,0,0,0|1,1,0]=3 100 B11R1.8 O=Cc1cc(cc(c1O)O)F 271570a_203496583355_100011659637 [1,0,0,0,0,0|1,1,0]=3 101 B11R1.74 CC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200000210301 [1,0,0,0,0,0|1,2,0]=4 102 B11R1.74 CC(=O)c1cc(cc(c1)Br)C 1458a_100000760426_200000210301 [1,0,0,0,0,0|2,1,0]=4 103 B11R1.74 CC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200000210301 [1,0,0,0,0,0|1,2,0]=4 104 B11R1.74 CC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200000210301 [1,0,0,0,0,0|1,2,0]=4 105 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200000210301 [1,0,0,0,0,0|2,1,0]=4 106 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 271570a_203496583355_100010005435 [1,0,0,0,0,0|2,1,0]=4 107 B11R1.74 CC(=O)c1cc(cc(c1)C)C 1458a_100000210874_200000210301 [1,0,0,0,0,0|3,0,0]=4 108 B11R1.74 CC(=O)c1cc(cc(c1)Cl)C 1458a_100000684526_200000210301 [1,0,0,0,0,0|2,1,0]=4 109 B11R1.74 CC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200000210301 [1,0,0,0,0,0|1,2,0]=4 110 B11R1.74 CC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200000210301 [1,0,0,0,0,0|1,2,0]=4 111 B11R1.74 CC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200000210301 [1,0,0,0,0,0|2,1,0]=4 112 B11R1.74 CC(=O)c1cc(cc(c1)F)C 1458a_100000763163_200000210301 [1,0,0,0,0,0|2,1,0]=4 113 B11R1.74 CC(=O)c1cc(cc(c1)F)F 1458a_100000211655_200000210301 [1,0,0,0,0,0|1,2,0]=4 114 B11R1.74 CC(=O)c1cc(cc(c1)F)O 1458a_100012017291_200000210301 [1,0,0,0,0,0|2,1,0]=4 115 B11R1.74 CC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100012361402 [1,0,0,0,0,0|2,1,0]=4 116 B11R1.74 CC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200000210301 [1,0,0,0,0,0|1,1,0]=3 117 B11R1.74 CC(=O)c1cc(cc(c1)I)C 1458a_100000729426_200000210301 [1,0,0,0,0,0|2,0,0]=3 118 B11R1.74 CC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200000210301 [1,0,0,0,0,0|1,1,0]=3 119 B11R1.74 CC(=O)c1cc(cc(c1)I)F 1458a_100012047268_200000210301 [1,0,0,0,0,0|1,1,0]=3 120 B11R1.74 CC(=O)c1cc(cc(c1)I)I 1458a_100011204819_200000210301 [1,0,0,0,0,0|1,0,0]=2 121 B11R1.74 CC(=O)c1cc(cc(c1)O)C 1458a_100000094094_200000210301 [1,0,0,0,0,0|3,0,0]=4 122 B11R1.74 CC(=O)c1cc(cc(c1)O)C 271570a_203496583355_100000694479 [1,0,0,0,0,0|3,0,0]=4 123 B11R1.74 Cc1cc(cc(c1)C(=O)N)O 271570a_203496583355_200012348365 [1,0,0,0,0,0|3,0,0]=4 124 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Br 1458a_100000760426_200025704644 [1,0,0,0,0,0|2,1,0]=4 125 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])C 1458a_100000210874_200025704644 [1,0,0,0,0,0|3,0,0]=4 126 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Cl 1458a_100000684526_200025704644 [1,0,0,0,0,0|2,1,0]=4 127 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])F 1458a_100000763163_200025704644 [1,0,0,0,0,0|2,1,0]=4 128 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])I 1458a_100000729426_200025704644 [1,0,0,0,0,0|2,0,0]=3 129 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])O 1458a_100000094094_200025704644 [1,0,0,0,0,0|3,0,0]=4 130 B11R1.74 NC(=O)c1cc(cc(c1)F)O 271570a_203496583355_200011280034 [1,0,0,0,0,0|2,1,0]=4 131 B11R1.74 NC(=O)c1cc(cc(c1)O)O 271570a_203496583355_100010084318 [1,0,0,0,0,0|3,0,0]=4 132 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200025704644 [1,0,0,0,0,0|1,2,0]=4 133 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200025704644 [1,0,0,0,0,0|1,2,0]=4 134 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200025704644 [1,0,0,0,0,0|1,2,0]=4 135 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200025704644 [1,0,0,0,0,0|2,1,0]=4 136 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200025704644 [1,0,0,0,0,0|1,2,0]=4 137 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200025704644 [1,0,0,0,0,0|1,2,0]=4 138 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200025704644 [1,0,0,0,0,0|2,1,0]=4 139 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)F 1458a_100000211655_200025704644 [1,0,0,0,0,0|1,2,0]=4 140 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)O 1458a_100012017291_200025704644 [1,0,0,0,0,0|2,1,0]=4 141 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200025704644 [1,0,0,0,0,0|1,1,0]=3 142 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200025704644 [1,0,0,0,0,0|1,1,0]=3 143 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)F 1458a_100012047268_200025704644 [1,0,0,0,0,0|1,1,0]=3 144 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)I 1458a_100011204819_200025704644 [1,0,0,0,0,0|1,0,0]=2 145 B11R1.159 C=C(C)c1cccc(c1O)Br 271570a_100000694244_100010084509 [1,0,0,0,0,0|2,1,0]=4 146 B11R1.159 C=C(C)c1cccc(c1O)C 271570a_100000694244_100009817157 [1,0,0,0,0,0|3,0,0]=4 147 B11R1.159 C=C(C)c1cccc(c1O)Cl 271570a_100000694244_100010202889 [1,0,0,0,0,0|2,1,0]=4 148 B11R1.159 C=C(C)c1cccc(c1O)F 271570a_100000694244_100009813666 [1,0,0,0,0,0|2,1,0]=4 149 B11R1.159 C=C(C)c1cccc(c1O)N 271570a_100000694244_100011934915 [1,0,0,0,0,0|3,0,0]=4 150 B11R1.159 C=C(C)c1cccc(c1O)O 271570a_100000694244_100009815950 [1,0,0,0,0,0|3,0,0]=4 151 B11R1.159 CC(=O)c1cccc(c1Br)Br 1458a_100012360534_200000210301 [1,0,0,0,0,0|2,1,0]=4 152 B11R1.159 CC(=O)c1cccc(c1Br)C 1458a_100000692419_200000210301 [1,0,0,0,0,0|3,0,0]=4 153 B11R1.159 CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_200000210301 [1,0,0,0,0,0|2,1,0]=4 154 B11R1.159 CC(=O)c1cccc(c1Br)F 1458a_100011217547_200000210301 [1,0,0,0,0,0|2,1,0]=4 155 B11R1.159 CC(=O)c1cccc(c1Br)I 1458a_100010232522_200000210301 [1,0,0,0,0,0|2,0,0]=3 156 B11R1.159 CC(=O)c1cccc(c1Br)O 1458a_100010230362_200000210301 [1,0,0,0,0,0|3,0,0]=4 157 B11R1.159 CC(=O)c1cccc(c1C)Br 1458a_100000760464_200000210301 [1,0,0,0,0,0|2,1,0]=4 158 B11R1.159 CC(=O)c1cccc(c1C)C 1458a_100000183679_200000210301 [1,0,0,0,0,0|3,0,0]=4 159 B11R1.159 CC(=O)c1cccc(c1C)Cl 1458a_100000690184_200000210301 [1,0,0,0,0,0|2,1,0]=4 160 B11R1.159 CC(=O)c1cccc(c1C)F 1458a_100011218272_200000210301 [1,0,0,0,0,0|2,1,0]=4 161 B11R1.159 CC(=O)c1cccc(c1C)I 1458a_100000751865_200000210301 [1,0,0,0,0,0|2,0,0]=3 162 B11R1.159 CC(=O)c1cccc(c1C)O 1458a_100000766327_200000210301 [1,0,0,0,0,0|3,0,0]=4 163 B11R1.159 CC(=O)c1cccc(c1C)O 271570a_203496583355_100012706834 [1,0,0,0,0,0|3,0,0]=4 164 B11R1.159 CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_200000210301 [1,0,0,0,0,0|2,1,0]=4 165 B11R1.159 CC(=O)c1cccc(c1Cl)C 1458a_100000693142_200000210301 [1,0,0,0,0,0|3,0,0]=4 166 B11R1.159 CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200000210301 [1,0,0,0,0,0|2,1,0]=4 167 B11R1.159 CC(=O)c1cccc(c1Cl)F 1458a_100000759904_200000210301 [1,0,0,0,0,0|2,1,0]=4 168 B11R1.159 CC(=O)c1cccc(c1Cl)I 1458a_100010176783_200000210301 [1,0,0,0,0,0|2,0,0]=3 169 B11R1.159 CC(=O)c1cccc(c1Cl)O 1458a_100000092362_200000210301 [1,0,0,0,0,0|3,0,0]=4 170 B11R1.159 CC(=O)c1cccc(c1F)Br 1458a_100000756403_200000210301 [1,0,0,0,0,0|2,1,0]=4 171 B11R1.159 CC(=O)c1cccc(c1F)C 1458a_100000766181_200000210301 [1,0,0,0,0,0|3,0,0]=4 172 B11R1.159 CC(=O)c1cccc(c1F)Cl 1458a_100000688816_200000210301 [1,0,0,0,0,0|2,1,0]=4 173 B11R1.159 CC(=O)c1cccc(c1F)F 1458a_100000748134_200000210301 [1,0,0,0,0,0|2,1,0]=4 174 B11R1.159 CC(=O)c1cccc(c1F)I 1458a_100010185205_200000210301 [1,0,0,0,0,0|2,0,0]=3 175 B11R1.159 CC(=O)c1cccc(c1F)O 1458a_100000037433_200000210301 [1,0,0,0,0,0|3,0,0]=4 176 B11R1.159 CC(=O)c1cccc(c1F)O 271570a_203496583355_100012355707 [1,0,0,0,0,0|3,0,0]=4 177 B11R1.159 CC(=O)c1cccc(c1I)Br 1458a_100000688019_200000210301 [1,0,0,0,0,0|2,1,0]=4 178 B11R1.159 CC(=O)c1cccc(c1I)C 1458a_100000739377_200000210301 [1,0,0,0,0,0|3,0,0]=4 179 B11R1.159 CC(=O)c1cccc(c1I)Cl 1458a_100010176784_200000210301 [1,0,0,0,0,0|2,1,0]=4 180 B11R1.159 CC(=O)c1cccc(c1I)F 1458a_100000690930_200000210301 [1,0,0,0,0,0|2,1,0]=4 181 B11R1.159 CC(=O)c1cccc(c1I)O 1458a_100010084636_200000210301 [1,0,0,0,0,0|3,0,0]=4 182 B11R1.159 CC(=O)c1cccc(c1O)Br 1458a_100000752940_200000210301 [1,0,0,0,0,0|1,1,0]=3 183 B11R1.159 CC(=O)c1cccc(c1O)C 1458a_100000183896_200000210301 [1,0,0,0,0,0|2,0,0]=3 184 B11R1.159 CC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000210301 [1,0,0,0,0,0|1,1,0]=3 185 B11R1.159 CC(=O)c1cccc(c1O)F 1458a_100011217230_200000210301 [1,0,0,0,0,0|1,1,0]=3 186 B11R1.159 CC(=O)c1cccc(c1O)F 271570a_203496583355_100012362612 [1,0,0,0,0,0|1,1,0]=3 187 B11R1.159 CC(=O)c1cccc(c1O)O 1458a_100000690420_200000210301 [1,0,0,0,0,0|2,0,0]=3 188 B11R1.159 CC(=O)c1cccc(c1O)O 271570a_203496583355_100009815558 [1,0,0,0,0,0|2,0,0]=3 189 B11R1.159 Cc1c(cccc1C(=O)N)O 271570a_203496583355_200012298201 [1,0,0,0,0,0|3,0,0]=4 190 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Br 1458a_100000760464_200025704644 [1,0,0,0,0,0|2,1,0]=4 191 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Cl 1458a_100000690184_200025704644 [1,0,0,0,0,0|2,1,0]=4 192 B11R1.159 Cc1c(cccc1C(=O)[13CH3])F 1458a_100011218272_200025704644 [1,0,0,0,0,0|2,1,0]=4 193 B11R1.159 Cc1c(cccc1C(=O)[13CH3])I 1458a_100000751865_200025704644 [1,0,0,0,0,0|2,0,0]=3 194 B11R1.159 Cc1c(cccc1C(=O)[13CH3])O 1458a_100000766327_200025704644 [1,0,0,0,0,0|3,0,0]=4 195 B11R1.159 Cc1cccc(c1Br)C(=O)[13CH3] 1458a_100000692419_200025704644 [1,0,0,0,0,0|3,0,0]=4 196 B11R1.159 Cc1cccc(c1C)C(=O)[13CH3] 1458a_100000183679_200025704644 [1,0,0,0,0,0|3,0,0]=4 197 B11R1.159 Cc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000693142_200025704644 [1,0,0,0,0,0|3,0,0]=4 198 B11R1.159 Cc1cccc(c1F)C(=O)[13CH3] 1458a_100000766181_200025704644 [1,0,0,0,0,0|3,0,0]=4 199 B11R1.159 Cc1cccc(c1I)C(=O)[13CH3] 1458a_100000739377_200025704644 [1,0,0,0,0,0|3,0,0]=4 200 B11R1.159 Cc1cccc(c1O)C(=O)N 271570a_203496583355_200011409216 [1,0,0,0,0,0|2,0,0]=3 201 B11R1.159 Cc1cccc(c1O)C(=O)[13CH3] 1458a_100000183896_200025704644 [1,0,0,0,0,0|2,0,0]=3 202 B11R1.159 NC(=O)c1cccc(c1F)O 271570a_203496583355_100012351131 [1,0,0,0,0,0|3,0,0]=4 203 B11R1.159 NC(=O)c1cccc(c1N)O 271570a_203496583355_100010144993 [1,0,0,0,0,0|3,0,0]=4 204 B11R1.159 NC(=O)c1cccc(c1O)F 271570a_203496583355_200012351544 [1,0,0,0,0,0|1,1,0]=3 205 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Br 1458a_100012360534_200025704644 [1,0,0,0,0,0|2,1,0]=4 206 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Cl 1458a_100012339722_200025704644 [1,0,0,0,0,0|2,1,0]=4 207 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)F 1458a_100011217547_200025704644 [1,0,0,0,0,0|2,1,0]=4 208 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)I 1458a_100010232522_200025704644 [1,0,0,0,0,0|2,0,0]=3 209 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)O 1458a_100010230362_200025704644 [1,0,0,0,0,0|3,0,0]=4 210 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Br 1458a_100000760540_200025704644 [1,0,0,0,0,0|2,1,0]=4 211 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200025704644 [1,0,0,0,0,0|2,1,0]=4 212 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)F 1458a_100000759904_200025704644 [1,0,0,0,0,0|2,1,0]=4 213 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)I 1458a_100010176783_200025704644 [1,0,0,0,0,0|2,0,0]=3 214 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)O 1458a_100000092362_200025704644 [1,0,0,0,0,0|3,0,0]=4 215 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Br 1458a_100000756403_200025704644 [1,0,0,0,0,0|2,1,0]=4 216 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Cl 1458a_100000688816_200025704644 [1,0,0,0,0,0|2,1,0]=4 217 B11R1.159 [13CH3]C(=O)c1cccc(c1F)F 1458a_100000748134_200025704644 [1,0,0,0,0,0|2,1,0]=4 218 B11R1.159 [13CH3]C(=O)c1cccc(c1F)I 1458a_100010185205_200025704644 [1,0,0,0,0,0|2,0,0]=3 219 B11R1.159 [13CH3]C(=O)c1cccc(c1F)O 1458a_100000037433_200025704644 [1,0,0,0,0,0|3,0,0]=4 220 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Br 1458a_100000688019_200025704644 [1,0,0,0,0,0|2,1,0]=4 221 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Cl 1458a_100010176784_200025704644 [1,0,0,0,0,0|2,1,0]=4 222 B11R1.159 [13CH3]C(=O)c1cccc(c1I)F 1458a_100000690930_200025704644 [1,0,0,0,0,0|2,1,0]=4 223 B11R1.159 [13CH3]C(=O)c1cccc(c1I)O 1458a_100010084636_200025704644 [1,0,0,0,0,0|3,0,0]=4 224 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Br 1458a_100000752940_200025704644 [1,0,0,0,0,0|1,1,0]=3 225 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Cl 1458a_100000742801_200025704644 [1,0,0,0,0,0|1,1,0]=3 226 B11R1.159 [13CH3]C(=O)c1cccc(c1O)F 1458a_100011217230_200025704644 [1,0,0,0,0,0|1,1,0]=3 227 B11R1.159 [13CH3]C(=O)c1cccc(c1O)O 1458a_100000690420_200025704644 [1,0,0,0,0,0|2,0,0]=3 228 B11R1.167 C=C(C)c1cc(ccc1O)Br 271570a_100000694244_100012355227 [1,0,0,0,0,0|2,1,0]=4 229 B11R1.167 C=C(C)c1cc(ccc1O)C 271570a_100000694244_100000765521 [1,0,0,0,0,0|3,0,0]=4 230 B11R1.167 C=C(C)c1cc(ccc1O)Cl 271570a_100000694244_100011356953 [1,0,0,0,0,0|2,1,0]=4 231 B11R1.167 C=C(C)c1cc(ccc1O)F 271570a_100000694244_100000211999 [1,0,0,0,0,0|2,1,0]=4 232 B11R1.167 C=C(C)c1cc(ccc1O)N 271570a_100000694244_100011534360 [1,0,0,0,0,0|3,0,0]=4 233 B11R1.167 C=C(C)c1cc(ccc1O)O 271570a_100000694244_100009813629 [1,0,0,0,0,0|3,0,0]=4 234 B11R1.167 CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_200000210301 [1,0,0,0,0,0|2,1,0]=4 235 B11R1.167 CC(=O)c1cc(ccc1Br)C 1458a_100000689033_200000210301 [1,0,0,0,0,0|3,0,0]=4 236 B11R1.167 CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200000210301 [1,0,0,0,0,0|2,1,0]=4 237 B11R1.167 CC(=O)c1cc(ccc1Br)F 1458a_100000212315_200000210301 [1,0,0,0,0,0|2,1,0]=4 238 B11R1.167 CC(=O)c1cc(ccc1Br)I 1458a_100000698340_200000210301 [1,0,0,0,0,0|2,0,0]=3 239 B11R1.167 CC(=O)c1cc(ccc1Br)O 1458a_100012352043_200000210301 [1,0,0,0,0,0|3,0,0]=4 240 B11R1.167 CC(=O)c1cc(ccc1C)Br 1458a_100000759961_200000210301 [1,0,0,0,0,0|2,1,0]=4 241 B11R1.167 CC(=O)c1cc(ccc1C)C 1458a_100000195421_200000210301 [1,0,0,0,0,0|3,0,0]=4 242 B11R1.167 CC(=O)c1cc(ccc1C)Cl 1458a_100000692595_200000210301 [1,0,0,0,0,0|2,1,0]=4 243 B11R1.167 CC(=O)c1cc(ccc1C)F 1458a_100000240043_200000210301 [1,0,0,0,0,0|2,1,0]=4 244 B11R1.167 CC(=O)c1cc(ccc1C)I 1458a_100000688012_200000210301 [1,0,0,0,0,0|2,0,0]=3 245 B11R1.167 CC(=O)c1cc(ccc1C)O 1458a_100000687834_200000210301 [1,0,0,0,0,0|3,0,0]=4 246 B11R1.167 CC(=O)c1cc(ccc1C)O 271570a_203496583355_100012706819 [1,0,0,0,0,0|3,0,0]=4 247 B11R1.167 CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200000210301 [1,0,0,0,0,0|2,1,0]=4 248 B11R1.167 CC(=O)c1cc(ccc1Cl)C 1458a_100011290873_200000210301 [1,0,0,0,0,0|3,0,0]=4 249 B11R1.167 CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200000210301 [1,0,0,0,0,0|2,1,0]=4 250 B11R1.167 CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_200000210301 [1,0,0,0,0,0|2,1,0]=4 251 B11R1.167 CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_200000210301 [1,0,0,0,0,0|2,0,0]=3 252 B11R1.167 CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_200000210301 [1,0,0,0,0,0|3,0,0]=4 253 B11R1.167 CC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100010712560 [1,0,0,0,0,0|3,0,0]=4 254 B11R1.167 CC(=O)c1cc(ccc1F)Br 1458a_100000212322_200000210301 [1,0,0,0,0,0|2,1,0]=4 255 B11R1.167 CC(=O)c1cc(ccc1F)C 1458a_100000749327_200000210301 [1,0,0,0,0,0|3,0,0]=4 256 B11R1.167 CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_200000210301 [1,0,0,0,0,0|2,1,0]=4 257 B11R1.167 CC(=O)c1cc(ccc1F)F 1458a_100000198512_200000210301 [1,0,0,0,0,0|2,1,0]=4 258 B11R1.167 CC(=O)c1cc(ccc1F)I 1458a_100000688014_200000210301 [1,0,0,0,0,0|2,0,0]=3 259 B11R1.167 CC(=O)c1cc(ccc1F)O 1458a_100000037260_200000210301 [1,0,0,0,0,0|3,0,0]=4 260 B11R1.167 CC(=O)c1cc(ccc1F)O 271570a_203496583355_100000689017 [1,0,0,0,0,0|3,0,0]=4 261 B11R1.167 CC(=O)c1cc(ccc1I)Br 1458a_100000183945_200000210301 [1,0,0,0,0,0|2,1,0]=4 262 B11R1.167 CC(=O)c1cc(ccc1I)C 1458a_100000057929_200000210301 [1,0,0,0,0,0|3,0,0]=4 263 B11R1.167 CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_200000210301 [1,0,0,0,0,0|2,1,0]=4 264 B11R1.167 CC(=O)c1cc(ccc1I)F 1458a_100000748905_200000210301 [1,0,0,0,0,0|2,1,0]=4 265 B11R1.167 CC(=O)c1cc(ccc1I)I 1458a_100000750460_200000210301 [1,0,0,0,0,0|2,0,0]=3 266 B11R1.167 CC(=O)c1cc(ccc1I)O 1458a_200009995701_200000210301 [1,0,0,0,0,0|3,0,0]=4 267 B11R1.167 CC(=O)c1cc(ccc1N)O 271570a_203496583355_100000695420 [1,0,0,0,0,0|3,0,0]=4 268 B11R1.167 CC(=O)c1cc(ccc1O)Br 1458a_100000212140_200000210301 [1,0,0,0,0,0|1,1,0]=3 269 B11R1.167 CC(=O)c1cc(ccc1O)Br 271570a_203496583355_100012349576 [1,0,0,0,0,0|1,1,0]=3 270 B11R1.167 CC(=O)c1cc(ccc1O)C 1458a_100000229998_200000210301 [1,0,0,0,0,0|2,0,0]=3 271 B11R1.167 CC(=O)c1cc(ccc1O)C 271570a_203496583355_100012361225 [1,0,0,0,0,0|2,0,0]=3 272 B11R1.167 CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_200000210301 [1,0,0,0,0,0|1,1,0]=3 273 B11R1.167 CC(=O)c1cc(ccc1O)F 1458a_100000742286_200000210301 [1,0,0,0,0,0|1,1,0]=3 274 B11R1.167 CC(=O)c1cc(ccc1O)F 271570a_203496583355_100012353695 [1,0,0,0,0,0|1,1,0]=3 275 B11R1.167 CC(=O)c1cc(ccc1O)I 1458a_100000212111_200000210301 [1,0,0,0,0,0|1,0,0]=2 276 B11R1.167 CC(=O)c1cc(ccc1O)N 271570a_203496583355_100012349454 [1,0,0,0,0,0|2,0,0]=3 277 B11R1.167 CC(=O)c1cc(ccc1O)O 1458a_100000758025_200000210301 [1,0,0,0,0,0|2,0,0]=3 278 B11R1.167 CC(=O)c1cc(ccc1O)O 271570a_203496583355_100000212127 [1,0,0,0,0,0|2,0,0]=3 279 B11R1.167 CC(=O)c1cc(cnc1O)F 271570a_203496583355_100000118324 [1,0,0,0,0,0|2,1,0]=4 280 B11R1.167 C[C@H](O)c1cc(ccc1O)F 271570a_203496583355_100134768474 [1,0,0,0,0,0|1,1,1]=4 281 B11R1.167 Cc1ccc(c(c1)B(O)O)O 271570a_203496583355_200010883979 [1,0,0,0,0,0|2,0,1]=4 282 B11R1.167 Cc1ccc(c(c1)C(=O)N)O 271570a_203496583355_200012349609 [1,0,0,0,0,0|2,0,0]=3 283 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Br 1458a_100000689033_200025704644 [1,0,0,0,0,0|3,0,0]=4 284 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])C 1458a_100000195421_200025704644 [1,0,0,0,0,0|3,0,0]=4 285 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100011290873_200025704644 [1,0,0,0,0,0|3,0,0]=4 286 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])F 1458a_100000749327_200025704644 [1,0,0,0,0,0|3,0,0]=4 287 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])I 1458a_100000057929_200025704644 [1,0,0,0,0,0|3,0,0]=4 288 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000229998_200025704644 [1,0,0,0,0,0|2,0,0]=3 289 B11R1.167 Cc1ccc(cc1C(=O)N)O 271570a_203496583355_100012257281 [1,0,0,0,0,0|3,0,0]=4 290 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Br 1458a_100000759961_200025704644 [1,0,0,0,0,0|2,1,0]=4 291 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Cl 1458a_100000692595_200025704644 [1,0,0,0,0,0|2,1,0]=4 292 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])F 1458a_100000240043_200025704644 [1,0,0,0,0,0|2,1,0]=4 293 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])I 1458a_100000688012_200025704644 [1,0,0,0,0,0|2,0,0]=3 294 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])O 1458a_100000687834_200025704644 [1,0,0,0,0,0|3,0,0]=4 295 B11R1.167 NC(=O)c1cc(ccc1F)O 271570a_203496583355_100000162119 [1,0,0,0,0,0|3,0,0]=4 296 B11R1.167 NC(=O)c1cc(ccc1N)O 271570a_203496583355_100000740421 [1,0,0,0,0,0|3,0,0]=4 297 B11R1.167 NC(=O)c1cc(ccc1O)Br 271570a_203496583355_200000162314 [1,0,0,0,0,0|1,1,0]=3 298 B11R1.167 NC(=O)c1cc(ccc1O)F 271570a_203496583355_100000206434 [1,0,0,0,0,0|1,1,0]=3 299 B11R1.167 NC(=O)c1cc(ccc1O)N 271570a_203496583355_100015186447 [1,0,0,0,0,0|2,0,0]=3 300 B11R1.167 NC(=O)c1cc(ccc1O)O 271570a_203496583355_100000192807 [1,0,0,0,0,0|2,0,0]=3 301 B11R1.167 NC(=O)c1cc(cnc1O)F 271570a_203496583355_100012183597 [1,0,0,0,0,0|2,1,0]=4 302 B11R1.167 OB(O)c1cc(ccc1O)F 271570a_203496583355_200009816908 [1,0,0,0,0,0|1,1,1]=4 303 B11R1.167 OB(O)c1cc(ccc1O)O 271570a_203496583355_200009814749 [1,0,0,0,0,0|2,0,1]=4 304 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Br 1458a_100000690610_200025704644 [1,0,0,0,0,0|2,1,0]=4 305 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200025704644 [1,0,0,0,0,0|2,1,0]=4 306 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)F 1458a_100000212315_200025704644 [1,0,0,0,0,0|2,1,0]=4 307 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)I 1458a_100000698340_200025704644 [1,0,0,0,0,0|2,0,0]=3 308 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)O 1458a_100012352043_200025704644 [1,0,0,0,0,0|3,0,0]=4 309 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200025704644 [1,0,0,0,0,0|2,1,0]=4 310 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200025704644 [1,0,0,0,0,0|2,1,0]=4 311 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)F 1458a_100011219680_200025704644 [1,0,0,0,0,0|2,1,0]=4 312 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)I 1458a_100000688013_200025704644 [1,0,0,0,0,0|2,0,0]=3 313 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)O 1458a_100000719527_200025704644 [1,0,0,0,0,0|3,0,0]=4 314 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Br 1458a_100000212322_200025704644 [1,0,0,0,0,0|2,1,0]=4 315 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Cl 1458a_100000214954_200025704644 [1,0,0,0,0,0|2,1,0]=4 316 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)F 1458a_100000198512_200025704644 [1,0,0,0,0,0|2,1,0]=4 317 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)I 1458a_100000688014_200025704644 [1,0,0,0,0,0|2,0,0]=3 318 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)O 1458a_100000037260_200025704644 [1,0,0,0,0,0|3,0,0]=4 319 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Br 1458a_100000183945_200025704644 [1,0,0,0,0,0|2,1,0]=4 320 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Cl 1458a_100000739379_200025704644 [1,0,0,0,0,0|2,1,0]=4 321 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)F 1458a_100000748905_200025704644 [1,0,0,0,0,0|2,1,0]=4 322 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)I 1458a_100000750460_200025704644 [1,0,0,0,0,0|2,0,0]=3 323 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)O 1458a_200009995701_200025704644 [1,0,0,0,0,0|3,0,0]=4 324 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Br 1458a_100000212140_200025704644 [1,0,0,0,0,0|1,1,0]=3 325 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Cl 1458a_100000212143_200025704644 [1,0,0,0,0,0|1,1,0]=3 326 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)F 1458a_100000742286_200025704644 [1,0,0,0,0,0|1,1,0]=3 327 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)I 1458a_100000212111_200025704644 [1,0,0,0,0,0|1,0,0]=2 328 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)O 1458a_100000758025_200025704644 [1,0,0,0,0,0|2,0,0]=3 329 B13R1.299 C=Cc1cc(cc(c1O)C(=O)C)C 271570a_100011290941_100011659362 [0,1,0,0,0,0|3,0,0]=4 330 B13R1.299 C=Cc1cc(cc(c1O)C(=O)N)F 271570a_100011290941_200135271384 [0,1,0,0,0,0|2,1,0]=4 331 B13R1.299 CC(=O)c1cc(cc(c1O)S[13CH3])C 62a_200025704644_100011659362 [0,1,0,0,0,0|3,0,0]=4 332 B13R1.299 COc1cc(cc(c1O)C(=O)C)Br 1458a_100012340195_200000210301 [0,1,0,0,0,0|2,1,0]=4 333 B13R1.299 COc1cc(cc(c1O)C(=O)[13CH3])Br 1458a_100012340195_200025704644 [0,1,0,0,0,0|2,1,0]=4 334 B13R1.299 CSc1cc(cc(c1O)C(=O)C)C 62a_200000210301_100011659362 [0,1,0,0,0,0|3,0,0]=4 335 B13R1.299 CSc1cc(cc(c1O)C(=O)N)F 62a_200000210301_200135271384 [0,1,0,0,0,0|2,1,0]=4 336 B13R1.299 CSc1cc(cc(c1O)C(=O)N)F 62a_200135271384_200000210301 [0,1,0,0,0,0|2,1,0]=4 337 B13R1.299 [13CH3]Sc1cc(cc(c1O)C(=O)N)F 62a_200025704644_200135271384 [0,1,0,0,0,0|2,1,0]=4 338 B13R1.299 [13CH3]Sc1cc(cc(c1O)C(=O)N)F 62a_200135271384_200025704644 [0,1,0,0,0,0|2,1,0]=4 339 B13R1.2818 CC(=O)c1c(c(cc(c1Cl)Cl)Cl)O 1458a_100000186488_200000210301 [0,1,0,0,0,0|1,2,0]=4 340 B13R1.2818 [13CH3]C(=O)c1c(c(cc(c1Cl)Cl)Cl)O 1458a_100000186488_200025704644 [0,1,0,0,0,0|1,2,0]=4 341 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Br)Br 7a_100000212130_200025704644 [0,1,0,0,0,0|1,2,0]=4 342 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Br)C 7a_100011659362_200025704644 [0,1,0,0,0,0|2,1,0]=4 343 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Br)Cl 7a_100011218835_200025704644 [0,1,0,0,0,0|1,2,0]=4 344 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])C)C 34a_100000188341_200025704644 [0,1,0,0,0,0|3,0,0]=4 345 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])C)C 7a_100000188341_200025704644 [0,1,0,0,0,0|3,0,0]=4 346 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Cl)C 34a_100010659243_200025704644 [0,1,0,0,0,0|2,1,0]=4 347 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Cl)C 7a_100010659243_200025704644 [0,1,0,0,0,0|2,1,0]=4 348 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Cl)Cl 7a_100000182809_200025704644 [0,1,0,0,0,0|1,2,0]=4 349 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Cl)F 34a_100011659368_200025704644 [0,1,0,0,0,0|1,2,0]=4 350 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Cl)F 7a_100011659368_200025704644 [0,1,0,0,0,0|1,2,0]=4 351 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])F)F 34a_100000751779_200025704644 [0,1,0,0,0,0|1,2,0]=4 352 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])F)F 7a_100000751779_200025704644 [0,1,0,0,0,0|1,2,0]=4 353 B13R1.3255 COc1c(cc(cc1C(=O)C)Br)Br 1458a_100000188141_200000210301 [0,1,0,0,0,0|1,2,0]=4 354 B13R1.3255 COc1c(cc(cc1C(=O)C)Br)Br 7a_100000212130_200000210301 [0,1,0,0,0,0|1,2,0]=4 355 B13R1.3255 COc1c(cc(cc1C(=O)C)C)Br 7a_100011659362_200000210301 [0,1,0,0,0,0|2,1,0]=4 356 B13R1.3255 COc1c(cc(cc1C(=O)C)C)C 34a_100000188341_200000210301 [0,1,0,0,0,0|3,0,0]=4 357 B13R1.3255 COc1c(cc(cc1C(=O)C)C)C 7a_100000188341_200000210301 [0,1,0,0,0,0|3,0,0]=4 358 B13R1.3255 COc1c(cc(cc1C(=O)C)C)Cl 34a_100010659243_200000210301 [0,1,0,0,0,0|2,1,0]=4 359 B13R1.3255 COc1c(cc(cc1C(=O)C)C)Cl 7a_100010659243_200000210301 [0,1,0,0,0,0|2,1,0]=4 360 B13R1.3255 COc1c(cc(cc1C(=O)C)Cl)Br 7a_100011218835_200000210301 [0,1,0,0,0,0|1,2,0]=4 361 B13R1.3255 COc1c(cc(cc1C(=O)C)Cl)Cl 1458a_100000186506_200000210301 [0,1,0,0,0,0|1,2,0]=4 362 B13R1.3255 COc1c(cc(cc1C(=O)C)Cl)Cl 7a_100000182809_200000210301 [0,1,0,0,0,0|1,2,0]=4 363 B13R1.3255 COc1c(cc(cc1C(=O)C)F)Cl 34a_100011659368_200000210301 [0,1,0,0,0,0|1,2,0]=4 364 B13R1.3255 COc1c(cc(cc1C(=O)C)F)Cl 7a_100011659368_200000210301 [0,1,0,0,0,0|1,2,0]=4 365 B13R1.3255 COc1c(cc(cc1C(=O)C)F)F 1458a_100000062013_200000210301 [0,1,0,0,0,0|1,2,0]=4 366 B13R1.3255 COc1c(cc(cc1C(=O)C)F)F 34a_100000751779_200000210301 [0,1,0,0,0,0|1,2,0]=4 367 B13R1.3255 COc1c(cc(cc1C(=O)C)F)F 7a_100000751779_200000210301 [0,1,0,0,0,0|1,2,0]=4 368 B13R1.3255 COc1c(cc(cc1C(=O)N)Br)Br 34a_200009812496_200000210301 [0,1,0,0,0,0|1,2,0]=4 369 B13R1.3255 COc1c(cc(cc1C(=O)N)Br)Br 7a_200009812496_200000210301 [0,1,0,0,0,0|1,2,0]=4 370 B13R1.3255 COc1c(cc(cc1C(=O)N)F)I 34a_200135271384_200000210301 [0,1,0,0,0,0|1,1,0]=3 371 B13R1.3255 COc1c(cc(cc1C(=O)N)F)I 7a_200135271384_200000210301 [0,1,0,0,0,0|1,1,0]=3 372 B13R1.3255 COc1c(cc(cc1C(=O)[13CH3])Br)Br 1458a_100000188141_200025704644 [0,1,0,0,0,0|1,2,0]=4 373 B13R1.3255 COc1c(cc(cc1C(=O)[13CH3])Cl)Cl 1458a_100000186506_200025704644 [0,1,0,0,0,0|1,2,0]=4 374 B13R1.3255 COc1c(cc(cc1C(=O)[13CH3])F)F 1458a_100000062013_200025704644 [0,1,0,0,0,0|1,2,0]=4 375 B13R1.3255 [13CH3]Oc1c(cc(cc1C(=O)N)Br)Br 34a_200009812496_200025704644 [0,1,0,0,0,0|1,2,0]=4 376 B13R1.3255 [13CH3]Oc1c(cc(cc1C(=O)N)Br)Br 7a_200009812496_200025704644 [0,1,0,0,0,0|1,2,0]=4 377 B13R1.3255 [13CH3]Oc1c(cc(cc1C(=O)N)F)I 34a_200135271384_200025704644 [0,1,0,0,0,0|1,1,0]=3 378 B13R1.3255 [13CH3]Oc1c(cc(cc1C(=O)N)F)I 7a_200135271384_200025704644 [0,1,0,0,0,0|1,1,0]=3 379 B13R1.4789 CCC(=O)c1cc(cc(c1F)Cl)I 1458a_100012920558_100000210202 [0,1,0,0,0,0|2,1,0]=4 380 B13R1.4789 CCC(=O)c1cc(cc(c1F)F)I 1458a_100012344719_100000210202 [0,1,0,0,0,0|2,1,0]=4 381 B13R1.4789 CCC(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_100000210202 [0,1,0,0,0,0|1,2,0]=4 382 B13R1.4789 CCC(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100000210202 [0,1,0,0,0,0|1,2,0]=4 383 B13R1.4789 CCC(=O)c1cc(cc(c1O)C)Br 1458a_100011825902_100000210202 [0,1,0,0,0,0|2,1,0]=4 384 B13R1.4789 CCC(=O)c1cc(cc(c1O)C)Cl 1458a_100011255218_100000210202 [0,1,0,0,0,0|2,1,0]=4 385 B13R1.4789 CCC(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100000210202 [0,1,0,0,0,0|1,2,0]=4 386 B13R1.4789 CCC(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_100000210202 [0,1,0,0,0,0|1,2,0]=4 387 B13R1.4789 CCC(=O)c1cc(cc(c1O)F)F 1458a_100011255242_100000210202 [0,1,0,0,0,0|1,2,0]=4 388 B13R1.4789 CCC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_100000210202 [0,1,0,0,0,0|1,0,0]=2 389 B13R1.4789 CCC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_100000210202 [0,1,0,0,0,0|2,1,0]=4 390 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)I 11a_106832991635_100012920558 [0,1,0,0,0,0|2,1,0]=4 391 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)I 1626a_100102657272_100012920558 [0,1,0,0,0,0|2,1,0]=4 392 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)I 240690a_100102657272_100012920558 [0,1,0,0,0,0|2,1,0]=4 393 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)I 11a_106832991635_100012344719 [0,1,0,0,0,0|2,1,0]=4 394 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)I 1626a_100102657272_100012344719 [0,1,0,0,0,0|2,1,0]=4 395 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)I 240690a_100102657272_100012344719 [0,1,0,0,0,0|2,1,0]=4 396 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)I 527a_100102657272_100012344719 [0,1,0,0,0,0|2,1,0]=4 397 B13R1.4789 CNC(=O)c1cc(cc(c1O)Br)Br 240690a_100102657272_100000212120 [0,1,0,0,0,0|1,2,0]=4 398 B13R1.4789 CNC(=O)c1cc(cc(c1O)Br)Br 527a_100102657272_100000212120 [0,1,0,0,0,0|1,2,0]=4 399 B13R1.4789 CNC(=O)c1cc(cc(c1O)Br)Cl 240690a_100102657272_100000765379 [0,1,0,0,0,0|1,2,0]=4 400 B13R1.4789 CNC(=O)c1cc(cc(c1O)Br)Cl 527a_100102657272_100000765379 [0,1,0,0,0,0|1,2,0]=4 401 B13R1.4789 CNC(=O)c1cc(cc(c1O)C)Br 240690a_100102657272_100011825902 [0,1,0,0,0,0|2,1,0]=4 402 B13R1.4789 CNC(=O)c1cc(cc(c1O)C)Cl 240690a_100102657272_100011255218 [0,1,0,0,0,0|2,1,0]=4 403 B13R1.4789 CNC(=O)c1cc(cc(c1O)C)Cl 527a_100102657272_100011255218 [0,1,0,0,0,0|2,1,0]=4 404 B13R1.4789 CNC(=O)c1cc(cc(c1O)Cl)Cl 240690a_100102657272_100000215963 [0,1,0,0,0,0|1,2,0]=4 405 B13R1.4789 CNC(=O)c1cc(cc(c1O)Cl)Cl 527a_100102657272_100000215963 [0,1,0,0,0,0|1,2,0]=4 406 B13R1.4789 CNC(=O)c1cc(cc(c1O)F)Br 240690a_100102657272_100011255233 [0,1,0,0,0,0|1,2,0]=4 407 B13R1.4789 CNC(=O)c1cc(cc(c1O)F)Br 527a_100102657272_100011255233 [0,1,0,0,0,0|1,2,0]=4 408 B13R1.4789 CNC(=O)c1cc(cc(c1O)F)F 240690a_100102657272_100011255242 [0,1,0,0,0,0|1,2,0]=4 409 B13R1.4789 CNC(=O)c1cc(cc(c1O)F)F 527a_100102657272_100011255242 [0,1,0,0,0,0|1,2,0]=4 410 B13R1.4789 CNC(=O)c1cc(cc(c1O)I)I 1626a_100102657272_100000748652 [0,1,0,0,0,0|1,0,0]=2 411 B13R1.4789 CNC(=O)c1cc(cc(c1O)I)I 240690a_100102657272_100000748652 [0,1,0,0,0,0|1,0,0]=2 412 B13R1.4789 COC(=O)c1cc(cc(c1C)Br)O 271570a_203496583355_100012569200 [0,1,0,0,0,0|2,1,0]=4 413 B13R1.4789 COC(=O)c1cc(cc(c1C)F)O 271570a_203496583355_100015527428 [0,1,0,0,0,0|2,1,0]=4 414 B13R1.4789 COC(=O)c1cc(cc(c1C)N)O 271570a_203496583355_100012257200 [0,1,0,0,0,0|3,0,0]=4 415 B13R1.4789 COC(=O)c1cc(cc(c1C)O)F 271570a_203496583355_100012347598 [0,1,0,0,0,0|2,1,0]=4 416 B13R1.4789 COC(=O)c1cc(cc(c1C)O)O 271570a_203496583355_200011012443 [0,1,0,0,0,0|3,0,0]=4 417 B13R1.4789 COC(=O)c1cc(cc(c1F)C)O 271570a_203496583355_200012928940 [0,1,0,0,0,0|3,0,0]=4 418 B13R1.4789 COC(=O)c1cc(cc(c1F)F)O 271570a_203496583355_100012362532 [0,1,0,0,0,0|2,1,0]=4 419 B13R1.4789 COC(=O)c1cc(cc(c1F)N)O 271570a_203496583355_100011794250 [0,1,0,0,0,0|3,0,0]=4 420 B13R1.4789 COC(=O)c1cc(cc(c1N)C)O 271570a_203496583355_100011356660 [0,1,0,0,0,0|3,0,0]=4 421 B13R1.4789 COC(=O)c1cc(cc(c1N)N)O 271570a_203496583355_100010127340 [0,1,0,0,0,0|3,0,0]=4 422 B13R1.4789 COC(=O)c1cc(cc(c1N)O)Br 271570a_203496583355_100010726126 [0,1,0,0,0,0|2,1,0]=4 423 B13R1.4789 COC(=O)c1cc(cc(c1N)O)C 271570a_203496583355_100000216481 [0,1,0,0,0,0|3,0,0]=4 424 B13R1.4789 COC(=O)c1cc(cc(c1N)O)Cl 271570a_203496583355_100000043629 [0,1,0,0,0,0|2,1,0]=4 425 B13R1.4789 COC(=O)c1cc(cc(c1O)C)F 271570a_203496583355_100016049047 [0,1,0,0,0,0|1,1,0]=3 426 B13R1.4789 COC(=O)c1cc(cc(c1O)F)F 271570a_203496583355_100010155431 [0,1,0,0,0,0|0,2,0]=3 427 B13R1.4789 COC(=O)c1cc(cc(c1O)N)F 271570a_203496583355_100011794234 [0,1,0,0,0,0|1,1,0]=3 428 B13R1.4789 COC(=O)c1cc(cc(c1O)O)Br 271570a_203496583355_100009996593 [0,1,0,0,0,0|1,1,0]=3 429 B13R1.4789 Cc1cc(cc(c1O)C(=O)CF)Br 1458a_100011825902_100015361967 [0,1,0,0,0,0|2,1,0]=4 430 B13R1.4789 Cc1cc(cc(c1O)C(=O)CF)Cl 1458a_100011255218_100015361967 [0,1,0,0,0,0|2,1,0]=4 431 B13R1.4789 O=C(CF)c1cc(cc(c1F)Cl)I 1458a_100012920558_100015361967 [0,1,0,0,0,0|2,1,0]=4 432 B13R1.4789 O=C(CF)c1cc(cc(c1F)F)I 1458a_100012344719_100015361967 [0,1,0,0,0,0|2,1,0]=4 433 B13R1.4789 O=C(CF)c1cc(cc(c1O)Br)Br 1458a_100000212120_100015361967 [0,1,0,0,0,0|1,2,0]=4 434 B13R1.4789 O=C(CF)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100015361967 [0,1,0,0,0,0|1,2,0]=4 435 B13R1.4789 O=C(CF)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100015361967 [0,1,0,0,0,0|1,2,0]=4 436 B13R1.4789 O=C(CF)c1cc(cc(c1O)F)Br 1458a_100011255233_100015361967 [0,1,0,0,0,0|1,2,0]=4 437 B13R1.4789 O=C(CF)c1cc(cc(c1O)F)F 1458a_100011255242_100015361967 [0,1,0,0,0,0|1,2,0]=4 438 B13R1.4789 O=C(CF)c1cc(cc(c1O)I)I 1458a_100000748652_100015361967 [0,1,0,0,0,0|1,0,0]=2 439 B13R1.4789 O=C(CF)c1cc(cc(c1O)O)Br 1458a_200010196872_100015361967 [0,1,0,0,0,0|2,1,0]=4 440 B13R1.2816 CC(=O)Cc1cc(cc(c1Cl)Br)I 1458a_100000070787_100021522891 [0,0,0,0,0,1|2,1,0]=4 441 B13R1.2816 CC(=O)Cc1cc(cc(c1O)Br)Br 1458a_100000070787_200009814416 [0,0,0,0,0,1|1,2,0]=4 442 B13R1.2816 CC(=O)Cc1cc(cc(c1O)Cl)Cl 1458a_100010323609_200000210301 [0,0,0,0,0,1|1,2,0]=4 443 B13R1.2816 CC(=O)Cc1cc(cc(c1O)F)F 1458a_200015623426_200000210301 [0,0,0,0,0,1|1,2,0]=4 444 B13R1.2816 CC(=O)Nc1cc(cc(c1C)I)Cl 11a_200000050010_100015343762 [0,0,0,0,0,1|2,1,0]=4 445 B13R1.2816 CC(=O)Nc1cc(cc(c1C)I)Cl 1626a_200000050010_100015343762 [0,0,0,0,0,1|2,1,0]=4 446 B13R1.2816 CC(=O)Nc1cc(cc(c1C)I)Cl 527a_200000050010_100103153847 [0,0,0,0,0,1|2,1,0]=4 447 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)Br 22a_100010781877_100000070787 [0,0,0,0,0,1|1,2,0]=4 448 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)Br 527a_100010781877_100103153847 [0,0,0,0,0,1|1,2,0]=4 449 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)Cl 22a_106741647128_100000070787 [0,0,0,0,0,1|1,2,0]=4 450 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)Cl 527a_106741647128_100103153847 [0,0,0,0,0,1|1,2,0]=4 451 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)F 22a_200011217456_100000070787 [0,0,0,0,0,1|1,2,0]=4 452 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)F 527a_200011217456_100103153847 [0,0,0,0,0,1|1,2,0]=4 453 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)Br 11a_100011825904_100015343762 [0,0,0,0,0,1|2,1,0]=4 454 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)Br 22a_100011825904_100000070787 [0,0,0,0,0,1|2,1,0]=4 455 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)Br 527a_100011825904_100103153847 [0,0,0,0,0,1|2,1,0]=4 456 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)C 11a_100011216242_100015343762 [0,0,0,0,0,1|3,0,0]=4 457 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)C 22a_100011216242_100000070787 [0,0,0,0,0,1|3,0,0]=4 458 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)C 527a_100011216242_100103153847 [0,0,0,0,0,1|3,0,0]=4 459 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)F 11a_100000130126_100015343762 [0,0,0,0,0,1|2,1,0]=4 460 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)F 22a_100000130126_100000070787 [0,0,0,0,0,1|2,1,0]=4 461 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)F 527a_100000130126_100103153847 [0,0,0,0,0,1|2,1,0]=4 462 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Cl)Br 22a_100000694353_100000070787 [0,0,0,0,0,1|1,2,0]=4 463 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Cl)Br 527a_100000694353_100103153847 [0,0,0,0,0,1|1,2,0]=4 464 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Cl)Cl 22a_100000695819_100000070787 [0,0,0,0,0,1|1,2,0]=4 465 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Cl)Cl 527a_100000695819_100103153847 [0,0,0,0,0,1|1,2,0]=4 466 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)Br 22a_100011217383_100000070787 [0,0,0,0,0,1|1,2,0]=4 467 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)Br 527a_100011217383_100103153847 [0,0,0,0,0,1|1,2,0]=4 468 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)F 1626a_100015205836_100015343762 [0,0,0,0,0,1|1,2,0]=4 469 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)F 22a_100015205836_100000070787 [0,0,0,0,0,1|1,2,0]=4 470 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)F 527a_100015205836_100103153847 [0,0,0,0,0,1|1,2,0]=4 471 B13R1.2816 CC(=O)Nc1cc(cc(c1O)I)Br 22a_100016071998_100000070787 [0,0,0,0,0,1|1,1,0]=3 472 B13R1.2816 CC(=O)Nc1cc(cc(c1O)I)Br 527a_100016071998_100103153847 [0,0,0,0,0,1|1,1,0]=3 473 B13R1.2816 [13CH3]C(=O)Cc1cc(cc(c1O)Cl)Cl 1458a_100010323609_200025704644 [0,0,0,0,0,1|1,2,0]=4 474 B13R1.2816 [13CH3]C(=O)Cc1cc(cc(c1O)F)F 1458a_200015623426_200025704644 [0,0,0,0,0,1|1,2,0]=4 475 B10R1.2 C=Cc1cccc(c1O)Br 271570a_100011290941_100010084509 [2,0,0,0,0,0|1,1,0]=4 476 B10R1.2 C=Cc1cccc(c1O)C 271570a_100011290941_100009817157 [2,0,0,0,0,0|2,0,0]=4 477 B10R1.2 C=Cc1cccc(c1O)Cl 271570a_100011290941_100010202889 [2,0,0,0,0,0|1,1,0]=4 478 B10R1.2 C=Cc1cccc(c1O)F 271570a_100011290941_100009813666 [2,0,0,0,0,0|1,1,0]=4 479 B10R1.2 C=Cc1cccc(c1O)N 271570a_100011290941_100011934915 [2,0,0,0,0,0|2,0,0]=4 480 B10R1.2 C=Cc1cccc(c1O)O 271570a_100011290941_100009815950 [2,0,0,0,0,0|2,0,0]=4 481 B10R1.2 Cc1c(cccc1C=O)O 271570a_203496583355_100012179384 [2,0,0,0,0,0|2,0,0]=4 482 B10R1.2 Cc1cccc(c1O)CO 271570a_203496583355_100011659289 [2,0,0,0,0,0|1,0,1]=4 483 B10R1.2 Nc1c(cccc1C=O)O 271570a_203496583355_100010144990 [2,0,0,0,0,0|2,0,0]=4 484 B10R1.2 O=Cc1cccc(c1F)O 271570a_203496583355_100000766533 [2,0,0,0,0,0|2,0,0]=4 485 B10R1.2 O=Cc1cccc(c1O)F 271570a_203496583355_100011998484 [2,0,0,0,0,0|0,1,0]=3 486 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100000737635 [2,0,0,0,0,0|1,0,0]=3 487 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100009816417 [2,0,0,0,0,0|1,0,0]=3 488 B10R1.2 O=Cc1ccnc(c1O)F 271570a_203496583355_100009856171 [2,0,0,0,0,0|1,1,0]=4 489 B10R1.2 OCc1cccc(c1O)Br 271570a_203496583355_100010146604 [2,0,0,0,0,0|0,1,1]=4 490 B10R1.2 OCc1cccc(c1O)F 271570a_203496583355_100000692438 [2,0,0,0,0,0|0,1,1]=4 491 B10R1.8 CNc1cc(cc(c1)I)I 7a_200000696836_200000210301 [2,0,0,0,0,0|2,0,0]=4 492 B10R1.8 Cc1cc(cc(c1)C=O)O 271570a_203496583355_100000686105 [2,0,0,0,0,0|2,0,0]=4 493 B10R1.8 O=Cc1cc(cc(c1)Br)O 271570a_203496583355_100010185649 [2,0,0,0,0,0|1,1,0]=4 494 B10R1.8 O=Cc1cc(cc(c1)F)O 271570a_203496583355_100011794424 [2,0,0,0,0,0|1,1,0]=4 495 B10R1.8 O=Cc1cc(cc(c1)O)O 271570a_203496583355_100010176088 [2,0,0,0,0,0|2,0,0]=4 496 B10R1.8 [13CH3]Nc1cc(cc(c1)I)I 7a_200000696836_200025704644 [2,0,0,0,0,0|2,0,0]=4 497 B10R1.22 Cc1cc(c(c(c1)F)O)O 271570a_203496583355_200135191068 [2,0,0,0,0,0|1,1,0]=4 498 B10R1.22 Cc1cc(c(c(c1)O)O)C 271570a_203496583355_100010342985 [2,0,0,0,0,0|2,0,0]=4 499 B10R1.22 Cc1cc(c(c(c1)O)O)C 271570a_203496583355_100011934984 [2,0,0,0,0,0|2,0,0]=4 500 B10R1.22 Cc1cc(cc(c1O)O)Cl 271570a_203496583355_100010254216 [2,0,0,0,0,0|1,1,0]=4 501 B10R1.22 Cc1cc(cc(c1O)O)Cl 271570a_203496583355_100012343667 [2,0,0,0,0,0|1,1,0]=4 502 B10R1.22 Cc1cc(cc(c1O)O)N 271570a_203496583355_100010064301 [2,0,0,0,0,0|2,0,0]=4 503 B10R1.22 Nc1cc(cc(c1O)O)F 271570a_203496583355_200011217456 [2,0,0,0,0,0|1,1,0]=4 504 B10R1.22 Oc1cc(c(c(c1)O)O)O 271570a_203496583355_200010341185 [2,0,0,0,0,0|2,0,0]=4 505 B10R1.22 Oc1cc(cc(c1O)Br)F 271570a_203496583355_200013085147 [2,0,0,0,0,0|0,2,0]=4 506 B10R1.22 Oc1cc(cc(c1O)Cl)Cl 271570a_203496583355_200012339341 [2,0,0,0,0,0|0,2,0]=4 507 B10R1.22 Oc1cc(cc(c1O)F)Br 271570a_203496583355_100013354677 [2,0,0,0,0,0|0,2,0]=4 508 B10R1.22 Oc1cc(cc(c1O)F)F 271570a_203496583355_100000688693 [2,0,0,0,0,0|0,2,0]=4 509 B10R1.22 Oc1cc(cc(c1O)F)F 271570a_203496583355_100009815984 [2,0,0,0,0,0|0,2,0]=4 510 B10R1.30 C=Cc1cc(ccc1O)Br 271570a_100011290941_100012355227 [2,0,0,0,0,0|1,1,0]=4 511 B10R1.30 C=Cc1cc(ccc1O)C 271570a_100011290941_100000765521 [2,0,0,0,0,0|2,0,0]=4 512 B10R1.30 C=Cc1cc(ccc1O)Cl 271570a_100011290941_100011356953 [2,0,0,0,0,0|1,1,0]=4 513 B10R1.30 C=Cc1cc(ccc1O)F 271570a_100011290941_100000211999 [2,0,0,0,0,0|1,1,0]=4 514 B10R1.30 C=Cc1cc(ccc1O)N 271570a_100011290941_100011534360 [2,0,0,0,0,0|2,0,0]=4 515 B10R1.30 C=Cc1cc(ccc1O)O 271570a_100011290941_100009813629 [2,0,0,0,0,0|2,0,0]=4 516 B10R1.30 Cc1ccc(c(c1)C=O)O 271570a_203496583355_100011551863 [2,0,0,0,0,0|1,0,0]=3 517 B10R1.30 Cc1ccc(c(c1)CO)O 271570a_203496583355_100012361352 [2,0,0,0,0,0|1,0,1]=4 518 B10R1.30 Cc1ccc(c(n1)C=O)O 271570a_203496583355_100010173661 [2,0,0,0,0,0|2,0,0]=4 519 B10R1.30 Cc1ccc(cc1C=O)O 271570a_203496583355_100011361606 [2,0,0,0,0,0|2,0,0]=4 520 B10R1.30 Cc1cnc(c(c1)C=O)O 271570a_203496583355_100000050350 [2,0,0,0,0,0|2,0,0]=4 521 B10R1.30 Nc1ccc(c(c1)CO)O 271570a_203496583355_100012347228 [2,0,0,0,0,0|1,0,1]=4 522 B10R1.30 Nc1ccc(cc1C=O)O 271570a_203496583355_100011935258 [2,0,0,0,0,0|2,0,0]=4 523 B10R1.30 O=Cc1cc(ccc1Br)O 271570a_203496583355_100010185652 [2,0,0,0,0,0|2,0,0]=4 524 B10R1.30 O=Cc1cc(ccc1Cl)O 271570a_203496583355_100010254384 [2,0,0,0,0,0|2,0,0]=4 525 B10R1.30 O=Cc1cc(ccc1F)O 271570a_203496583355_100000211465 [2,0,0,0,0,0|2,0,0]=4 526 B10R1.30 O=Cc1cc(ccc1O)Br 271570a_203496583355_100010185651 [2,0,0,0,0,0|0,1,0]=3 527 B10R1.30 O=Cc1cc(ccc1O)Cl 271570a_203496583355_100010254386 [2,0,0,0,0,0|0,1,0]=3 528 B10R1.30 O=Cc1cc(ccc1O)F 271570a_203496583355_100011218309 [2,0,0,0,0,0|0,1,0]=3 529 B10R1.30 O=Cc1cc(ccc1O)O 271570a_203496583355_100000186750 [2,0,0,0,0,0|1,0,0]=3 530 B10R1.30 O=Cc1cc(ccc1O)O 271570a_203496583355_100000690577 [2,0,0,0,0,0|1,0,0]=3 531 B10R1.30 O=Cc1cc(cnc1O)F 271570a_203496583355_100000079965 [2,0,0,0,0,0|1,1,0]=4 532 B10R1.30 OCc1cc(ccc1O)Br 271570a_203496583355_100011356890 [2,0,0,0,0,0|0,1,1]=4 533 B10R1.30 OCc1cc(ccc1O)F 271570a_203496583355_100011217561 [2,0,0,0,0,0|0,1,1]=4 534 B10R1.30 OCc1cc(ccc1O)O 271570a_203496583355_100000184703 [2,0,0,0,0,0|1,0,1]=4 535 B10R1.30 OCc1cc(ccc1O)O 271570a_203496583355_100012351483 [2,0,0,0,0,0|1,0,1]=4 536 B10R1.113 CC(=O)c1cccc(c1)Br 1458a_100000210664_200000210301 [2,0,0,0,0,0|1,1,0]=4 537 B10R1.113 CC(=O)c1cccc(c1)C 1458a_100000189346_200000210301 [2,0,0,0,0,0|2,0,0]=4 538 B10R1.113 CC(=O)c1cccc(c1)Cl 1458a_100000210390_200000210301 [2,0,0,0,0,0|1,1,0]=4 539 B10R1.113 CC(=O)c1cccc(c1)F 1458a_100000210950_200000210301 [2,0,0,0,0,0|1,1,0]=4 540 B10R1.113 CC(=O)c1cccc(c1)I 1458a_100000184098_200000210301 [2,0,0,0,0,0|1,0,0]=3 541 B10R1.113 CC(=O)c1cccc(c1)O 1458a_100000183914_200000210301 [2,0,0,0,0,0|2,0,0]=4 542 B10R1.113 CC(=O)c1cccc(c1)O 271570a_203496583355_100000210093 [2,0,0,0,0,0|2,0,0]=4 543 B10R1.113 Cc1cccc(c1)C(=O)[13CH3] 1458a_100000189346_200025704644 [2,0,0,0,0,0|2,0,0]=4 544 B10R1.113 NC(=O)c1cccc(c1)O 271570a_203496583355_100000162208 [2,0,0,0,0,0|2,0,0]=4 545 B10R1.113 [13CH3]C(=O)c1cccc(c1)Br 1458a_100000210664_200025704644 [2,0,0,0,0,0|1,1,0]=4 546 B10R1.113 [13CH3]C(=O)c1cccc(c1)Cl 1458a_100000210390_200025704644 [2,0,0,0,0,0|1,1,0]=4 547 B10R1.113 [13CH3]C(=O)c1cccc(c1)F 1458a_100000210950_200025704644 [2,0,0,0,0,0|1,1,0]=4 548 B10R1.113 [13CH3]C(=O)c1cccc(c1)I 1458a_100000184098_200025704644 [2,0,0,0,0,0|1,0,0]=3 549 B10R1.113 [13CH3]C(=O)c1cccc(c1)O 1458a_100000183914_200025704644 [2,0,0,0,0,0|2,0,0]=4 550 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [2,0,0,0,0,0|2,0,0]=4 551 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [2,0,0,0,0,0|2,0,0]=4 552 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [2,0,0,0,0,0|2,0,0]=4 553 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [2,0,0,0,0,0|2,0,0]=4 554 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [2,0,0,0,0,0|2,0,0]=4 555 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [2,0,0,0,0,0|2,0,0]=4 556 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [2,0,0,0,0,0|1,0,0]=3 557 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [2,0,0,0,0,0|1,0,0]=3 558 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [2,0,0,0,0,0|1,0,1]=4 559 B10R1.61 CC(=O)c1cccnc1O 271570a_203496583355_100000753718 [2,0,0,0,0,0|2,0,0]=4 560 B10R1.61 CC(=O)c1ccncc1O 271570a_203496583355_100009993184 [2,0,0,0,0,0|2,0,0]=4 561 B10R1.61 CC(=O)c1cnccc1O 271570a_203496583355_100160469449 [2,0,0,0,0,0|2,0,0]=4 562 B10R1.61 CC(=O)c1ncccc1O 271570a_203496583355_100012348690 [2,0,0,0,0,0|2,0,0]=4 563 B10R1.61 CC(O)c1ccccc1O 271570a_203496583355_100000702211 [2,0,0,0,0,0|1,0,1]=4 564 B10R1.61 CS(=O)c1ccccc1O 271570a_203496583355_100000734199 [2,0,0,0,0,0|2,0,0]=4 565 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [2,0,0,0,0,0|2,0,0]=4 566 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [2,0,0,0,0,0|1,0,0]=3 567 B10R1.61 NC(=O)c1cccnc1O 271570a_203496583355_100000162199 [2,0,0,0,0,0|2,0,0]=4 568 B10R1.61 NC(=O)c1ccncc1O 271570a_203496583355_100010205435 [2,0,0,0,0,0|2,0,0]=4 569 B10R1.61 NC(=O)c1cnccc1O 271570a_203496583355_100000697804 [2,0,0,0,0,0|2,0,0]=4 570 B10R1.61 NC(=O)c1ncccc1O 271570a_203496583355_200012359670 [2,0,0,0,0,0|2,0,0]=4 571 B10R1.61 OB(O)c1ccccc1O 271570a_203496583355_100000693059 [2,0,0,0,0,0|1,0,1]=4 572 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [2,0,0,0,0,0|2,0,0]=4 573 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [2,0,0,0,0,0|2,0,0]=4 574 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [2,0,0,0,0,0|2,0,0]=4 575 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [2,0,0,0,0,0|2,0,0]=4 576 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [2,0,0,0,0,0|1,0,0]=3 577 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [2,0,0,0,0,0|1,0,1]=4 578 B12R1.40 COCc1cc(cc(c1I)I)I 34a_100138415774_100010206063 [1,1,0,0,0,0|1,0,1]=4 579 B12R1.234 COc1c(cc(cc1C=O)C)O 271570a_203496583355_200010171662 [1,1,0,0,0,0|2,0,0]=4 580 B12R1.234 COc1c(cc(cc1C=O)F)O 271570a_203496583355_100010240317 [1,1,0,0,0,0|1,1,0]=4 581 B12R1.235 C=Cc1cc(cc(c1O)C=O)C 271570a_100011290941_100000698970 [1,1,0,0,0,0|2,0,0]=4 582 B12R1.235 C=Cc1cc(cc(c1O)C=O)F 271570a_100011290941_100011659637 [1,1,0,0,0,0|1,1,0]=4 583 B12R1.235 CSc1cc(cc(c1O)C=O)C 62a_200000210301_100000698970 [1,1,0,0,0,0|2,0,0]=4 584 B12R1.235 CSc1cc(cc(c1O)C=O)Cl 62a_200000210301_200000123117 [1,1,0,0,0,0|1,1,0]=4 585 B12R1.235 CSc1cc(cc(c1O)C=O)F 62a_200000210301_100011659637 [1,1,0,0,0,0|1,1,0]=4 586 B12R1.235 Cc1cc(c(c(c1)S[13CH3])O)C=O 62a_200025704644_100000698970 [1,1,0,0,0,0|2,0,0]=4 587 B12R1.235 [13CH3]Sc1cc(cc(c1O)C=O)Cl 62a_200025704644_200000123117 [1,1,0,0,0,0|1,1,0]=4 588 B12R1.235 [13CH3]Sc1cc(cc(c1O)C=O)F 62a_200025704644_100011659637 [1,1,0,0,0,0|1,1,0]=4 589 B12R1.300 C=Cc1cc(c(c(c1)C=O)O)F 271570a_100011290941_100011217654 [1,1,0,0,0,0|1,1,0]=4 590 B12R1.300 COc1cc(c(c(c1)C=O)O)O 271570a_203496583355_100000751510 [1,1,0,0,0,0|2,0,0]=4 591 B12R1.300 CSc1cc(c(c(c1)C=O)O)C 62a_200000210301_100000696164 [1,1,0,0,0,0|2,0,0]=4 592 B12R1.300 CSc1cc(c(c(c1)C=O)O)F 62a_100011217654_200000210301 [1,1,0,0,0,0|1,1,0]=4 593 B12R1.300 CSc1cc(c(c(c1)C=O)O)F 62a_200000210301_100011217654 [1,1,0,0,0,0|1,1,0]=4 594 B12R1.300 CSc1cc(c(c(c1)C=O)O)O 62a_200000210301_100010235811 [1,1,0,0,0,0|2,0,0]=4 595 B12R1.300 Cc1cc(cc(c1O)C=O)S[13CH3] 62a_200025704644_100000696164 [1,1,0,0,0,0|2,0,0]=4 596 B12R1.300 [13CH3]Sc1cc(c(c(c1)C=O)O)F 62a_100011217654_200025704644 [1,1,0,0,0,0|1,1,0]=4 597 B12R1.300 [13CH3]Sc1cc(c(c(c1)C=O)O)F 62a_200025704644_100011217654 [1,1,0,0,0,0|1,1,0]=4 598 B12R1.300 [13CH3]Sc1cc(c(c(c1)C=O)O)O 62a_200025704644_100010235811 [1,1,0,0,0,0|2,0,0]=4 599 B12R1.11 COc1cc(cc(c1)C(=O)C)I 1458a_200010292657_200000210301 [1,1,0,0,0,0|2,0,0]=4 600 B12R1.11 COc1cc(cc(c1)C(=O)[13CH3])I 1458a_200010292657_200025704644 [1,1,0,0,0,0|2,0,0]=4 601 B12R1.358 CCC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_100000210202 [1,1,0,0,0,0|1,1,0]=4 602 B12R1.358 CCC(=O)c1cc(cc(c1)I)C 1458a_100000729426_100000210202 [1,1,0,0,0,0|2,0,0]=4 603 B12R1.358 CCC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_100000210202 [1,1,0,0,0,0|1,1,0]=4 604 B12R1.358 CCC(=O)c1cc(cc(c1)I)F 1458a_100012047268_100000210202 [1,1,0,0,0,0|1,1,0]=4 605 B12R1.358 CCC(=O)c1cc(cc(c1)I)I 1458a_100011204819_100000210202 [1,1,0,0,0,0|1,0,0]=3 606 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br 11a_106832991635_100000689235 [1,1,0,0,0,0|1,1,0]=4 607 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br 1626a_100102657272_100000689235 [1,1,0,0,0,0|1,1,0]=4 608 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br 240690a_100102657272_100000689235 [1,1,0,0,0,0|1,1,0]=4 609 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br 527a_100102657272_100000689235 [1,1,0,0,0,0|1,1,0]=4 610 B12R1.358 CNC(=O)c1cc(cc(c1)I)C 11a_106832991635_100000729426 [1,1,0,0,0,0|2,0,0]=4 611 B12R1.358 CNC(=O)c1cc(cc(c1)I)C 1626a_100102657272_100000729426 [1,1,0,0,0,0|2,0,0]=4 612 B12R1.358 CNC(=O)c1cc(cc(c1)I)C 240690a_100102657272_100000729426 [1,1,0,0,0,0|2,0,0]=4 613 B12R1.358 CNC(=O)c1cc(cc(c1)I)C 527a_100102657272_100000729426 [1,1,0,0,0,0|2,0,0]=4 614 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl 11a_106832991635_100012047205 [1,1,0,0,0,0|1,1,0]=4 615 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl 1626a_100102657272_100012047205 [1,1,0,0,0,0|1,1,0]=4 616 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl 240690a_100102657272_100012047205 [1,1,0,0,0,0|1,1,0]=4 617 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl 527a_100102657272_100012047205 [1,1,0,0,0,0|1,1,0]=4 618 B12R1.358 CNC(=O)c1cc(cc(c1)I)F 11a_106832991635_100012047268 [1,1,0,0,0,0|1,1,0]=4 619 B12R1.358 CNC(=O)c1cc(cc(c1)I)F 1626a_100102657272_100012047268 [1,1,0,0,0,0|1,1,0]=4 620 B12R1.358 CNC(=O)c1cc(cc(c1)I)F 240690a_100102657272_100012047268 [1,1,0,0,0,0|1,1,0]=4 621 B12R1.358 CNC(=O)c1cc(cc(c1)I)F 527a_100102657272_100012047268 [1,1,0,0,0,0|1,1,0]=4 622 B12R1.358 CNC(=O)c1cc(cc(c1)I)I 11a_106832991635_100011204819 [1,1,0,0,0,0|1,0,0]=3 623 B12R1.358 CNC(=O)c1cc(cc(c1)I)I 1626a_100102657272_100011204819 [1,1,0,0,0,0|1,0,0]=3 624 B12R1.358 CNC(=O)c1cc(cc(c1)I)I 240690a_100102657272_100011204819 [1,1,0,0,0,0|1,0,0]=3 625 B12R1.358 CNC(=O)c1cc(cc(c1)I)I 527a_100102657272_100011204819 [1,1,0,0,0,0|1,0,0]=3 626 B12R1.358 COC(=O)c1cc(cc(c1)Br)O 271570a_203496583355_100012339729 [1,1,0,0,0,0|1,1,0]=4 627 B12R1.358 COC(=O)c1cc(cc(c1)Cl)O 271570a_203496583355_100000695173 [1,1,0,0,0,0|1,1,0]=4 628 B12R1.358 COC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100000698578 [1,1,0,0,0,0|1,1,0]=4 629 B12R1.358 COC(=O)c1cc(cc(c1)O)C 271570a_203496583355_100012359405 [1,1,0,0,0,0|2,0,0]=4 630 B12R1.358 COC(=O)c1cc(cc(c1)O)N 271570a_203496583355_100138415615 [1,1,0,0,0,0|2,0,0]=4 631 B12R1.358 COC(=O)c1cc(cc(c1)O)O 271570a_203496583355_100000696291 [1,1,0,0,0,0|2,0,0]=4 632 B12R1.358 Cc1cc(cc(c1)C(=O)CF)I 1458a_100000729426_100015361967 [1,1,0,0,0,0|2,0,0]=4 633 B12R1.358 O=C(CF)c1cc(cc(c1)I)Br 1458a_100000689235_100015361967 [1,1,0,0,0,0|1,1,0]=4 634 B12R1.358 O=C(CF)c1cc(cc(c1)I)Cl 1458a_100012047205_100015361967 [1,1,0,0,0,0|1,1,0]=4 635 B12R1.358 O=C(CF)c1cc(cc(c1)I)F 1458a_100012047268_100015361967 [1,1,0,0,0,0|1,1,0]=4 636 B12R1.358 O=C(CF)c1cc(cc(c1)I)I 1458a_100011204819_100015361967 [1,1,0,0,0,0|1,0,0]=3 637 B12R1.1005 CC(=O)c1cc(c(c(c1)I)C)F 1458a_100012344050_200000210301 [1,1,0,0,0,0|1,1,0]=4 638 B12R1.1005 CC(=O)c1cc(c(c(c1)I)I)I 1458a_100000033816_200000210301 [1,1,0,0,0,0|1,0,0]=3 639 B12R1.1005 CC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_200000210301 [1,1,0,0,0,0|1,0,0]=3 640 B12R1.1005 Cc1c(cc(cc1I)C(=O)[13CH3])F 1458a_100012344050_200025704644 [1,1,0,0,0,0|1,1,0]=4 641 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)I)I)I 1458a_100000033816_200025704644 [1,1,0,0,0,0|1,0,0]=3 642 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_200025704644 [1,1,0,0,0,0|1,0,0]=3 643 B12R1.24 CCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210202 [1,1,0,0,0,0|2,0,0]=4 644 B12R1.24 CCC(=O)c1cccc(c1C)I 1458a_100000751865_100000210202 [1,1,0,0,0,0|2,0,0]=4 645 B12R1.24 CCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210202 [1,1,0,0,0,0|2,0,0]=4 646 B12R1.24 CCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210202 [1,1,0,0,0,0|2,0,0]=4 647 B12R1.24 CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210202 [1,1,0,0,0,0|1,1,0]=4 648 B12R1.24 CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210202 [1,1,0,0,0,0|2,0,0]=4 649 B12R1.24 CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210202 [1,1,0,0,0,0|1,1,0]=4 650 B12R1.24 CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210202 [1,1,0,0,0,0|1,1,0]=4 651 B12R1.24 CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210202 [1,1,0,0,0,0|2,0,0]=4 652 B12R1.24 CNC(=O)c1cccc(c1Br)I 11a_106832991635_100010232522 [1,1,0,0,0,0|2,0,0]=4 653 B12R1.24 CNC(=O)c1cccc(c1Br)I 1626a_100102657272_100010232522 [1,1,0,0,0,0|2,0,0]=4 654 B12R1.24 CNC(=O)c1cccc(c1Br)I 240690a_100102657272_100010232522 [1,1,0,0,0,0|2,0,0]=4 655 B12R1.24 CNC(=O)c1cccc(c1Br)I 527a_100102657272_100010232522 [1,1,0,0,0,0|2,0,0]=4 656 B12R1.24 CNC(=O)c1cccc(c1C)I 11a_106832991635_100000751865 [1,1,0,0,0,0|2,0,0]=4 657 B12R1.24 CNC(=O)c1cccc(c1C)I 1626a_100102657272_100000751865 [1,1,0,0,0,0|2,0,0]=4 658 B12R1.24 CNC(=O)c1cccc(c1C)I 240690a_100102657272_100000751865 [1,1,0,0,0,0|2,0,0]=4 659 B12R1.24 CNC(=O)c1cccc(c1C)I 527a_100102657272_100000751865 [1,1,0,0,0,0|2,0,0]=4 660 B12R1.24 CNC(=O)c1cccc(c1Cl)I 11a_106832991635_100010176783 [1,1,0,0,0,0|2,0,0]=4 661 B12R1.24 CNC(=O)c1cccc(c1Cl)I 1626a_100102657272_100010176783 [1,1,0,0,0,0|2,0,0]=4 662 B12R1.24 CNC(=O)c1cccc(c1Cl)I 240690a_100102657272_100010176783 [1,1,0,0,0,0|2,0,0]=4 663 B12R1.24 CNC(=O)c1cccc(c1Cl)I 527a_100102657272_100010176783 [1,1,0,0,0,0|2,0,0]=4 664 B12R1.24 CNC(=O)c1cccc(c1F)I 11a_106832991635_100010185205 [1,1,0,0,0,0|2,0,0]=4 665 B12R1.24 CNC(=O)c1cccc(c1F)I 1626a_100102657272_100010185205 [1,1,0,0,0,0|2,0,0]=4 666 B12R1.24 CNC(=O)c1cccc(c1F)I 240690a_100102657272_100010185205 [1,1,0,0,0,0|2,0,0]=4 667 B12R1.24 CNC(=O)c1cccc(c1F)I 527a_100102657272_100010185205 [1,1,0,0,0,0|2,0,0]=4 668 B12R1.24 CNC(=O)c1cccc(c1O)Br 240690a_100102657272_100000752940 [1,1,0,0,0,0|1,1,0]=4 669 B12R1.24 CNC(=O)c1cccc(c1O)Br 527a_100102657272_100000752940 [1,1,0,0,0,0|1,1,0]=4 670 B12R1.24 CNC(=O)c1cccc(c1O)C 240690a_100102657272_100000183896 [1,1,0,0,0,0|2,0,0]=4 671 B12R1.24 CNC(=O)c1cccc(c1O)C 527a_100102657272_100000183896 [1,1,0,0,0,0|2,0,0]=4 672 B12R1.24 CNC(=O)c1cccc(c1O)Cl 240690a_100102657272_100000742801 [1,1,0,0,0,0|1,1,0]=4 673 B12R1.24 CNC(=O)c1cccc(c1O)Cl 527a_100102657272_100000742801 [1,1,0,0,0,0|1,1,0]=4 674 B12R1.24 CNC(=O)c1cccc(c1O)F 240690a_100102657272_100011217230 [1,1,0,0,0,0|1,1,0]=4 675 B12R1.24 CNC(=O)c1cccc(c1O)F 527a_100102657272_100011217230 [1,1,0,0,0,0|1,1,0]=4 676 B12R1.24 CNC(=O)c1cccc(c1O)O 527a_100102657272_100000690420 [1,1,0,0,0,0|2,0,0]=4 677 B12R1.24 COC(=O)c1cccc(c1Br)O 271570a_203496583355_100010240208 [1,1,0,0,0,0|2,0,0]=4 678 B12R1.24 COC(=O)c1cccc(c1C)O 271570a_203496583355_100012298220 [1,1,0,0,0,0|2,0,0]=4 679 B12R1.24 COC(=O)c1cccc(c1F)O 271570a_203496583355_100012355674 [1,1,0,0,0,0|2,0,0]=4 680 B12R1.24 COC(=O)c1cccc(c1N)O 271570a_203496583355_100011356556 [1,1,0,0,0,0|2,0,0]=4 681 B12R1.24 COC(=O)c1cccc(c1O)Br 271570a_203496583355_100010150843 [1,1,0,0,0,0|0,1,0]=3 682 B12R1.24 COC(=O)c1cccc(c1O)C 271570a_203496583355_100012002529 [1,1,0,0,0,0|1,0,0]=3 683 B12R1.24 COC(=O)c1cccc(c1O)F 271570a_203496583355_100012357630 [1,1,0,0,0,0|0,1,0]=3 684 B12R1.24 COC(=O)c1cccc(c1O)N 271570a_203496583355_100000719424 [1,1,0,0,0,0|1,0,0]=3 685 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_100009816214 [1,1,0,0,0,0|1,0,0]=3 686 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_200010230364 [1,1,0,0,0,0|1,0,0]=3 687 B12R1.24 Cc1c(cccc1C(=O)CF)I 1458a_100000751865_100015361967 [1,1,0,0,0,0|2,0,0]=4 688 B12R1.24 Cc1cccc(c1O)C(=O)CF 1458a_100000183896_100015361967 [1,1,0,0,0,0|2,0,0]=4 689 B12R1.24 O=C(CF)c1cccc(c1Br)I 1458a_100010232522_100015361967 [1,1,0,0,0,0|2,0,0]=4 690 B12R1.24 O=C(CF)c1cccc(c1Cl)I 1458a_100010176783_100015361967 [1,1,0,0,0,0|2,0,0]=4 691 B12R1.24 O=C(CF)c1cccc(c1F)I 1458a_100010185205_100015361967 [1,1,0,0,0,0|2,0,0]=4 692 B12R1.24 O=C(CF)c1cccc(c1O)Br 1458a_100000752940_100015361967 [1,1,0,0,0,0|1,1,0]=4 693 B12R1.24 O=C(CF)c1cccc(c1O)Cl 1458a_100000742801_100015361967 [1,1,0,0,0,0|1,1,0]=4 694 B12R1.24 O=C(CF)c1cccc(c1O)F 1458a_100011217230_100015361967 [1,1,0,0,0,0|1,1,0]=4 695 B12R1.24 O=C(CF)c1cccc(c1O)O 1458a_100000690420_100015361967 [1,1,0,0,0,0|2,0,0]=4 696 B12R1.87 CC(=O)c1cccc(c1O[13CH3])C 34a_100009847209_200025704644 [1,1,0,0,0,0|2,0,0]=4 697 B12R1.87 CC(=O)c1cccc(c1O[13CH3])C 7a_100009847209_200025704644 [1,1,0,0,0,0|2,0,0]=4 698 B12R1.87 CC(=O)c1cccc(c1O[13CH3])Cl 34a_100000043392_200025704644 [1,1,0,0,0,0|1,1,0]=4 699 B12R1.87 CC(=O)c1cccc(c1O[13CH3])Cl 7a_100000043392_200025704644 [1,1,0,0,0,0|1,1,0]=4 700 B12R1.87 CC(=O)c1cccc(c1O[13CH3])F 34a_100011246037_200025704644 [1,1,0,0,0,0|1,1,0]=4 701 B12R1.87 CC(=O)c1cccc(c1O[13CH3])F 7a_100011246037_200025704644 [1,1,0,0,0,0|1,1,0]=4 702 B12R1.87 COc1c(cccc1C(=O)C)Br 1458a_100000689802_200000210301 [1,1,0,0,0,0|1,1,0]=4 703 B12R1.87 COc1c(cccc1C(=O)C)C 1458a_100000187929_200000210301 [1,1,0,0,0,0|2,0,0]=4 704 B12R1.87 COc1c(cccc1C(=O)C)C 34a_100009847209_200000210301 [1,1,0,0,0,0|2,0,0]=4 705 B12R1.87 COc1c(cccc1C(=O)C)C 7a_100009847209_200000210301 [1,1,0,0,0,0|2,0,0]=4 706 B12R1.87 COc1c(cccc1C(=O)C)Cl 1458a_100011934004_200000210301 [1,1,0,0,0,0|1,1,0]=4 707 B12R1.87 COc1c(cccc1C(=O)C)Cl 34a_100000043392_200000210301 [1,1,0,0,0,0|1,1,0]=4 708 B12R1.87 COc1c(cccc1C(=O)C)Cl 7a_100000043392_200000210301 [1,1,0,0,0,0|1,1,0]=4 709 B12R1.87 COc1c(cccc1C(=O)C)F 1458a_100011218433_200000210301 [1,1,0,0,0,0|1,1,0]=4 710 B12R1.87 COc1c(cccc1C(=O)C)F 34a_100011246037_200000210301 [1,1,0,0,0,0|1,1,0]=4 711 B12R1.87 COc1c(cccc1C(=O)C)F 7a_100011246037_200000210301 [1,1,0,0,0,0|1,1,0]=4 712 B12R1.87 COc1c(cccc1C(=O)C)O 1458a_100000080799_200000210301 [1,1,0,0,0,0|2,0,0]=4 713 B12R1.87 COc1c(cccc1C(=O)C)O 271570a_203496583355_100010725610 [1,1,0,0,0,0|2,0,0]=4 714 B12R1.87 COc1c(cccc1C(=O)N)Cl 34a_100009868166_200000210301 [1,1,0,0,0,0|1,1,0]=4 715 B12R1.87 COc1c(cccc1C(=O)N)Cl 7a_100009868166_200000210301 [1,1,0,0,0,0|1,1,0]=4 716 B12R1.87 COc1c(cccc1C(=O)N)F 34a_100009886295_200000210301 [1,1,0,0,0,0|1,1,0]=4 717 B12R1.87 COc1c(cccc1C(=O)N)F 7a_100009886295_200000210301 [1,1,0,0,0,0|1,1,0]=4 718 B12R1.87 COc1c(cccc1C(=O)N)O 271570a_203496583355_100010146779 [1,1,0,0,0,0|2,0,0]=4 719 B12R1.87 COc1c(cccc1C(=O)[13CH3])Br 1458a_100000689802_200025704644 [1,1,0,0,0,0|1,1,0]=4 720 B12R1.87 COc1c(cccc1C(=O)[13CH3])C 1458a_100000187929_200025704644 [1,1,0,0,0,0|2,0,0]=4 721 B12R1.87 COc1c(cccc1C(=O)[13CH3])Cl 1458a_100011934004_200025704644 [1,1,0,0,0,0|1,1,0]=4 722 B12R1.87 COc1c(cccc1C(=O)[13CH3])F 1458a_100011218433_200025704644 [1,1,0,0,0,0|1,1,0]=4 723 B12R1.87 COc1c(cccc1C(=O)[13CH3])O 1458a_100000080799_200025704644 [1,1,0,0,0,0|2,0,0]=4 724 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)Cl 34a_100009868166_200025704644 [1,1,0,0,0,0|1,1,0]=4 725 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)Cl 7a_100009868166_200025704644 [1,1,0,0,0,0|1,1,0]=4 726 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)F 34a_100009886295_200025704644 [1,1,0,0,0,0|1,1,0]=4 727 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)F 7a_100009886295_200025704644 [1,1,0,0,0,0|1,1,0]=4 728 B12R1.440 C=Cc1cccc(c1O)C(=O)C 271570a_100011290941_100009815558 [1,1,0,0,0,0|2,0,0]=4 729 B12R1.440 CC(=O)c1cccc(c1O)C#N 1458a_100009886288_200000210301 [1,1,0,0,0,0|2,0,0]=4 730 B12R1.440 COc1cccc(c1O)C(=O)C 1458a_100000212136_200000210301 [1,1,0,0,0,0|2,0,0]=4 731 B12R1.440 COc1cccc(c1O)C(=O)[13CH3] 1458a_100000212136_200025704644 [1,1,0,0,0,0|2,0,0]=4 732 B12R1.440 [13CH3]C(=O)c1cccc(c1O)C#N 1458a_100009886288_200025704644 [1,1,0,0,0,0|2,0,0]=4 733 B12R1.893 CC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_200000210301 [1,1,0,0,0,0|2,0,0]=4 734 B12R1.893 CC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_200000210301 [1,1,0,0,0,0|1,1,0]=4 735 B12R1.893 CC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_200000210301 [1,1,0,0,0,0|1,1,0]=4 736 B12R1.893 CC(=O)c1ccc(c(c1O)F)F 271570a_203496583355_200013857550 [1,1,0,0,0,0|1,1,0]=4 737 B12R1.893 CC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200000210301 [1,1,0,0,0,0|2,0,0]=4 738 B12R1.893 Cc1ccc(c(c1C)O)C(=O)[13CH3] 1458a_100000742916_200025704644 [1,1,0,0,0,0|2,0,0]=4 739 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_200025704644 [1,1,0,0,0,0|1,1,0]=4 740 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)F)F 1458a_100011799213_200025704644 [1,1,0,0,0,0|1,1,0]=4 741 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200025704644 [1,1,0,0,0,0|2,0,0]=4 742 B12R1.894 CC(=O)c1c(ccc(c1F)I)Br 1458a_100010782274_200000210301 [1,1,0,0,0,0|2,0,0]=4 743 B12R1.894 CC(=O)c1c(ccc(c1F)I)Cl 1458a_100021583479_200000210301 [1,1,0,0,0,0|2,0,0]=4 744 B12R1.894 CC(=O)c1c(ccc(c1F)I)F 1458a_100012359589_200000210301 [1,1,0,0,0,0|2,0,0]=4 745 B12R1.894 CC(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_200000210301 [1,1,0,0,0,0|1,1,0]=4 746 B12R1.894 CC(=O)c1c(ccc(c1O)C)C 1458a_100011255215_200000210301 [1,1,0,0,0,0|2,0,0]=4 747 B12R1.894 CC(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_200000210301 [1,1,0,0,0,0|1,1,0]=4 748 B12R1.894 CC(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_200000210301 [1,1,0,0,0,0|1,1,0]=4 749 B12R1.894 CC(=O)c1c(ccc(c1O)F)F 1458a_100011830443_200000210301 [1,1,0,0,0,0|1,1,0]=4 750 B12R1.894 Cc1ccc(c(c1O)C(=O)[13CH3])C 1458a_100011255215_200025704644 [1,1,0,0,0,0|2,0,0]=4 751 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)I)Br 1458a_100010782274_200025704644 [1,1,0,0,0,0|2,0,0]=4 752 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)I)Cl 1458a_100021583479_200025704644 [1,1,0,0,0,0|2,0,0]=4 753 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)I)F 1458a_100012359589_200025704644 [1,1,0,0,0,0|2,0,0]=4 754 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_200025704644 [1,1,0,0,0,0|1,1,0]=4 755 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_200025704644 [1,1,0,0,0,0|1,1,0]=4 756 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_200025704644 [1,1,0,0,0,0|1,1,0]=4 757 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)F)F 1458a_100011830443_200025704644 [1,1,0,0,0,0|1,1,0]=4 758 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])Br 34a_100000212127_200025704644 [1,1,0,0,0,0|1,1,0]=4 759 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])Br 7a_100000212127_200025704644 [1,1,0,0,0,0|1,1,0]=4 760 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])C 34a_100000195442_200025704644 [1,1,0,0,0,0|2,0,0]=4 761 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])C 7a_100000195442_200025704644 [1,1,0,0,0,0|2,0,0]=4 762 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])Cl 34a_100000185566_200025704644 [1,1,0,0,0,0|1,1,0]=4 763 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])Cl 7a_100000185566_200025704644 [1,1,0,0,0,0|1,1,0]=4 764 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])F 7a_100000182812_200025704644 [1,1,0,0,0,0|1,1,0]=4 765 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])I 7a_100010712555_200025704644 [1,1,0,0,0,0|1,0,0]=3 766 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])N 34a_100011218865_200025704644 [1,1,0,0,0,0|2,0,0]=4 767 B12R1.46 COc1ccc(cc1C(=O)C)Br 1458a_100000188853_200000210301 [1,1,0,0,0,0|1,1,0]=4 768 B12R1.46 COc1ccc(cc1C(=O)C)Br 34a_100000212127_200000210301 [1,1,0,0,0,0|1,1,0]=4 769 B12R1.46 COc1ccc(cc1C(=O)C)Br 7a_100000212127_200000210301 [1,1,0,0,0,0|1,1,0]=4 770 B12R1.46 COc1ccc(cc1C(=O)C)C 1458a_100000204667_200000210301 [1,1,0,0,0,0|2,0,0]=4 771 B12R1.46 COc1ccc(cc1C(=O)C)C 34a_100000195442_200000210301 [1,1,0,0,0,0|2,0,0]=4 772 B12R1.46 COc1ccc(cc1C(=O)C)C 7a_100000195442_200000210301 [1,1,0,0,0,0|2,0,0]=4 773 B12R1.46 COc1ccc(cc1C(=O)C)Cl 1458a_100000211409_200000210301 [1,1,0,0,0,0|1,1,0]=4 774 B12R1.46 COc1ccc(cc1C(=O)C)Cl 34a_100000185566_200000210301 [1,1,0,0,0,0|1,1,0]=4 775 B12R1.46 COc1ccc(cc1C(=O)C)Cl 7a_100000185566_200000210301 [1,1,0,0,0,0|1,1,0]=4 776 B12R1.46 COc1ccc(cc1C(=O)C)F 1458a_100000735445_200000210301 [1,1,0,0,0,0|1,1,0]=4 777 B12R1.46 COc1ccc(cc1C(=O)C)F 7a_100000182812_200000210301 [1,1,0,0,0,0|1,1,0]=4 778 B12R1.46 COc1ccc(cc1C(=O)C)I 1458a_100000230898_200000210301 [1,1,0,0,0,0|1,0,0]=3 779 B12R1.46 COc1ccc(cc1C(=O)C)I 7a_100010712555_200000210301 [1,1,0,0,0,0|1,0,0]=3 780 B12R1.46 COc1ccc(cc1C(=O)C)N 34a_100011218865_200000210301 [1,1,0,0,0,0|2,0,0]=4 781 B12R1.46 COc1ccc(cc1C(=O)C)O 1458a_200000100057_200000210301 [1,1,0,0,0,0|2,0,0]=4 782 B12R1.46 COc1ccc(cc1C(=O)C)O 271570a_203496583355_100000173343 [1,1,0,0,0,0|2,0,0]=4 783 B12R1.46 COc1ccc(cc1C(=O)N)Br 34a_100000192807_200000210301 [1,1,0,0,0,0|1,1,0]=4 784 B12R1.46 COc1ccc(cc1C(=O)N)Br 7a_100000192807_200000210301 [1,1,0,0,0,0|1,1,0]=4 785 B12R1.46 COc1ccc(cc1C(=O)N)C 34a_200000192840_200000210301 [1,1,0,0,0,0|2,0,0]=4 786 B12R1.46 COc1ccc(cc1C(=O)N)C 7a_200000192840_200000210301 [1,1,0,0,0,0|2,0,0]=4 787 B12R1.46 COc1ccc(cc1C(=O)N)Cl 34a_100000185026_200000210301 [1,1,0,0,0,0|1,1,0]=4 788 B12R1.46 COc1ccc(cc1C(=O)N)Cl 7a_100000185026_200000210301 [1,1,0,0,0,0|1,1,0]=4 789 B12R1.46 COc1ccc(cc1C(=O)N)F 34a_100012186459_200000210301 [1,1,0,0,0,0|1,1,0]=4 790 B12R1.46 COc1ccc(cc1C(=O)N)F 7a_100012186459_200000210301 [1,1,0,0,0,0|1,1,0]=4 791 B12R1.46 COc1ccc(cc1C(=O)N)I 34a_100000192813_200000210301 [1,1,0,0,0,0|1,0,0]=3 792 B12R1.46 COc1ccc(cc1C(=O)N)I 7a_100000192813_200000210301 [1,1,0,0,0,0|1,0,0]=3 793 B12R1.46 COc1ccc(cc1C(=O)[13CH3])Br 1458a_100000188853_200025704644 [1,1,0,0,0,0|1,1,0]=4 794 B12R1.46 COc1ccc(cc1C(=O)[13CH3])C 1458a_100000204667_200025704644 [1,1,0,0,0,0|2,0,0]=4 795 B12R1.46 COc1ccc(cc1C(=O)[13CH3])Cl 1458a_100000211409_200025704644 [1,1,0,0,0,0|1,1,0]=4 796 B12R1.46 COc1ccc(cc1C(=O)[13CH3])F 1458a_100000735445_200025704644 [1,1,0,0,0,0|1,1,0]=4 797 B12R1.46 COc1ccc(cc1C(=O)[13CH3])I 1458a_100000230898_200025704644 [1,1,0,0,0,0|1,0,0]=3 798 B12R1.46 COc1ccc(cc1C(=O)[13CH3])O 1458a_200000100057_200025704644 [1,1,0,0,0,0|2,0,0]=4 799 B12R1.46 COc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_200000210301 [1,1,0,0,0,0|1,0,1]=4 800 B12R1.46 CSc1ccc(cc1C(=O)O)Br 62a_100011072988_200000210301 [1,1,0,0,0,0|0,2,0]=4 801 B12R1.46 Cc1ccc(c(c1)C(=O)N)O[13CH3] 34a_200000192840_200025704644 [1,1,0,0,0,0|2,0,0]=4 802 B12R1.46 Cc1ccc(c(c1)C(=O)N)O[13CH3] 7a_200000192840_200025704644 [1,1,0,0,0,0|2,0,0]=4 803 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)Br 34a_100000192807_200025704644 [1,1,0,0,0,0|1,1,0]=4 804 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)Br 7a_100000192807_200025704644 [1,1,0,0,0,0|1,1,0]=4 805 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)Cl 34a_100000185026_200025704644 [1,1,0,0,0,0|1,1,0]=4 806 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)Cl 7a_100000185026_200025704644 [1,1,0,0,0,0|1,1,0]=4 807 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)F 34a_100012186459_200025704644 [1,1,0,0,0,0|1,1,0]=4 808 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)F 7a_100012186459_200025704644 [1,1,0,0,0,0|1,1,0]=4 809 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)I 34a_100000192813_200025704644 [1,1,0,0,0,0|1,0,0]=3 810 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)I 7a_100000192813_200025704644 [1,1,0,0,0,0|1,0,0]=3 811 B12R1.46 [13CH3]Oc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_200025704644 [1,1,0,0,0,0|1,0,1]=4 812 B12R1.46 [13CH3]Sc1ccc(cc1C(=O)O)Br 62a_100011072988_200025704644 [1,1,0,0,0,0|0,2,0]=4 813 B12R1.232 CC(=O)c1cc(c(cc1C)C)I 1458a_100000723791_200000210301 [1,1,0,0,0,0|2,0,0]=4 814 B12R1.232 CC(=O)c1cc(c(cc1C)F)I 1458a_100013328184_200000210301 [1,1,0,0,0,0|2,0,0]=4 815 B12R1.232 CC(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_200000210301 [1,1,0,0,0,0|2,0,0]=4 816 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_200000210301 [1,1,0,0,0,0|2,0,0]=4 817 B12R1.232 CC(=O)c1cc(c(cc1F)F)I 1458a_100000691139_200000210301 [1,1,0,0,0,0|2,0,0]=4 818 B12R1.232 CC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_200000210301 [1,1,0,0,0,0|1,1,0]=4 819 B12R1.232 CC(=O)c1cc(c(cc1O)C)Br 1458a_100010233826_200000210301 [1,1,0,0,0,0|1,1,0]=4 820 B12R1.232 CC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_200000210301 [1,1,0,0,0,0|2,0,0]=4 821 B12R1.232 CC(=O)c1cc(c(cc1O)C)O 271570a_203496583355_200010233951 [1,1,0,0,0,0|2,0,0]=4 822 B12R1.232 CC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_200000210301 [1,1,0,0,0,0|1,1,0]=4 823 B12R1.232 CC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_200000210301 [1,1,0,0,0,0|1,1,0]=4 824 B12R1.232 CC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_200000210301 [1,1,0,0,0,0|1,1,0]=4 825 B12R1.232 CC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_200000210301 [1,1,0,0,0,0|1,1,0]=4 826 B12R1.232 CC(=O)c1cc(c(cc1O)F)F 271570a_203496583355_100013243444 [1,1,0,0,0,0|1,1,0]=4 827 B12R1.232 CC(=O)c1cc(c(cc1O)F)O 271570a_203496583355_100000691652 [1,1,0,0,0,0|2,0,0]=4 828 B12R1.232 CC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_200000210301 [1,1,0,0,0,0|1,1,0]=4 829 B12R1.232 CC(=O)c1cc(c(cc1O)O)C 271570a_203496583355_100009816031 [1,1,0,0,0,0|2,0,0]=4 830 B12R1.232 CC(=O)c1cc(c(cc1O)O)F 271570a_203496583355_200010245088 [1,1,0,0,0,0|1,1,0]=4 831 B12R1.232 Cc1cc(c(cc1Br)C(=O)[13CH3])O 1458a_100010233826_200025704644 [1,1,0,0,0,0|1,1,0]=4 832 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])I)F 1458a_100013328184_200025704644 [1,1,0,0,0,0|2,0,0]=4 833 B12R1.232 Cc1cc(c(cc1C)C(=O)[13CH3])O 1458a_100009831561_200025704644 [1,1,0,0,0,0|2,0,0]=4 834 B12R1.232 Cc1cc(c(cc1I)C(=O)[13CH3])C 1458a_100000723791_200025704644 [1,1,0,0,0,0|2,0,0]=4 835 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_200025704644 [1,1,0,0,0,0|2,0,0]=4 836 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_200025704644 [1,1,0,0,0,0|2,0,0]=4 837 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)I 1458a_100000691139_200025704644 [1,1,0,0,0,0|2,0,0]=4 838 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_200025704644 [1,1,0,0,0,0|1,1,0]=4 839 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_200025704644 [1,1,0,0,0,0|1,1,0]=4 840 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_200025704644 [1,1,0,0,0,0|1,1,0]=4 841 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_200025704644 [1,1,0,0,0,0|1,1,0]=4 842 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)F 1458a_100012182723_200025704644 [1,1,0,0,0,0|1,1,0]=4 843 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_200025704644 [1,1,0,0,0,0|1,1,0]=4 844 B12R1.354 CCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210202 [1,1,0,0,0,0|2,0,0]=4 845 B12R1.354 CCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000210202 [1,1,0,0,0,0|2,0,0]=4 846 B12R1.354 CCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210202 [1,1,0,0,0,0|2,0,0]=4 847 B12R1.354 CCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210202 [1,1,0,0,0,0|2,0,0]=4 848 B12R1.354 CCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210202 [1,1,0,0,0,0|2,0,0]=4 849 B12R1.354 CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210202 [1,1,0,0,0,0|1,1,0]=4 850 B12R1.354 CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210202 [1,1,0,0,0,0|2,0,0]=4 851 B12R1.354 CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210202 [1,1,0,0,0,0|1,1,0]=4 852 B12R1.354 CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210202 [1,1,0,0,0,0|1,1,0]=4 853 B12R1.354 CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210202 [1,1,0,0,0,0|1,0,0]=3 854 B12R1.354 CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210202 [1,1,0,0,0,0|2,0,0]=4 855 B12R1.354 CCC(=O)c1cc(ccc1O)O 271570a_203496583355_100000183607 [1,1,0,0,0,0|2,0,0]=4 856 B12R1.354 CNC(=O)c1cc(ccc1Br)I 11a_106832991635_100000698340 [1,1,0,0,0,0|2,0,0]=4 857 B12R1.354 CNC(=O)c1cc(ccc1Br)I 1626a_100102657272_100000698340 [1,1,0,0,0,0|2,0,0]=4 858 B12R1.354 CNC(=O)c1cc(ccc1Br)I 240690a_100102657272_100000698340 [1,1,0,0,0,0|2,0,0]=4 859 B12R1.354 CNC(=O)c1cc(ccc1Br)I 527a_100102657272_100000698340 [1,1,0,0,0,0|2,0,0]=4 860 B12R1.354 CNC(=O)c1cc(ccc1C)I 11a_106832991635_100000688012 [1,1,0,0,0,0|2,0,0]=4 861 B12R1.354 CNC(=O)c1cc(ccc1C)I 1626a_100102657272_100000688012 [1,1,0,0,0,0|2,0,0]=4 862 B12R1.354 CNC(=O)c1cc(ccc1C)I 240690a_100102657272_100000688012 [1,1,0,0,0,0|2,0,0]=4 863 B12R1.354 CNC(=O)c1cc(ccc1C)I 527a_100102657272_100000688012 [1,1,0,0,0,0|2,0,0]=4 864 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 11a_106832991635_100000688013 [1,1,0,0,0,0|2,0,0]=4 865 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 1626a_100102657272_100000688013 [1,1,0,0,0,0|2,0,0]=4 866 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 240690a_100102657272_100000688013 [1,1,0,0,0,0|2,0,0]=4 867 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 527a_100102657272_100000688013 [1,1,0,0,0,0|2,0,0]=4 868 B12R1.354 CNC(=O)c1cc(ccc1F)I 11a_106832991635_100000688014 [1,1,0,0,0,0|2,0,0]=4 869 B12R1.354 CNC(=O)c1cc(ccc1F)I 1626a_100102657272_100000688014 [1,1,0,0,0,0|2,0,0]=4 870 B12R1.354 CNC(=O)c1cc(ccc1F)I 240690a_100102657272_100000688014 [1,1,0,0,0,0|2,0,0]=4 871 B12R1.354 CNC(=O)c1cc(ccc1F)I 527a_100102657272_100000688014 [1,1,0,0,0,0|2,0,0]=4 872 B12R1.354 CNC(=O)c1cc(ccc1I)I 11a_106832991635_100000750460 [1,1,0,0,0,0|2,0,0]=4 873 B12R1.354 CNC(=O)c1cc(ccc1I)I 1626a_100102657272_100000750460 [1,1,0,0,0,0|2,0,0]=4 874 B12R1.354 CNC(=O)c1cc(ccc1I)I 240690a_100102657272_100000750460 [1,1,0,0,0,0|2,0,0]=4 875 B12R1.354 CNC(=O)c1cc(ccc1I)I 527a_100102657272_100000750460 [1,1,0,0,0,0|2,0,0]=4 876 B12R1.354 CNC(=O)c1cc(ccc1O)Br 1626a_100102657272_100000212140 [1,1,0,0,0,0|1,1,0]=4 877 B12R1.354 CNC(=O)c1cc(ccc1O)Br 240690a_100102657272_100000212140 [1,1,0,0,0,0|1,1,0]=4 878 B12R1.354 CNC(=O)c1cc(ccc1O)Br 527a_100102657272_100000212140 [1,1,0,0,0,0|1,1,0]=4 879 B12R1.354 CNC(=O)c1cc(ccc1O)C 240690a_100102657272_100000229998 [1,1,0,0,0,0|2,0,0]=4 880 B12R1.354 CNC(=O)c1cc(ccc1O)C 527a_100102657272_100000229998 [1,1,0,0,0,0|2,0,0]=4 881 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 11a_106832991635_100000212143 [1,1,0,0,0,0|1,1,0]=4 882 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 1626a_100102657272_100000212143 [1,1,0,0,0,0|1,1,0]=4 883 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 240690a_100102657272_100000212143 [1,1,0,0,0,0|1,1,0]=4 884 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 271570a_203496583355_200011279454 [1,1,0,0,0,0|1,1,0]=4 885 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 527a_100102657272_100000212143 [1,1,0,0,0,0|1,1,0]=4 886 B12R1.354 CNC(=O)c1cc(ccc1O)F 240690a_100102657272_100000742286 [1,1,0,0,0,0|1,1,0]=4 887 B12R1.354 CNC(=O)c1cc(ccc1O)F 271570a_203496583355_200000206232 [1,1,0,0,0,0|1,1,0]=4 888 B12R1.354 CNC(=O)c1cc(ccc1O)F 527a_100102657272_100000742286 [1,1,0,0,0,0|1,1,0]=4 889 B12R1.354 CNC(=O)c1cc(ccc1O)I 240690a_100102657272_100000212111 [1,1,0,0,0,0|1,0,0]=3 890 B12R1.354 CNC(=O)c1cc(ccc1O)I 527a_100102657272_100000212111 [1,1,0,0,0,0|1,0,0]=3 891 B12R1.354 COC(=O)c1cc(ccc1Br)O 271570a_203496583355_100012340073 [1,1,0,0,0,0|2,0,0]=4 892 B12R1.354 COC(=O)c1cc(ccc1C)O 271570a_203496583355_100012360116 [1,1,0,0,0,0|2,0,0]=4 893 B12R1.354 COC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100012353682 [1,1,0,0,0,0|2,0,0]=4 894 B12R1.354 COC(=O)c1cc(ccc1F)O 271570a_203496583355_100000154357 [1,1,0,0,0,0|2,0,0]=4 895 B12R1.354 COC(=O)c1cc(ccc1N)O 271570a_203496583355_100000212070 [1,1,0,0,0,0|2,0,0]=4 896 B12R1.354 COC(=O)c1cc(ccc1O)Br 271570a_203496583355_100000148213 [1,1,0,0,0,0|0,1,0]=3 897 B12R1.354 COC(=O)c1cc(ccc1O)C 271570a_203496583355_100012339458 [1,1,0,0,0,0|1,0,0]=3 898 B12R1.354 COC(=O)c1cc(ccc1O)Cl 271570a_203496583355_100011294804 [1,1,0,0,0,0|0,1,0]=3 899 B12R1.354 COC(=O)c1cc(ccc1O)F 271570a_203496583355_100000205820 [1,1,0,0,0,0|0,1,0]=3 900 B12R1.354 COC(=O)c1cc(ccc1O)N 271570a_203496583355_100000696289 [1,1,0,0,0,0|1,0,0]=3 901 B12R1.354 COC(=O)c1cc(ccc1O)O 271570a_203496583355_100000149868 [1,1,0,0,0,0|1,0,0]=3 902 B12R1.354 COC(=O)c1cc(ccc1O)O 271570a_203496583355_100010230369 [1,1,0,0,0,0|1,0,0]=3 903 B12R1.354 COC(=O)c1cc(cnc1O)C 271570a_203496583355_100000085774 [1,1,0,0,0,0|2,0,0]=4 904 B12R1.354 COC(=O)c1cc(cnc1O)F 271570a_203496583355_100012000215 [1,1,0,0,0,0|1,1,0]=4 905 B12R1.354 COC(=O)c1cc(cnc1O)N 271570a_203496583355_200012182668 [1,1,0,0,0,0|2,0,0]=4 906 B12R1.354 COC(=O)c1cc(ncc1O)N 271570a_203496583355_100011934820 [1,1,0,0,0,0|2,0,0]=4 907 B12R1.354 COC(=O)c1cc(ncc1O)O 271570a_203496583355_100009816900 [1,1,0,0,0,0|2,0,0]=4 908 B12R1.354 COC(=O)c1cc(ncc1O)O 271570a_203496583355_100010136202 [1,1,0,0,0,0|2,0,0]=4 909 B12R1.354 COC(=O)c1nc(ccc1O)N 271570a_203496583355_100009816986 [1,1,0,0,0,0|2,0,0]=4 910 B12R1.354 COC(=O)c1nc(ccc1O)O 271570a_203496583355_100000697862 [1,1,0,0,0,0|2,0,0]=4 911 B12R1.354 COC(=O)c1nc(ccc1O)O 271570a_203496583355_100010189638 [1,1,0,0,0,0|2,0,0]=4 912 B12R1.354 Cc1ccc(c(c1)C(=O)CF)O 1458a_100000229998_100015361967 [1,1,0,0,0,0|2,0,0]=4 913 B12R1.354 Cc1ccc(cc1C(=O)CF)I 1458a_100000688012_100015361967 [1,1,0,0,0,0|2,0,0]=4 914 B12R1.354 NNC(=O)c1cc(ccc1O)F 271570a_203496583355_100000205862 [1,1,0,0,0,0|1,1,0]=4 915 B12R1.354 NNC(=O)c1cc(ccc1O)O 271570a_203496583355_100000193350 [1,1,0,0,0,0|2,0,0]=4 916 B12R1.354 O=C(CF)c1cc(ccc1Br)I 1458a_100000698340_100015361967 [1,1,0,0,0,0|2,0,0]=4 917 B12R1.354 O=C(CF)c1cc(ccc1Cl)I 1458a_100000688013_100015361967 [1,1,0,0,0,0|2,0,0]=4 918 B12R1.354 O=C(CF)c1cc(ccc1F)I 1458a_100000688014_100015361967 [1,1,0,0,0,0|2,0,0]=4 919 B12R1.354 O=C(CF)c1cc(ccc1I)I 1458a_100000750460_100015361967 [1,1,0,0,0,0|2,0,0]=4 920 B12R1.354 O=C(CF)c1cc(ccc1O)Br 1458a_100000212140_100015361967 [1,1,0,0,0,0|1,1,0]=4 921 B12R1.354 O=C(CF)c1cc(ccc1O)Cl 1458a_100000212143_100015361967 [1,1,0,0,0,0|1,1,0]=4 922 B12R1.354 O=C(CF)c1cc(ccc1O)F 1458a_100000742286_100015361967 [1,1,0,0,0,0|1,1,0]=4 923 B12R1.354 O=C(CF)c1cc(ccc1O)I 1458a_100000212111_100015361967 [1,1,0,0,0,0|1,0,0]=3 924 B12R1.354 O=C(CF)c1cc(ccc1O)O 1458a_100000758025_100015361967 [1,1,0,0,0,0|2,0,0]=4 925 B12R1.453 C=Cc1ccc(c(c1)C(=O)C)O 271570a_100011290941_100000212127 [1,1,0,0,0,0|2,0,0]=4 926 B12R1.453 C=Cc1ccc(c(c1)C(=O)N)O 271570a_100011290941_100000192807 [1,1,0,0,0,0|2,0,0]=4 927 B12R1.453 CC(=O)c1cc(ccc1O)C#N 1458a_100000719980_200000210301 [1,1,0,0,0,0|2,0,0]=4 928 B12R1.453 CC(=O)c1cc(ccc1O)CO 1458a_200000045694_200000210301 [1,1,0,0,0,0|2,0,0]=4 929 B12R1.453 CCc1ccc(c(c1)C(=O)C)O 1458a_200000748397_200000210301 [1,1,0,0,0,0|2,0,0]=4 930 B12R1.453 CCc1ccc(c(c1)C(=O)[13CH3])O 1458a_200000748397_200025704644 [1,1,0,0,0,0|2,0,0]=4 931 B12R1.453 COc1ccc(c(c1)C(=O)C)O 1458a_100000211986_200000210301 [1,1,0,0,0,0|2,0,0]=4 932 B12R1.453 COc1ccc(c(c1)C(=O)C)O 271570a_203496583355_100011360761 [1,1,0,0,0,0|2,0,0]=4 933 B12R1.453 COc1ccc(c(c1)C(=O)N)O 271570a_203496583355_100000162014 [1,1,0,0,0,0|2,0,0]=4 934 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000211986_200025704644 [1,1,0,0,0,0|2,0,0]=4 935 B12R1.453 CSc1ccc(c(c1)C(=O)N)O 62a_100000192807_200000210301 [1,1,0,0,0,0|2,0,0]=4 936 B12R1.453 [13CH3]C(=O)c1cc(ccc1O)C#N 1458a_100000719980_200025704644 [1,1,0,0,0,0|2,0,0]=4 937 B12R1.453 [13CH3]C(=O)c1cc(ccc1O)CO 1458a_200000045694_200025704644 [1,1,0,0,0,0|2,0,0]=4 938 B12R1.453 [13CH3]Sc1ccc(c(c1)C(=O)N)O 62a_100000192807_200025704644 [1,1,0,0,0,0|2,0,0]=4 939 B14R1.12200 COc1c(cc(cc1NC(=O)C)Br)I 11a_100015658936_100015343762 [0,1,0,0,0,1|1,1,0]=4 940 B14R1.12200 COc1c(cc(cc1NC(=O)C)Br)I 1626a_100015658936_100015343762 [0,1,0,0,0,1|1,1,0]=4 941 B14R1.12200 COc1c(cc(cc1NC(=O)C)Br)I 22a_100015658936_100000070787 [0,1,0,0,0,1|1,1,0]=4 942 B14R1.12200 COc1c(cc(cc1NC(=O)C)Br)I 527a_100015658936_100103153847 [0,1,0,0,0,1|1,1,0]=4 943 B14R1.19574 C=CC(=O)Nc1cc(cc(c1O)I)Br 22a_100016071998_100000185746 [0,1,0,0,0,1|1,1,0]=4 944 B14R1.19574 CC(=Cc1cc(cc(c1O)I)I)C#N 6a_100000186756_200000212204 [0,1,0,0,0,1|2,0,0]=4 945 B14R1.19574 CCC(=O)Nc1cc(cc(c1O)I)Br 22a_100016071998_100000210414 [0,1,0,0,0,1|1,1,0]=4 946 B14R1.19574 CCC(=O)Nc1cc(cc(c1O)I)Br 527a_100016071998_100000210414 [0,1,0,0,0,1|1,1,0]=4 947 B14R1.19574 CNC(=O)Nc1cc(cc(c1O)I)Br 2430a_100016071998_100102657272 [0,1,0,0,0,1|1,1,0]=4 948 B14R1.19574 Cc1c(cc(cc1NC(=O)CO)Cl)I 527a_200000050010_100000210174 [0,1,0,0,0,1|1,1,0]=4 949 B14R1.19574 Cc1cc(c(c(c1)NC(=O)CO)O)C 22a_100011216242_100000210174 [0,1,0,0,0,1|2,0,0]=4 950 B14R1.19574 Cc1cc(c(c(c1)NC(=O)CO)O)C 527a_100011216242_100000210174 [0,1,0,0,0,1|2,0,0]=4 951 B14R1.19574 Cc1cc(cc(c1O)NC(=O)CO)Br 22a_100011825904_100000210174 [0,1,0,0,0,1|1,1,0]=4 952 B14R1.19574 Cc1cc(cc(c1O)NC(=O)CO)Br 527a_100011825904_100000210174 [0,1,0,0,0,1|1,1,0]=4 953 B14R1.19574 Cc1cc(cc(c1O)NC(=O)CO)F 22a_100000130126_100000210174 [0,1,0,0,0,1|1,1,0]=4 954 B14R1.19574 Cc1cc(cc(c1O)NC(=O)CO)F 527a_100000130126_100000210174 [0,1,0,0,0,1|1,1,0]=4 955 B14R1.19574 N#CC(=Cc1cc(cc(c1O)I)I)F 6a_100000186756_200000032654 [0,1,0,0,0,1|2,0,0]=4 956 B14R1.19574 O=C(CO)Cc1cc(cc(c1Cl)Br)I 1458a_100000210174_100021522891 [0,1,0,0,0,1|1,1,0]=4 957 B14R1.19574 O=C(CO)Cc1cc(cc(c1O)Br)Br 1458a_100000210174_200009814416 [0,1,0,0,0,1|0,2,0]=4 958 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)Br)Br 22a_100010781877_100000210174 [0,1,0,0,0,1|0,2,0]=4 959 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)Br)Br 527a_100010781877_100000210174 [0,1,0,0,0,1|0,2,0]=4 960 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)Br)Cl 22a_106741647128_100000210174 [0,1,0,0,0,1|0,2,0]=4 961 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)Br)Cl 527a_106741647128_100000210174 [0,1,0,0,0,1|0,2,0]=4 962 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)Br)F 22a_200011217456_100000210174 [0,1,0,0,0,1|0,2,0]=4 963 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)Br)F 527a_200011217456_100000210174 [0,1,0,0,0,1|0,2,0]=4 964 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)Cl)Br 22a_100000694353_100000210174 [0,1,0,0,0,1|0,2,0]=4 965 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)Cl)Br 527a_100000694353_100000210174 [0,1,0,0,0,1|0,2,0]=4 966 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)Cl)Cl 22a_100000695819_100000210174 [0,1,0,0,0,1|0,2,0]=4 967 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)Cl)Cl 527a_100000695819_100000210174 [0,1,0,0,0,1|0,2,0]=4 968 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)F)Br 22a_100011217383_100000210174 [0,1,0,0,0,1|0,2,0]=4 969 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)F)Br 527a_100011217383_100000210174 [0,1,0,0,0,1|0,2,0]=4 970 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)F)F 22a_100015205836_100000210174 [0,1,0,0,0,1|0,2,0]=4 971 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)F)F 527a_100015205836_100000210174 [0,1,0,0,0,1|0,2,0]=4 972 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)I)Br 22a_100016071998_100000210174 [0,1,0,0,0,1|0,1,0]=3 973 B14R1.19574 O=C(CO)Nc1cc(cc(c1O)I)Br 527a_100016071998_100000210174 [0,1,0,0,0,1|0,1,0]=3 974 B14R1.351 COc1cc(cc(c1OC)C(=O)C)I 1458a_200009992065_200000210301 [0,2,0,0,0,0|2,0,0]=4 975 B14R1.351 COc1cc(cc(c1OC)C(=O)[13CH3])I 1458a_200009992065_200025704644 [0,2,0,0,0,0|2,0,0]=4 976 B14R1.384 C=Cc1cc(cc(c1O)C(=O)OC)Br 271570a_100011290941_100009996593 [0,2,0,0,0,0|1,1,0]=4 977 B14R1.384 COC(=O)c1cc(cc(c1O)OC)O 271570a_203496583355_100010164242 [0,2,0,0,0,0|2,0,0]=4 978 B14R1.384 COC(=O)c1cc(cc(c1O)SC)Br 62a_100009996593_200000210301 [0,2,0,0,0,0|1,1,0]=4 979 B14R1.384 COC(=O)c1cc(cc(c1O)S[13CH3])Br 62a_100009996593_200025704644 [0,2,0,0,0,0|1,1,0]=4 980 B14R1.12530 COC(=O)c1cc(cc(c1OC)Br)Br 34a_200009812281_200000210301 [0,2,0,0,0,0|0,2,0]=4 981 B14R1.12530 COC(=O)c1cc(cc(c1OC)Br)Br 7a_200009812281_200000210301 [0,2,0,0,0,0|0,2,0]=4 982 B14R1.12530 COC(=O)c1cc(cc(c1OC)Br)Cl 34a_100010164249_200000210301 [0,2,0,0,0,0|0,2,0]=4 983 B14R1.12530 COC(=O)c1cc(cc(c1OC)Br)Cl 7a_100010164249_200000210301 [0,2,0,0,0,0|0,2,0]=4 984 B14R1.12530 COC(=O)c1cc(cc(c1OC)C)O 271570a_203496583355_100010171057 [0,2,0,0,0,0|2,0,0]=4 985 B14R1.12530 COC(=O)c1cc(cc(c1OC)Cl)Cl 34a_100009996592_200000210301 [0,2,0,0,0,0|0,2,0]=4 986 B14R1.12530 COC(=O)c1cc(cc(c1OC)Cl)Cl 7a_100009996592_200000210301 [0,2,0,0,0,0|0,2,0]=4 987 B14R1.12530 COC(=O)c1cc(cc(c1OC)I)Br 7a_100009996593_200000210301 [0,2,0,0,0,0|0,1,0]=3 988 B14R1.12530 COC(=O)c1cc(cc(c1OC)N)Br 34a_100009815751_200000210301 [0,2,0,0,0,0|1,1,0]=4 989 B14R1.12530 COC(=O)c1cc(cc(c1OC)N)Cl 34a_100000060356_200000210301 [0,2,0,0,0,0|1,1,0]=4 990 B14R1.12530 COC(=O)c1cc(cc(c1OC)N)F 34a_100010587532_200000210301 [0,2,0,0,0,0|1,1,0]=4 991 B14R1.12530 COC(=O)c1cc(cc(c1OC)N)O 271570a_203496583355_100010184925 [0,2,0,0,0,0|2,0,0]=4 992 B14R1.12530 COC(=O)c1cc(cc(c1O[13CH3])Br)Br 34a_200009812281_200025704644 [0,2,0,0,0,0|0,2,0]=4 993 B14R1.12530 COC(=O)c1cc(cc(c1O[13CH3])Br)Br 7a_200009812281_200025704644 [0,2,0,0,0,0|0,2,0]=4 994 B14R1.12530 COC(=O)c1cc(cc(c1O[13CH3])Br)Cl 34a_100010164249_200025704644 [0,2,0,0,0,0|0,2,0]=4 995 B14R1.12530 COC(=O)c1cc(cc(c1O[13CH3])Br)Cl 7a_100010164249_200025704644 [0,2,0,0,0,0|0,2,0]=4 996 B14R1.12530 COC(=O)c1cc(cc(c1O[13CH3])Cl)Cl 34a_100009996592_200025704644 [0,2,0,0,0,0|0,2,0]=4 997 B14R1.12530 COC(=O)c1cc(cc(c1O[13CH3])Cl)Cl 7a_100009996592_200025704644 [0,2,0,0,0,0|0,2,0]=4 998 B14R1.12530 COC(=O)c1cc(cc(c1O[13CH3])I)Br 7a_100009996593_200025704644 [0,2,0,0,0,0|0,1,0]=3 999 B14R1.12530 COC(=O)c1cc(cc(c1O[13CH3])N)Br 34a_100009815751_200025704644 [0,2,0,0,0,0|1,1,0]=4 1000 B14R1.12530 COC(=O)c1cc(cc(c1O[13CH3])N)Cl 34a_100000060356_200025704644 [0,2,0,0,0,0|1,1,0]=4 1001 B14R1.12530 COC(=O)c1cc(cc(c1O[13CH3])N)F 34a_100010587532_200025704644 [0,2,0,0,0,0|1,1,0]=4 1002 B14R1.14774 CCOc1c(cc(cc1C(=O)N)F)I 34a_200135271384_100000210202 [0,2,0,0,0,0|1,1,0]=4 1003 B14R1.14774 CCOc1c(cc(cc1C(=O)N)F)I 7a_200135271384_100000210202 [0,2,0,0,0,0|1,1,0]=4 1004 B14R1.14774 NC(=O)c1cc(cc(c1OCF)I)F 34a_200135271384_100015361967 [0,2,0,0,0,0|1,1,0]=4 1005 B14R1.14774 NC(=O)c1cc(cc(c1OCF)I)F 7a_200135271384_100015361967 [0,2,0,0,0,0|1,1,0]=4 1006 B14R1.18985 C#CCC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_100000184674 [0,2,0,0,0,0|1,0,0]=3 1007 B14R1.18985 C=CCC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_100000210623 [0,2,0,0,0,0|1,0,0]=3 1008 B14R1.18985 CCCC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_100000210303 [0,2,0,0,0,0|1,0,0]=3 1009 B14R1.18985 CCNC(=O)c1cc(cc(c1O)I)I 240690a_100015525214_100000748652 [0,2,0,0,0,0|1,0,0]=3 1010 B14R1.18985 CNNC(=O)c1cc(cc(c1O)I)I 22a_100016993582_100000748652 [0,2,0,0,0,0|1,0,0]=3 1011 B14R1.18985 Cc1cc(cc(c1O)C(=O)CCO)Br 1458a_100011825902_100000211926 [0,2,0,0,0,0|1,1,0]=4 1012 B14R1.18985 Cc1cc(cc(c1O)C(=O)CCO)Cl 1458a_100011255218_100000211926 [0,2,0,0,0,0|1,1,0]=4 1013 B14R1.18985 N#CCC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_100011214920 [0,2,0,0,0,0|1,0,0]=3 1014 B14R1.18985 O=C(CCF)c1cc(cc(c1O)I)I 1458a_100000748652_100011217306 [0,2,0,0,0,0|1,0,0]=3 1015 B14R1.18985 O=C(CCO)c1cc(cc(c1F)Cl)I 1458a_100012920558_100000211926 [0,2,0,0,0,0|1,1,0]=4 1016 B14R1.18985 O=C(CCO)c1cc(cc(c1F)F)I 1458a_100012344719_100000211926 [0,2,0,0,0,0|1,1,0]=4 1017 B14R1.18985 O=C(CCO)c1cc(cc(c1O)Br)Br 1458a_100000212120_100000211926 [0,2,0,0,0,0|0,2,0]=4 1018 B14R1.18985 O=C(CCO)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100000211926 [0,2,0,0,0,0|0,2,0]=4 1019 B14R1.18985 O=C(CCO)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100000211926 [0,2,0,0,0,0|0,2,0]=4 1020 B14R1.18985 O=C(CCO)c1cc(cc(c1O)F)Br 1458a_100011255233_100000211926 [0,2,0,0,0,0|0,2,0]=4 1021 B14R1.18985 O=C(CCO)c1cc(cc(c1O)F)F 1458a_100011255242_100000211926 [0,2,0,0,0,0|0,2,0]=4 1022 B14R1.18985 O=C(CCO)c1cc(cc(c1O)I)I 1458a_100000748652_100000211926 [0,2,0,0,0,0|0,0,0]=2 1023 B14R1.18985 O=C(CCO)c1cc(cc(c1O)O)Br 1458a_200010196872_100000211926 [0,2,0,0,0,0|1,1,0]=4 1024 B12R2.196 O=C1COc2c1cccc2O 271570a_203496583355_100011230590 [1,0,0,1,0,0|2,0,0]=4 1025 B12R2.196 O=C1OCc2c1cccc2O 271570a_203496583355_100010167076 [1,0,0,1,0,0|2,0,0]=4 1026 B12R2.132 O=C1COc2c1cc(cc2)O 271570a_203496583355_100000752586 [1,0,0,1,0,0|2,0,0]=4 1027 B12R2.132 O=C1OCc2c1cc(cc2)O 271570a_203496583355_100000693025 [1,0,0,1,0,0|2,0,0]=4 1028 B12R2.132 O=c1[nH]oc2c1cc(cc2)O 271570a_203496583355_100000732257 [1,0,0,1,0,0|2,0,0]=4 1029 B12R1.101 CC(=O)Cc1cc(cc(c1)I)Br 1458a_100000070787_100010146614 [1,0,0,0,0,1|1,1,0]=4 1030 B12R1.101 CC(=O)Cc1cc(cc(c1)I)F 1458a_100000070787_100010149605 [1,0,0,0,0,1|1,1,0]=4 1031 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 11a_100009814763_100015343762 [1,0,0,0,0,1|1,1,0]=4 1032 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 1626a_100009814763_100015343762 [1,0,0,0,0,1|1,1,0]=4 1033 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 22a_100009814763_100000070787 [1,0,0,0,0,1|1,1,0]=4 1034 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 527a_100009814763_100103153847 [1,0,0,0,0,1|1,1,0]=4 1035 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Cl 11a_100010147676_100015343762 [1,0,0,0,0,1|1,1,0]=4 1036 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Cl 1626a_100010147676_100015343762 [1,0,0,0,0,1|1,1,0]=4 1037 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Cl 22a_100010147676_100000070787 [1,0,0,0,0,1|1,1,0]=4 1038 B12R1.101 CC(=O)Nc1cc(cc(c1)I)F 11a_100011356972_100015343762 [1,0,0,0,0,1|1,1,0]=4 1039 B12R1.101 CC(=O)Nc1cc(cc(c1)I)F 1626a_100011356972_100015343762 [1,0,0,0,0,1|1,1,0]=4 1040 B12R1.101 CC(=O)Nc1cc(cc(c1)I)F 22a_100011356972_100000070787 [1,0,0,0,0,1|1,1,0]=4 1041 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 11a_200000696836_100015343762 [1,0,0,0,0,1|1,0,0]=3 1042 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 1626a_200000696836_100015343762 [1,0,0,0,0,1|1,0,0]=3 1043 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 22a_200000696836_100000070787 [1,0,0,0,0,1|1,0,0]=3 1044 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 527a_200000696836_100103153847 [1,0,0,0,0,1|1,0,0]=3 1045 B12R1.224 CC(=O)Cc1cccc(c1Br)I 1458a_100000070787_100010254545 [1,0,0,0,0,1|2,0,0]=4 1046 B12R1.224 CC(=O)Cc1cccc(c1C)I 1458a_100000070787_100010150147 [1,0,0,0,0,1|2,0,0]=4 1047 B12R1.224 CC(=O)Nc1cccc(c1C)I 11a_100000761887_100015343762 [1,0,0,0,0,1|2,0,0]=4 1048 B12R1.224 CC(=O)Nc1cccc(c1C)I 1626a_100000761887_100015343762 [1,0,0,0,0,1|2,0,0]=4 1049 B12R1.224 CC(=O)Nc1cccc(c1C)I 22a_100000761887_100000070787 [1,0,0,0,0,1|2,0,0]=4 1050 B12R1.224 CC(=O)Nc1cccc(c1C)I 527a_100000761887_100103153847 [1,0,0,0,0,1|2,0,0]=4 1051 B12R1.224 CC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000070787 [1,0,0,0,0,1|1,1,0]=4 1052 B12R1.224 CC(=O)Nc1cccc(c1O)Br 527a_100011934915_100103153847 [1,0,0,0,0,1|1,1,0]=4 1053 B12R1.224 CC(=O)Nc1cccc(c1O)C 11a_100000756359_100015343762 [1,0,0,0,0,1|2,0,0]=4 1054 B12R1.224 CC(=O)Nc1cccc(c1O)C 1626a_100000756359_100015343762 [1,0,0,0,0,1|2,0,0]=4 1055 B12R1.224 CC(=O)Nc1cccc(c1O)C 22a_100000756359_100000070787 [1,0,0,0,0,1|2,0,0]=4 1056 B12R1.224 CC(=O)Nc1cccc(c1O)C 527a_100000756359_100103153847 [1,0,0,0,0,1|2,0,0]=4 1057 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000070787 [1,0,0,0,0,1|1,1,0]=4 1058 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100103153847 [1,0,0,0,0,1|1,1,0]=4 1059 B12R1.224 CC(=O)Nc1cccc(c1O)F 1626a_100011934987_100015343762 [1,0,0,0,0,1|1,1,0]=4 1060 B12R1.224 CC(=O)Nc1cccc(c1O)F 22a_100011934987_100000070787 [1,0,0,0,0,1|1,1,0]=4 1061 B12R1.224 CC(=O)Nc1cccc(c1O)F 527a_100011934987_100103153847 [1,0,0,0,0,1|1,1,0]=4 1062 B12R1.224 CC(=O)Nc1cccc(c1O)I 1626a_100010084371_100015343762 [1,0,0,0,0,1|1,0,0]=3 1063 B12R1.224 CC(=O)Nc1cccc(c1O)I 22a_100010084371_100000070787 [1,0,0,0,0,1|1,0,0]=3 1064 B12R1.224 CC(=O)Nc1cccc(c1O)I 527a_100010084371_100103153847 [1,0,0,0,0,1|1,0,0]=3 1065 B12R1.224 Cc1cccc(c1O)CC(=O)N 271570a_203496583355_100011096275 [1,0,0,0,0,1|2,0,0]=4 1066 B12R1.127 CC(=O)Cc1cc(ccc1Br)I 1458a_100000070787_100012355412 [1,0,0,0,0,1|2,0,0]=4 1067 B12R1.127 CC(=O)Cc1cc(ccc1Cl)I 1458a_100000070787_100010188191 [1,0,0,0,0,1|2,0,0]=4 1068 B12R1.127 CC(=O)Cc1cc(ccc1F)I 1458a_100000070787_200010149601 [1,0,0,0,0,1|2,0,0]=4 1069 B12R1.127 CC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200000210301 [1,0,0,0,0,1|1,1,0]=4 1070 B12R1.127 CC(=O)Cc1cc(ccc1O)F 1458a_100000070787_100010161318 [1,0,0,0,0,1|1,1,0]=4 1071 B12R1.127 CC(=O)Cc1cc(ccc1O)O 1458a_100000038496_200000210301 [1,0,0,0,0,1|2,0,0]=4 1072 B12R1.127 CC(=O)Cc1cc(ccc1O)O 271570a_203496583355_200010006938 [1,0,0,0,0,1|2,0,0]=4 1073 B12R1.127 CC(=O)Nc1cc(ccc1Br)I 11a_100000750456_100015343762 [1,0,0,0,0,1|2,0,0]=4 1074 B12R1.127 CC(=O)Nc1cc(ccc1Br)I 1626a_100000750456_100015343762 [1,0,0,0,0,1|2,0,0]=4 1075 B12R1.127 CC(=O)Nc1cc(ccc1C)I 11a_100000761890_100015343762 [1,0,0,0,0,1|2,0,0]=4 1076 B12R1.127 CC(=O)Nc1cc(ccc1C)I 1626a_100000761890_100015343762 [1,0,0,0,0,1|2,0,0]=4 1077 B12R1.127 CC(=O)Nc1cc(ccc1C)I 22a_100000761890_100000070787 [1,0,0,0,0,1|2,0,0]=4 1078 B12R1.127 CC(=O)Nc1cc(ccc1C)I 527a_100000761890_100103153847 [1,0,0,0,0,1|2,0,0]=4 1079 B12R1.127 CC(=O)Nc1cc(ccc1Cl)I 11a_200000761891_100015343762 [1,0,0,0,0,1|2,0,0]=4 1080 B12R1.127 CC(=O)Nc1cc(ccc1Cl)I 1626a_200000761891_100015343762 [1,0,0,0,0,1|2,0,0]=4 1081 B12R1.127 CC(=O)Nc1cc(ccc1F)I 11a_100011464823_100015343762 [1,0,0,0,0,1|2,0,0]=4 1082 B12R1.127 CC(=O)Nc1cc(ccc1F)I 1626a_100011464823_100015343762 [1,0,0,0,0,1|2,0,0]=4 1083 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000070787 [1,0,0,0,0,1|1,1,0]=4 1084 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100103153847 [1,0,0,0,0,1|1,1,0]=4 1085 B12R1.127 CC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000070787 [1,0,0,0,0,1|2,0,0]=4 1086 B12R1.127 CC(=O)Nc1cc(ccc1O)C 271570a_203496583355_100000182586 [1,0,0,0,0,1|2,0,0]=4 1087 B12R1.127 CC(=O)Nc1cc(ccc1O)C 527a_100011215204_100103153847 [1,0,0,0,0,1|2,0,0]=4 1088 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000070787 [1,0,0,0,0,1|1,1,0]=4 1089 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100103153847 [1,0,0,0,0,1|1,1,0]=4 1090 B12R1.127 CC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000070787 [1,0,0,0,0,1|1,1,0]=4 1091 B12R1.127 CC(=O)Nc1cc(ccc1O)F 271570a_203496583355_100012558231 [1,0,0,0,0,1|1,1,0]=4 1092 B12R1.127 CC(=O)Nc1cc(ccc1O)F 527a_100000759472_100103153847 [1,0,0,0,0,1|1,1,0]=4 1093 B12R1.127 CC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000070787 [1,0,0,0,0,1|1,0,0]=3 1094 B12R1.127 CC(=O)Nc1cc(ccc1O)I 527a_100000753495_100103153847 [1,0,0,0,0,1|1,0,0]=3 1095 B12R1.127 CC(=O)Oc1cc(ccc1O)F 271570a_203496583355_200015685721 [1,0,0,0,0,1|1,1,0]=4 1096 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200025704644 [1,0,0,0,0,1|1,1,0]=4 1097 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)O 1458a_100000038496_200025704644 [1,0,0,0,0,1|2,0,0]=4