0 B12R1.893 C=C(C)c1ccc(c(c1Cl)C)Cl 271570a_100000694244_100010730154 [0,0,0,0,0,0|4,0,0]=4 1 B12R1.893 C=C(C)c1ccc(c(c1F)O)Br 271570a_100000694244_200010782288 [0,0,0,0,0,0|3,1,0]=4 2 B12R1.893 C=C(C)c1ccc(c(c1F)O)F 271570a_100000694244_100010167067 [0,0,0,0,0,0|3,1,0]=4 3 B12R1.893 C=C(C)c1ccc(c(c1N)C)F 271570a_100000694244_100011009917 [0,0,0,0,0,0|3,1,0]=4 4 B12R1.893 C=C(C)c1ccc(c(c1N)F)F 271570a_100000694244_100010008850 [0,0,0,0,0,0|3,1,0]=4 5 B12R1.893 C=C(C)c1ccc(c(c1N)N)F 271570a_100000694244_100011102919 [0,0,0,0,0,0|3,1,0]=4 6 B12R1.893 C=C(C)c1ccc(c(c1N)O)Br 271570a_100000694244_100020748643 [0,0,0,0,0,0|2,1,0]=3 7 B12R1.893 CC(=O)c1ccc(c(c1Br)F)F 1458a_100012356454_200000210301 [0,0,0,0,0,0|3,1,0]=4 8 B12R1.893 CC(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_200000210301 [0,0,0,0,0,0|2,1,0]=3 9 B12R1.893 CC(=O)c1ccc(c(c1C)F)F 1458a_100000061971_200000210301 [0,0,0,0,0,0|3,1,0]=4 10 B12R1.893 CC(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_200000210301 [0,0,0,0,0,0|3,0,0]=3 11 B12R1.893 CC(=O)c1ccc(c(c1Cl)C)Cl 1458a_100010074829_200000210301 [0,0,0,0,0,0|3,0,0]=3 12 B12R1.893 CC(=O)c1ccc(c(c1Cl)C)F 1458a_100000061447_200000210301 [0,0,0,0,0,0|3,1,0]=4 13 B12R1.893 CC(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_200000210301 [0,0,0,0,0,0|3,1,0]=4 14 B12R1.893 CC(=O)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_200000210301 [0,0,0,0,0,0|3,1,0]=4 15 B12R1.893 CC(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_200000210301 [0,0,0,0,0,0|3,0,0]=3 16 B12R1.893 CC(=O)c1ccc(c(c1Cl)F)F 1458a_100009888510_200000210301 [0,0,0,0,0,0|3,1,0]=4 17 B12R1.893 CC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_200000210301 [0,0,0,0,0,0|3,0,0]=3 18 B12R1.893 CC(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_200000210301 [0,0,0,0,0,0|3,1,0]=4 19 B12R1.893 CC(=O)c1ccc(c(c1F)Br)F 1458a_100010204296_200000210301 [0,0,0,0,0,0|3,1,0]=4 20 B12R1.893 CC(=O)c1ccc(c(c1F)C)Br 1458a_100000722919_200000210301 [0,0,0,0,0,0|3,1,0]=4 21 B12R1.893 CC(=O)c1ccc(c(c1F)C)C 1458a_100010768504_200000210301 [0,0,0,0,0,0|4,0,0]=4 22 B12R1.893 CC(=O)c1ccc(c(c1F)C)Cl 1458a_100012183103_200000210301 [0,0,0,0,0,0|3,0,0]=3 23 B12R1.893 CC(=O)c1ccc(c(c1F)C)F 1458a_100000067293_200000210301 [0,0,0,0,0,0|3,1,0]=4 24 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_200000210301 [0,0,0,0,0,0|3,1,0]=4 25 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)C 1458a_100000722910_200000210301 [0,0,0,0,0,0|4,0,0]=4 26 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)F 1458a_100000034381_200000210301 [0,0,0,0,0,0|3,1,0]=4 27 B12R1.893 CC(=O)c1ccc(c(c1F)F)Br 1458a_100009816880_200000210301 [0,0,0,0,0,0|3,1,0]=4 28 B12R1.893 CC(=O)c1ccc(c(c1F)F)C 1458a_100011219789_200000210301 [0,0,0,0,0,0|4,0,0]=4 29 B12R1.893 CC(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_200000210301 [0,0,0,0,0,0|3,0,0]=3 30 B12R1.893 CC(=O)c1ccc(c(c1F)F)F 1458a_100000766628_200000210301 [0,0,0,0,0,0|3,1,0]=4 31 B12R1.893 CC(=O)c1ccc(c(c1F)F)I 1458a_100010177778_200000210301 [0,0,0,0,0,0|3,1,0]=4 32 B12R1.893 CC(=O)c1ccc(c(c1F)F)O 1458a_100000036740_200000210301 [0,0,0,0,0,0|4,0,0]=4 33 B12R1.893 CC(=O)c1ccc(c(c1F)F)O 271570a_203496583355_100010174444 [0,0,0,0,0,0|4,0,0]=4 34 B12R1.893 CC(=O)c1ccc(c(c1F)O)F 1458a_100000084588_200000210301 [0,0,0,0,0,0|2,1,0]=3 35 B12R1.893 CC(=O)c1ccc(c(c1F)O)F 271570a_203496583355_100010179980 [0,0,0,0,0,0|2,1,0]=3 36 B12R1.893 CC(=O)c1ccc(c(c1I)C)C 1458a_100010188221_200000210301 [0,0,0,0,0,0|4,0,0]=4 37 B12R1.893 CC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_200000210301 [0,0,0,0,0,0|4,0,0]=4 38 B12R1.893 CC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_200000210301 [0,0,0,0,0,0|3,1,0]=4 39 B12R1.893 CC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_200000210301 [0,0,0,0,0,0|3,1,0]=4 40 B12R1.893 CC(=O)c1ccc(c(c1O)F)F 271570a_203496583355_200013857550 [0,0,0,0,0,0|3,1,0]=4 41 B12R1.893 CC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200000210301 [0,0,0,0,0,0|3,0,0]=3 42 B12R1.893 Cc1c(ccc(c1Cl)C(=O)[13CH3])Cl 1458a_100010074829_200025704644 [0,0,0,0,0,0|3,0,0]=3 43 B12R1.893 Cc1c(ccc(c1Cl)C(=O)[13CH3])F 1458a_100000061447_200025704644 [0,0,0,0,0,0|3,1,0]=4 44 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])Br 1458a_100000722919_200025704644 [0,0,0,0,0,0|3,1,0]=4 45 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])Cl 1458a_100012183103_200025704644 [0,0,0,0,0,0|3,0,0]=3 46 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])F 1458a_100000067293_200025704644 [0,0,0,0,0,0|3,1,0]=4 47 B12R1.893 Cc1c(ccc(c1F)F)C(=O)[13CH3] 1458a_100000061971_200025704644 [0,0,0,0,0,0|3,1,0]=4 48 B12R1.893 Cc1ccc(c(c1C)F)C(=O)[13CH3] 1458a_100010768504_200025704644 [0,0,0,0,0,0|4,0,0]=4 49 B12R1.893 Cc1ccc(c(c1C)I)C(=O)[13CH3] 1458a_100010188221_200025704644 [0,0,0,0,0,0|4,0,0]=4 50 B12R1.893 Cc1ccc(c(c1C)O)C(=O)[13CH3] 1458a_100000742916_200025704644 [0,0,0,0,0,0|4,0,0]=4 51 B12R1.893 Cc1ccc(c(c1Cl)F)C(=O)[13CH3] 1458a_100000722910_200025704644 [0,0,0,0,0,0|4,0,0]=4 52 B12R1.893 Cc1ccc(c(c1F)F)C(=O)[13CH3] 1458a_100011219789_200025704644 [0,0,0,0,0,0|4,0,0]=4 53 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Br)F)F 1458a_100012356454_200025704644 [0,0,0,0,0,0|3,1,0]=4 54 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_200025704644 [0,0,0,0,0,0|2,1,0]=3 55 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_200025704644 [0,0,0,0,0,0|3,0,0]=3 56 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_200025704644 [0,0,0,0,0,0|3,1,0]=4 57 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_200025704644 [0,0,0,0,0,0|3,1,0]=4 58 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_200025704644 [0,0,0,0,0,0|3,0,0]=3 59 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)F)F 1458a_100009888510_200025704644 [0,0,0,0,0,0|3,1,0]=4 60 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_200025704644 [0,0,0,0,0,0|3,0,0]=3 61 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_200025704644 [0,0,0,0,0,0|3,1,0]=4 62 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Br)F 1458a_100010204296_200025704644 [0,0,0,0,0,0|3,1,0]=4 63 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_200025704644 [0,0,0,0,0,0|3,1,0]=4 64 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Cl)F 1458a_100000034381_200025704644 [0,0,0,0,0,0|3,1,0]=4 65 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)Br 1458a_100009816880_200025704644 [0,0,0,0,0,0|3,1,0]=4 66 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_200025704644 [0,0,0,0,0,0|3,0,0]=3 67 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)F 1458a_100000766628_200025704644 [0,0,0,0,0,0|3,1,0]=4 68 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)I 1458a_100010177778_200025704644 [0,0,0,0,0,0|3,1,0]=4 69 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)O 1458a_100000036740_200025704644 [0,0,0,0,0,0|4,0,0]=4 70 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)O)F 1458a_100000084588_200025704644 [0,0,0,0,0,0|2,1,0]=3 71 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_200025704644 [0,0,0,0,0,0|3,1,0]=4 72 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)F)F 1458a_100011799213_200025704644 [0,0,0,0,0,0|3,1,0]=4 73 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200025704644 [0,0,0,0,0,0|3,0,0]=3 74 B11R1.21 C=C(C)c1ccc(c(c1)Br)Cl 271570a_100000694244_100012353702 [1,0,0,0,0,0|3,0,0]=4 75 B11R1.21 C=C(C)c1ccc(c(c1)C)Cl 271570a_100000694244_100000049509 [1,0,0,0,0,0|3,0,0]=4 76 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Cl 271570a_100000694244_100011214914 [1,0,0,0,0,0|3,0,0]=4 77 B11R1.21 C=C(C)c1ccc(c(c1)F)Cl 271570a_100000694244_100011216805 [1,0,0,0,0,0|3,0,0]=4 78 B11R1.21 C=C(C)c1ccc(c(c1)N)Cl 271570a_100000694244_200000761891 [1,0,0,0,0,0|3,0,0]=4 79 B11R1.21 C=C(C)c1ccc(c(c1)O)Br 271570a_100000694244_100012356990 [1,0,0,0,0,0|2,1,0]=4 80 B11R1.21 C=C(C)c1ccc(c(c1)O)C 271570a_100000694244_100000766334 [1,0,0,0,0,0|3,0,0]=4 81 B11R1.21 C=C(C)c1ccc(c(c1)O)Cl 271570a_100000694244_100011356854 [1,0,0,0,0,0|2,0,0]=3 82 B11R1.21 C=C(C)c1ccc(c(c1)O)F 271570a_100000694244_100000686035 [1,0,0,0,0,0|2,1,0]=4 83 B11R1.21 C=C(C)c1ccc(c(c1)O)N 271570a_100000694244_100000739049 [1,0,0,0,0,0|3,0,0]=4 84 B11R1.21 C=C(C)c1ccc(c(c1)O)O 271570a_100000694244_100009813601 [1,0,0,0,0,0|3,0,0]=4 85 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200000210301 [1,0,0,0,0,0|2,1,0]=4 86 B11R1.21 CC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_200000210301 [1,0,0,0,0,0|3,0,0]=4 87 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200000210301 [1,0,0,0,0,0|2,0,0]=3 88 B11R1.21 CC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200000210301 [1,0,0,0,0,0|2,1,0]=4 89 B11R1.21 CC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200000210301 [1,0,0,0,0,0|2,1,0]=4 90 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200000210301 [1,0,0,0,0,0|3,0,0]=4 91 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100010146554 [1,0,0,0,0,0|3,0,0]=4 92 B11R1.21 CC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_200000210301 [1,0,0,0,0,0|2,1,0]=4 93 B11R1.21 CC(=O)c1ccc(c(c1)C)C 1458a_100000210898_200000210301 [1,0,0,0,0,0|3,0,0]=4 94 B11R1.21 CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_200000210301 [1,0,0,0,0,0|2,0,0]=3 95 B11R1.21 CC(=O)c1ccc(c(c1)C)F 1458a_100000751819_200000210301 [1,0,0,0,0,0|2,1,0]=4 96 B11R1.21 CC(=O)c1ccc(c(c1)C)I 1458a_100000751300_200000210301 [1,0,0,0,0,0|2,1,0]=4 97 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [1,0,0,0,0,0|3,0,0]=4 98 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [1,0,0,0,0,0|3,0,0]=4 99 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200000210301 [1,0,0,0,0,0|2,1,0]=4 100 B11R1.21 CC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_200000210301 [1,0,0,0,0,0|3,0,0]=4 101 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200000210301 [1,0,0,0,0,0|2,0,0]=3 102 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200000210301 [1,0,0,0,0,0|2,1,0]=4 103 B11R1.21 CC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200000210301 [1,0,0,0,0,0|2,1,0]=4 104 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200000210301 [1,0,0,0,0,0|3,0,0]=4 105 B11R1.21 CC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200000210301 [1,0,0,0,0,0|2,1,0]=4 106 B11R1.21 CC(=O)c1ccc(c(c1)F)C 1458a_100000212313_200000210301 [1,0,0,0,0,0|3,0,0]=4 107 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200000210301 [1,0,0,0,0,0|2,0,0]=3 108 B11R1.21 CC(=O)c1ccc(c(c1)F)F 1458a_100000209822_200000210301 [1,0,0,0,0,0|2,1,0]=4 109 B11R1.21 CC(=O)c1ccc(c(c1)F)I 1458a_100000062624_200000210301 [1,0,0,0,0,0|2,1,0]=4 110 B11R1.21 CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_200000210301 [1,0,0,0,0,0|3,0,0]=4 111 B11R1.21 CC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000690002 [1,0,0,0,0,0|3,0,0]=4 112 B11R1.21 CC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200000210301 [1,0,0,0,0,0|2,1,0]=4 113 B11R1.21 CC(=O)c1ccc(c(c1)I)C 1458a_100000751299_200000210301 [1,0,0,0,0,0|3,0,0]=4 114 B11R1.21 CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200000210301 [1,0,0,0,0,0|2,0,0]=3 115 B11R1.21 CC(=O)c1ccc(c(c1)I)F 1458a_100000688015_200000210301 [1,0,0,0,0,0|2,1,0]=4 116 B11R1.21 CC(=O)c1ccc(c(c1)I)I 1458a_100000725830_200000210301 [1,0,0,0,0,0|2,1,0]=4 117 B11R1.21 CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_200000210301 [1,0,0,0,0,0|3,0,0]=4 118 B11R1.21 CC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100009816534 [1,0,0,0,0,0|3,0,0]=4 119 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200000210301 [1,0,0,0,0,0|1,1,0]=3 120 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100010146556 [1,0,0,0,0,0|1,1,0]=3 121 B11R1.21 CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_200000210301 [1,0,0,0,0,0|2,0,0]=3 122 B11R1.21 CC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011934287 [1,0,0,0,0,0|2,0,0]=3 123 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200000210301 [1,0,0,0,0,0|1,0,0]=2 124 B11R1.21 CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_200000210301 [1,0,0,0,0,0|1,1,0]=3 125 B11R1.21 CC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000239719 [1,0,0,0,0,0|1,1,0]=3 126 B11R1.21 CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_200000210301 [1,0,0,0,0,0|1,1,0]=3 127 B11R1.21 CC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100012029215 [1,0,0,0,0,0|2,0,0]=3 128 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [1,0,0,0,0,0|2,0,0]=3 129 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [1,0,0,0,0,0|2,0,0]=3 130 B11R1.21 CC(=O)c1cnc(c(c1)O)F 271570a_203496583355_200010135287 [1,0,0,0,0,0|2,1,0]=4 131 B11R1.21 CC(O)c1ccc(c(c1)O)F 271570a_203496583355_100011191524 [1,0,0,0,0,0|1,1,1]=4 132 B11R1.21 Cc1cc(ccc1Br)C(=O)[13CH3] 1458a_100000692631_200025704644 [1,0,0,0,0,0|2,1,0]=4 133 B11R1.21 Cc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000686306_200025704644 [1,0,0,0,0,0|2,0,0]=3 134 B11R1.21 Cc1cc(ccc1F)C(=O)[13CH3] 1458a_100000751819_200025704644 [1,0,0,0,0,0|2,1,0]=4 135 B11R1.21 Cc1cc(ccc1I)C(=O)[13CH3] 1458a_100000751300_200025704644 [1,0,0,0,0,0|2,1,0]=4 136 B11R1.21 Cc1cc(ccc1O)C(=O)N 271570a_203496583355_100011218126 [1,0,0,0,0,0|3,0,0]=4 137 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [1,0,0,0,0,0|3,0,0]=4 138 B11R1.21 Cc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000186397_200025704644 [1,0,0,0,0,0|3,0,0]=4 139 B11R1.21 Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100000210898_200025704644 [1,0,0,0,0,0|3,0,0]=4 140 B11R1.21 Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000751740_200025704644 [1,0,0,0,0,0|3,0,0]=4 141 B11R1.21 Cc1ccc(cc1F)C(=O)[13CH3] 1458a_100000212313_200025704644 [1,0,0,0,0,0|3,0,0]=4 142 B11R1.21 Cc1ccc(cc1I)C(=O)[13CH3] 1458a_100000751299_200025704644 [1,0,0,0,0,0|3,0,0]=4 143 B11R1.21 Cc1ccc(cc1O)B(O)O 271570a_203496583355_200010223333 [1,0,0,0,0,0|2,0,1]=4 144 B11R1.21 Cc1ccc(cc1O)C(=O)N 271570a_203496583355_100000186401 [1,0,0,0,0,0|2,0,0]=3 145 B11R1.21 Cc1ccc(cc1O)C(=O)[13CH3] 1458a_100000233767_200025704644 [1,0,0,0,0,0|2,0,0]=3 146 B11R1.21 NC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100009814583 [1,0,0,0,0,0|3,0,0]=4 147 B11R1.21 NC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000686215 [1,0,0,0,0,0|3,0,0]=4 148 B11R1.21 NC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011202321 [1,0,0,0,0,0|1,1,0]=3 149 B11R1.21 NC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012344895 [1,0,0,0,0,0|2,0,0]=3 150 B11R1.21 OB(O)c1ccc(c(c1)O)F 271570a_203496583355_100010175509 [1,0,0,0,0,0|1,1,1]=4 151 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200025704644 [1,0,0,0,0,0|2,1,0]=4 152 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200025704644 [1,0,0,0,0,0|2,0,0]=3 153 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200025704644 [1,0,0,0,0,0|2,1,0]=4 154 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200025704644 [1,0,0,0,0,0|2,1,0]=4 155 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200025704644 [1,0,0,0,0,0|3,0,0]=4 156 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200025704644 [1,0,0,0,0,0|2,1,0]=4 157 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200025704644 [1,0,0,0,0,0|2,0,0]=3 158 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200025704644 [1,0,0,0,0,0|2,1,0]=4 159 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200025704644 [1,0,0,0,0,0|2,1,0]=4 160 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200025704644 [1,0,0,0,0,0|3,0,0]=4 161 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200025704644 [1,0,0,0,0,0|2,1,0]=4 162 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200025704644 [1,0,0,0,0,0|2,0,0]=3 163 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)F 1458a_100000209822_200025704644 [1,0,0,0,0,0|2,1,0]=4 164 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)I 1458a_100000062624_200025704644 [1,0,0,0,0,0|2,1,0]=4 165 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)O 1458a_100000185466_200025704644 [1,0,0,0,0,0|3,0,0]=4 166 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200025704644 [1,0,0,0,0,0|2,1,0]=4 167 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200025704644 [1,0,0,0,0,0|2,0,0]=3 168 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)F 1458a_100000688015_200025704644 [1,0,0,0,0,0|2,1,0]=4 169 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)I 1458a_100000725830_200025704644 [1,0,0,0,0,0|2,1,0]=4 170 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)O 1458a_100000037485_200025704644 [1,0,0,0,0,0|3,0,0]=4 171 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200025704644 [1,0,0,0,0,0|1,1,0]=3 172 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200025704644 [1,0,0,0,0,0|1,0,0]=2 173 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)F 1458a_100000035894_200025704644 [1,0,0,0,0,0|1,1,0]=3 174 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)I 1458a_100000239334_200025704644 [1,0,0,0,0,0|1,1,0]=3 175 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [1,0,0,0,0,0|2,0,0]=3 176 B11R1.159 C=C(C)c1cccc(c1Br)O 271570a_100000694244_100010187914 [1,0,0,0,0,0|3,0,0]=4 177 B11R1.159 C=C(C)c1cccc(c1C)O 271570a_100000694244_100012002258 [1,0,0,0,0,0|3,0,0]=4 178 B11R1.159 C=C(C)c1cccc(c1Cl)O 271570a_100000694244_100000049636 [1,0,0,0,0,0|3,0,0]=4 179 B11R1.159 C=C(C)c1cccc(c1F)O 271570a_100000694244_100009817021 [1,0,0,0,0,0|3,0,0]=4 180 B11R1.159 C=C(C)c1cccc(c1N)Br 271570a_100000694244_100010146558 [1,0,0,0,0,0|3,0,0]=4 181 B11R1.159 C=C(C)c1cccc(c1N)C 271570a_100000694244_100011834072 [1,0,0,0,0,0|3,0,0]=4 182 B11R1.159 C=C(C)c1cccc(c1N)Cl 271570a_100000694244_100010190421 [1,0,0,0,0,0|3,0,0]=4 183 B11R1.159 C=C(C)c1cccc(c1N)F 271570a_100000694244_100000042321 [1,0,0,0,0,0|3,0,0]=4 184 B11R1.159 C=C(C)c1cccc(c1N)N 271570a_100000694244_100015191791 [1,0,0,0,0,0|3,0,0]=4 185 B11R1.159 C=C(C)c1cccc(c1N)O 271570a_100000694244_100011934926 [1,0,0,0,0,0|2,0,0]=3 186 B11R1.159 C=C(C)c1cccc(c1O)O 271570a_100000694244_100009815950 [1,0,0,0,0,0|3,0,0]=4 187 B11R1.159 C=C(C)c1nccc(c1N)O 271570a_100000694244_100000128729 [1,0,0,0,0,0|3,0,0]=4 188 B11R1.159 CC(=O)c1cccc(c1Br)Br 1458a_100012360534_200000210301 [1,0,0,0,0,0|3,0,0]=4 189 B11R1.159 CC(=O)c1cccc(c1Br)C 1458a_100000692419_200000210301 [1,0,0,0,0,0|3,0,0]=4 190 B11R1.159 CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_200000210301 [1,0,0,0,0,0|3,0,0]=4 191 B11R1.159 CC(=O)c1cccc(c1Br)F 1458a_100011217547_200000210301 [1,0,0,0,0,0|3,0,0]=4 192 B11R1.159 CC(=O)c1cccc(c1Br)I 1458a_100010232522_200000210301 [1,0,0,0,0,0|3,0,0]=4 193 B11R1.159 CC(=O)c1cccc(c1Br)O 1458a_100010230362_200000210301 [1,0,0,0,0,0|2,0,0]=3 194 B11R1.159 CC(=O)c1cccc(c1C)Br 1458a_100000760464_200000210301 [1,0,0,0,0,0|3,0,0]=4 195 B11R1.159 CC(=O)c1cccc(c1C)C 1458a_100000183679_200000210301 [1,0,0,0,0,0|3,0,0]=4 196 B11R1.159 CC(=O)c1cccc(c1C)Cl 1458a_100000690184_200000210301 [1,0,0,0,0,0|3,0,0]=4 197 B11R1.159 CC(=O)c1cccc(c1C)F 1458a_100011218272_200000210301 [1,0,0,0,0,0|3,0,0]=4 198 B11R1.159 CC(=O)c1cccc(c1C)I 1458a_100000751865_200000210301 [1,0,0,0,0,0|3,0,0]=4 199 B11R1.159 CC(=O)c1cccc(c1C)O 1458a_100000766327_200000210301 [1,0,0,0,0,0|2,0,0]=3 200 B11R1.159 CC(=O)c1cccc(c1C)O 271570a_203496583355_100012706834 [1,0,0,0,0,0|2,0,0]=3 201 B11R1.159 CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_200000210301 [1,0,0,0,0,0|3,0,0]=4 202 B11R1.159 CC(=O)c1cccc(c1Cl)C 1458a_100000693142_200000210301 [1,0,0,0,0,0|3,0,0]=4 203 B11R1.159 CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200000210301 [1,0,0,0,0,0|3,0,0]=4 204 B11R1.159 CC(=O)c1cccc(c1Cl)F 1458a_100000759904_200000210301 [1,0,0,0,0,0|3,0,0]=4 205 B11R1.159 CC(=O)c1cccc(c1Cl)I 1458a_100010176783_200000210301 [1,0,0,0,0,0|3,0,0]=4 206 B11R1.159 CC(=O)c1cccc(c1Cl)O 1458a_100000092362_200000210301 [1,0,0,0,0,0|2,0,0]=3 207 B11R1.159 CC(=O)c1cccc(c1F)Br 1458a_100000756403_200000210301 [1,0,0,0,0,0|3,0,0]=4 208 B11R1.159 CC(=O)c1cccc(c1F)C 1458a_100000766181_200000210301 [1,0,0,0,0,0|3,0,0]=4 209 B11R1.159 CC(=O)c1cccc(c1F)Cl 1458a_100000688816_200000210301 [1,0,0,0,0,0|3,0,0]=4 210 B11R1.159 CC(=O)c1cccc(c1F)F 1458a_100000748134_200000210301 [1,0,0,0,0,0|3,0,0]=4 211 B11R1.159 CC(=O)c1cccc(c1F)I 1458a_100010185205_200000210301 [1,0,0,0,0,0|3,0,0]=4 212 B11R1.159 CC(=O)c1cccc(c1F)O 1458a_100000037433_200000210301 [1,0,0,0,0,0|2,0,0]=3 213 B11R1.159 CC(=O)c1cccc(c1F)O 271570a_203496583355_100012355707 [1,0,0,0,0,0|2,0,0]=3 214 B11R1.159 CC(=O)c1cccc(c1I)Br 1458a_100000688019_200000210301 [1,0,0,0,0,0|3,0,0]=4 215 B11R1.159 CC(=O)c1cccc(c1I)C 1458a_100000739377_200000210301 [1,0,0,0,0,0|3,0,0]=4 216 B11R1.159 CC(=O)c1cccc(c1I)Cl 1458a_100010176784_200000210301 [1,0,0,0,0,0|3,0,0]=4 217 B11R1.159 CC(=O)c1cccc(c1I)F 1458a_100000690930_200000210301 [1,0,0,0,0,0|3,0,0]=4 218 B11R1.159 CC(=O)c1cccc(c1I)O 1458a_100010084636_200000210301 [1,0,0,0,0,0|2,0,0]=3 219 B11R1.159 CC(=O)c1cccc(c1O)Br 1458a_100000752940_200000210301 [1,0,0,0,0,0|3,0,0]=4 220 B11R1.159 CC(=O)c1cccc(c1O)C 1458a_100000183896_200000210301 [1,0,0,0,0,0|3,0,0]=4 221 B11R1.159 CC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000210301 [1,0,0,0,0,0|3,0,0]=4 222 B11R1.159 CC(=O)c1cccc(c1O)F 1458a_100011217230_200000210301 [1,0,0,0,0,0|3,0,0]=4 223 B11R1.159 CC(=O)c1cccc(c1O)F 271570a_203496583355_100012362612 [1,0,0,0,0,0|3,0,0]=4 224 B11R1.159 CC(=O)c1cccc(c1O)O 1458a_100000690420_200000210301 [1,0,0,0,0,0|2,0,0]=3 225 B11R1.159 CC(=O)c1cccc(c1O)O 271570a_203496583355_100009815558 [1,0,0,0,0,0|2,0,0]=3 226 B11R1.159 CC(=O)c1ccnc(c1N)O 271570a_203496583355_200000063496 [1,0,0,0,0,0|2,0,0]=3 227 B11R1.159 CC(=O)c1nccc(c1F)O 271570a_203496583355_100010729024 [1,0,0,0,0,0|3,0,0]=4 228 B11R1.159 CC(C)c1cccc(c1N)O 271570a_203496583355_100010571509 [1,0,0,0,0,0|2,0,1]=4 229 B11R1.159 CC(O)c1cccc(c1F)O 271570a_203496583355_200012356376 [1,0,0,0,0,0|2,0,1]=4 230 B11R1.159 Cc1c(cccc1B(O)O)O 271570a_203496583355_100000724322 [1,0,0,0,0,0|2,0,1]=4 231 B11R1.159 Cc1c(cccc1C(=O)N)O 271570a_203496583355_200012298201 [1,0,0,0,0,0|2,0,0]=3 232 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Br 1458a_100000760464_200025704644 [1,0,0,0,0,0|3,0,0]=4 233 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Cl 1458a_100000690184_200025704644 [1,0,0,0,0,0|3,0,0]=4 234 B11R1.159 Cc1c(cccc1C(=O)[13CH3])F 1458a_100011218272_200025704644 [1,0,0,0,0,0|3,0,0]=4 235 B11R1.159 Cc1c(cccc1C(=O)[13CH3])I 1458a_100000751865_200025704644 [1,0,0,0,0,0|3,0,0]=4 236 B11R1.159 Cc1c(cccc1C(=O)[13CH3])O 1458a_100000766327_200025704644 [1,0,0,0,0,0|2,0,0]=3 237 B11R1.159 Cc1cccc(c1Br)C(=O)[13CH3] 1458a_100000692419_200025704644 [1,0,0,0,0,0|3,0,0]=4 238 B11R1.159 Cc1cccc(c1C)C(=O)[13CH3] 1458a_100000183679_200025704644 [1,0,0,0,0,0|3,0,0]=4 239 B11R1.159 Cc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000693142_200025704644 [1,0,0,0,0,0|3,0,0]=4 240 B11R1.159 Cc1cccc(c1F)C(=O)[13CH3] 1458a_100000766181_200025704644 [1,0,0,0,0,0|3,0,0]=4 241 B11R1.159 Cc1cccc(c1I)C(=O)[13CH3] 1458a_100000739377_200025704644 [1,0,0,0,0,0|3,0,0]=4 242 B11R1.159 Cc1cccc(c1O)C(=O)N 271570a_203496583355_200011409216 [1,0,0,0,0,0|3,0,0]=4 243 B11R1.159 Cc1cccc(c1O)C(=O)[13CH3] 1458a_100000183896_200025704644 [1,0,0,0,0,0|3,0,0]=4 244 B11R1.159 NC(=O)c1cccc(c1F)O 271570a_203496583355_100012351131 [1,0,0,0,0,0|2,0,0]=3 245 B11R1.159 NC(=O)c1cccc(c1N)O 271570a_203496583355_100010144993 [1,0,0,0,0,0|1,0,0]=2 246 B11R1.159 NC(=O)c1cccc(c1O)F 271570a_203496583355_200012351544 [1,0,0,0,0,0|3,0,0]=4 247 B11R1.159 NC(=O)c1ccnc(c1N)O 271570a_203496583355_100000080204 [1,0,0,0,0,0|2,0,0]=3 248 B11R1.159 OB(O)c1cccc(c1F)O 271570a_203496583355_100011934463 [1,0,0,0,0,0|2,0,1]=4 249 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Br 1458a_100012360534_200025704644 [1,0,0,0,0,0|3,0,0]=4 250 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Cl 1458a_100012339722_200025704644 [1,0,0,0,0,0|3,0,0]=4 251 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)F 1458a_100011217547_200025704644 [1,0,0,0,0,0|3,0,0]=4 252 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)I 1458a_100010232522_200025704644 [1,0,0,0,0,0|3,0,0]=4 253 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)O 1458a_100010230362_200025704644 [1,0,0,0,0,0|2,0,0]=3 254 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Br 1458a_100000760540_200025704644 [1,0,0,0,0,0|3,0,0]=4 255 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200025704644 [1,0,0,0,0,0|3,0,0]=4 256 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)F 1458a_100000759904_200025704644 [1,0,0,0,0,0|3,0,0]=4 257 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)I 1458a_100010176783_200025704644 [1,0,0,0,0,0|3,0,0]=4 258 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)O 1458a_100000092362_200025704644 [1,0,0,0,0,0|2,0,0]=3 259 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Br 1458a_100000756403_200025704644 [1,0,0,0,0,0|3,0,0]=4 260 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Cl 1458a_100000688816_200025704644 [1,0,0,0,0,0|3,0,0]=4 261 B11R1.159 [13CH3]C(=O)c1cccc(c1F)F 1458a_100000748134_200025704644 [1,0,0,0,0,0|3,0,0]=4 262 B11R1.159 [13CH3]C(=O)c1cccc(c1F)I 1458a_100010185205_200025704644 [1,0,0,0,0,0|3,0,0]=4 263 B11R1.159 [13CH3]C(=O)c1cccc(c1F)O 1458a_100000037433_200025704644 [1,0,0,0,0,0|2,0,0]=3 264 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Br 1458a_100000688019_200025704644 [1,0,0,0,0,0|3,0,0]=4 265 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Cl 1458a_100010176784_200025704644 [1,0,0,0,0,0|3,0,0]=4 266 B11R1.159 [13CH3]C(=O)c1cccc(c1I)F 1458a_100000690930_200025704644 [1,0,0,0,0,0|3,0,0]=4 267 B11R1.159 [13CH3]C(=O)c1cccc(c1I)O 1458a_100010084636_200025704644 [1,0,0,0,0,0|2,0,0]=3 268 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Br 1458a_100000752940_200025704644 [1,0,0,0,0,0|3,0,0]=4 269 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Cl 1458a_100000742801_200025704644 [1,0,0,0,0,0|3,0,0]=4 270 B11R1.159 [13CH3]C(=O)c1cccc(c1O)F 1458a_100011217230_200025704644 [1,0,0,0,0,0|3,0,0]=4 271 B11R1.159 [13CH3]C(=O)c1cccc(c1O)O 1458a_100000690420_200025704644 [1,0,0,0,0,0|2,0,0]=3 272 B11R1.166 C=C(C)c1ccc(cc1Br)Cl 271570a_100000694244_100011219703 [1,0,0,0,0,0|3,0,0]=4 273 B11R1.166 C=C(C)c1ccc(cc1C)Cl 271570a_100000694244_100011219607 [1,0,0,0,0,0|3,0,0]=4 274 B11R1.166 C=C(C)c1ccc(cc1Cl)Cl 271570a_100000694244_100000699841 [1,0,0,0,0,0|3,0,0]=4 275 B11R1.166 C=C(C)c1ccc(cc1F)Cl 271570a_100000694244_100011216042 [1,0,0,0,0,0|3,0,0]=4 276 B11R1.166 C=C(C)c1ccc(cc1N)Br 271570a_100000694244_100000743836 [1,0,0,0,0,0|2,1,0]=4 277 B11R1.166 C=C(C)c1ccc(cc1N)C 271570a_100000694244_100011216686 [1,0,0,0,0,0|3,0,0]=4 278 B11R1.166 C=C(C)c1ccc(cc1N)Cl 271570a_100000694244_100000761886 [1,0,0,0,0,0|2,0,0]=3 279 B11R1.166 C=C(C)c1ccc(cc1N)F 271570a_100000694244_100011218093 [1,0,0,0,0,0|2,1,0]=4 280 B11R1.166 C=C(C)c1ccc(cc1N)N 271570a_100000694244_200012175722 [1,0,0,0,0,0|3,0,0]=4 281 B11R1.166 C=C(C)c1ccc(cc1N)O 271570a_100000694244_100011999798 [1,0,0,0,0,0|3,0,0]=4 282 B11R1.166 C=C(C)c1ccc(cc1O)Cl 271570a_100000694244_100000050036 [1,0,0,0,0,0|3,0,0]=4 283 B11R1.166 C=C(C)c1ccc(nc1N)Cl 271570a_100000694244_100010171640 [1,0,0,0,0,0|3,0,0]=4 284 B11R1.166 CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_200000210301 [1,0,0,0,0,0|2,1,0]=4 285 B11R1.166 CC(=O)c1ccc(cc1Br)C 1458a_100000685072_200000210301 [1,0,0,0,0,0|3,0,0]=4 286 B11R1.166 CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200000210301 [1,0,0,0,0,0|2,0,0]=3 287 B11R1.166 CC(=O)c1ccc(cc1Br)F 1458a_100000212304_200000210301 [1,0,0,0,0,0|2,1,0]=4 288 B11R1.166 CC(=O)c1ccc(cc1Br)I 1458a_100012360512_200000210301 [1,0,0,0,0,0|2,1,0]=4 289 B11R1.166 CC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000210301 [1,0,0,0,0,0|3,0,0]=4 290 B11R1.166 CC(=O)c1ccc(cc1C)Br 1458a_100000741311_200000210301 [1,0,0,0,0,0|2,1,0]=4 291 B11R1.166 CC(=O)c1ccc(cc1C)C 1458a_100000211164_200000210301 [1,0,0,0,0,0|3,0,0]=4 292 B11R1.166 CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_200000210301 [1,0,0,0,0,0|2,0,0]=3 293 B11R1.166 CC(=O)c1ccc(cc1C)F 1458a_100000686989_200000210301 [1,0,0,0,0,0|2,1,0]=4 294 B11R1.166 CC(=O)c1ccc(cc1C)I 1458a_100010189873_200000210301 [1,0,0,0,0,0|2,1,0]=4 295 B11R1.166 CC(=O)c1ccc(cc1C)O 1458a_100000692822_200000210301 [1,0,0,0,0,0|3,0,0]=4 296 B11R1.166 CC(=O)c1ccc(cc1C)O 271570a_203496583355_100012360112 [1,0,0,0,0,0|3,0,0]=4 297 B11R1.166 CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200000210301 [1,0,0,0,0,0|2,1,0]=4 298 B11R1.166 CC(=O)c1ccc(cc1Cl)C 1458a_100000766932_200000210301 [1,0,0,0,0,0|3,0,0]=4 299 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200000210301 [1,0,0,0,0,0|2,0,0]=3 300 B11R1.166 CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_200000210301 [1,0,0,0,0,0|2,1,0]=4 301 B11R1.166 CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_200000210301 [1,0,0,0,0,0|2,1,0]=4 302 B11R1.166 CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000210301 [1,0,0,0,0,0|3,0,0]=4 303 B11R1.166 CC(=O)c1ccc(cc1F)Br 1458a_100000214689_200000210301 [1,0,0,0,0,0|2,1,0]=4 304 B11R1.166 CC(=O)c1ccc(cc1F)C 1458a_100000766033_200000210301 [1,0,0,0,0,0|3,0,0]=4 305 B11R1.166 CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_200000210301 [1,0,0,0,0,0|2,0,0]=3 306 B11R1.166 CC(=O)c1ccc(cc1F)F 1458a_100000211022_200000210301 [1,0,0,0,0,0|2,1,0]=4 307 B11R1.166 CC(=O)c1ccc(cc1F)I 1458a_100000037189_200000210301 [1,0,0,0,0,0|2,1,0]=4 308 B11R1.166 CC(=O)c1ccc(cc1F)O 1458a_100000689029_200000210301 [1,0,0,0,0,0|3,0,0]=4 309 B11R1.166 CC(=O)c1ccc(cc1F)O 271570a_203496583355_100000690205 [1,0,0,0,0,0|3,0,0]=4 310 B11R1.166 CC(=O)c1ccc(cc1I)Br 1458a_100000751167_200000210301 [1,0,0,0,0,0|2,1,0]=4 311 B11R1.166 CC(=O)c1ccc(cc1I)C 1458a_100009999607_200000210301 [1,0,0,0,0,0|3,0,0]=4 312 B11R1.166 CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_200000210301 [1,0,0,0,0,0|2,0,0]=3 313 B11R1.166 CC(=O)c1ccc(cc1I)F 1458a_100000739341_200000210301 [1,0,0,0,0,0|2,1,0]=4 314 B11R1.166 CC(=O)c1ccc(cc1N)O 271570a_203496583355_100011590516 [1,0,0,0,0,0|2,0,0]=3 315 B11R1.166 CC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000210301 [1,0,0,0,0,0|2,1,0]=4 316 B11R1.166 CC(=O)c1ccc(cc1O)C 1458a_100000212137_200000210301 [1,0,0,0,0,0|3,0,0]=4 317 B11R1.166 CC(=O)c1ccc(cc1O)C 271570a_203496583355_100012353930 [1,0,0,0,0,0|3,0,0]=4 318 B11R1.166 CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000210301 [1,0,0,0,0,0|2,0,0]=3 319 B11R1.166 CC(=O)c1ccc(cc1O)F 1458a_100000746061_200000210301 [1,0,0,0,0,0|2,1,0]=4 320 B11R1.166 CC(=O)c1ccc(cc1O)F 271570a_203496583355_100000686192 [1,0,0,0,0,0|2,1,0]=4 321 B11R1.166 CC(=O)c1ccc(cc1O)I 1458a_100000091984_200000210301 [1,0,0,0,0,0|2,1,0]=4 322 B11R1.166 CC(=O)c1ccc(cc1O)O 1458a_100000212172_200000210301 [1,0,0,0,0,0|3,0,0]=4 323 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100000188348 [1,0,0,0,0,0|3,0,0]=4 324 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100012340537 [1,0,0,0,0,0|3,0,0]=4 325 B11R1.166 Cc1cc(ccc1C(=O)N)O 271570a_203496583355_100011327924 [1,0,0,0,0,0|3,0,0]=4 326 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Br 1458a_100000741311_200025704644 [1,0,0,0,0,0|2,1,0]=4 327 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000688705_200025704644 [1,0,0,0,0,0|2,0,0]=3 328 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])F 1458a_100000686989_200025704644 [1,0,0,0,0,0|2,1,0]=4 329 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])I 1458a_100010189873_200025704644 [1,0,0,0,0,0|2,1,0]=4 330 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])O 1458a_100000692822_200025704644 [1,0,0,0,0,0|3,0,0]=4 331 B11R1.166 Cc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000685072_200025704644 [1,0,0,0,0,0|3,0,0]=4 332 B11R1.166 Cc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000211164_200025704644 [1,0,0,0,0,0|3,0,0]=4 333 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000766932_200025704644 [1,0,0,0,0,0|3,0,0]=4 334 B11R1.166 Cc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000766033_200025704644 [1,0,0,0,0,0|3,0,0]=4 335 B11R1.166 Cc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100009999607_200025704644 [1,0,0,0,0,0|3,0,0]=4 336 B11R1.166 Cc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212137_200025704644 [1,0,0,0,0,0|3,0,0]=4 337 B11R1.166 NC(=O)c1ccc(cc1Br)O 271570a_203496583355_200010146565 [1,0,0,0,0,0|3,0,0]=4 338 B11R1.166 NC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216903 [1,0,0,0,0,0|3,0,0]=4 339 B11R1.166 NC(=O)c1ccc(cc1N)O 271570a_203496583355_100012349972 [1,0,0,0,0,0|2,0,0]=3 340 B11R1.166 NC(=O)c1ccc(cc1O)Br 271570a_203496583355_100009815748 [1,0,0,0,0,0|2,1,0]=4 341 B11R1.166 NC(=O)c1ccc(cc1O)F 271570a_203496583355_100000206404 [1,0,0,0,0,0|2,1,0]=4 342 B11R1.166 NC(=O)c1ccc(cc1O)O 271570a_203496583355_100011550861 [1,0,0,0,0,0|3,0,0]=4 343 B11R1.166 NC(=O)c1ccc(nc1N)O 271570a_203496583355_100009875182 [1,0,0,0,0,0|3,0,0]=4 344 B11R1.166 NC(=O)c1ncc(cc1N)O 271570a_203496583355_100010235749 [1,0,0,0,0,0|3,0,0]=4 345 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Br 1458a_100000762965_200025704644 [1,0,0,0,0,0|2,1,0]=4 346 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200025704644 [1,0,0,0,0,0|2,0,0]=3 347 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)F 1458a_100000212304_200025704644 [1,0,0,0,0,0|2,1,0]=4 348 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)I 1458a_100012360512_200025704644 [1,0,0,0,0,0|2,1,0]=4 349 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)O 1458a_100012344906_200025704644 [1,0,0,0,0,0|3,0,0]=4 350 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200025704644 [1,0,0,0,0,0|2,1,0]=4 351 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200025704644 [1,0,0,0,0,0|2,0,0]=3 352 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)F 1458a_100000211397_200025704644 [1,0,0,0,0,0|2,1,0]=4 353 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)I 1458a_100000751301_200025704644 [1,0,0,0,0,0|2,1,0]=4 354 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)O 1458a_100000702456_200025704644 [1,0,0,0,0,0|3,0,0]=4 355 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Br 1458a_100000214689_200025704644 [1,0,0,0,0,0|2,1,0]=4 356 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Cl 1458a_100000212326_200025704644 [1,0,0,0,0,0|2,0,0]=3 357 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)F 1458a_100000211022_200025704644 [1,0,0,0,0,0|2,1,0]=4 358 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)I 1458a_100000037189_200025704644 [1,0,0,0,0,0|2,1,0]=4 359 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)O 1458a_100000689029_200025704644 [1,0,0,0,0,0|3,0,0]=4 360 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Br 1458a_100000751167_200025704644 [1,0,0,0,0,0|2,1,0]=4 361 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Cl 1458a_100000739380_200025704644 [1,0,0,0,0,0|2,0,0]=3 362 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)F 1458a_100000739341_200025704644 [1,0,0,0,0,0|2,1,0]=4 363 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Br 1458a_100000744433_200025704644 [1,0,0,0,0,0|2,1,0]=4 364 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Cl 1458a_100000188622_200025704644 [1,0,0,0,0,0|2,0,0]=3 365 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)F 1458a_100000746061_200025704644 [1,0,0,0,0,0|2,1,0]=4 366 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)I 1458a_100000091984_200025704644 [1,0,0,0,0,0|2,1,0]=4 367 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)O 1458a_100000212172_200025704644 [1,0,0,0,0,0|3,0,0]=4 368 B11R1.278 C=Cc1ccc(c(c1Cl)C)Cl 271570a_100011290941_100010730154 [1,0,0,0,0,0|3,0,0]=4 369 B11R1.278 C=Cc1ccc(c(c1F)O)Br 271570a_100011290941_200010782288 [1,0,0,0,0,0|2,1,0]=4 370 B11R1.278 C=Cc1ccc(c(c1F)O)F 271570a_100011290941_100010167067 [1,0,0,0,0,0|2,1,0]=4 371 B11R1.278 C=Cc1ccc(c(c1N)C)F 271570a_100011290941_100011009917 [1,0,0,0,0,0|2,1,0]=4 372 B11R1.278 C=Cc1ccc(c(c1N)F)F 271570a_100011290941_100010008850 [1,0,0,0,0,0|2,1,0]=4 373 B11R1.278 C=Cc1ccc(c(c1N)N)F 271570a_100011290941_100011102919 [1,0,0,0,0,0|2,1,0]=4 374 B11R1.278 C=Cc1ccc(c(c1N)O)Br 271570a_100011290941_100020748643 [1,0,0,0,0,0|1,1,0]=3 375 B11R1.278 CSc1ccc(c(c1N)O)Br 62a_100020748643_200000210301 [1,0,0,0,0,0|2,1,0]=4 376 B11R1.278 Cc1c(ccc(c1F)C=O)O 271570a_203496583355_100015546853 [1,0,0,0,0,0|3,0,0]=4 377 B11R1.278 Cc1c(ccc(c1O)C=O)F 271570a_203496583355_100009872231 [1,0,0,0,0,0|2,1,0]=4 378 B11R1.278 N#Cc1ccc(c(c1N)O)F 271570a_203496583355_100010128265 [1,0,0,0,0,0|1,1,1]=4 379 B11R1.278 O=Cc1ccc(c(c1F)F)O 271570a_203496583355_100010209662 [1,0,0,0,0,0|3,0,0]=4 380 B11R1.278 O=Cc1ccc(c(c1F)O)F 271570a_203496583355_100000050342 [1,0,0,0,0,0|1,1,0]=3 381 B11R1.278 O=Cc1ccc(c(c1O)F)F 271570a_203496583355_100015087033 [1,0,0,0,0,0|2,1,0]=4 382 B11R1.278 O=Cc1ccc(c(c1O)F)O 271570a_203496583355_100010762540 [1,0,0,0,0,0|3,0,0]=4 383 B11R1.278 [13CH3]Sc1ccc(c(c1N)O)Br 62a_100020748643_200025704644 [1,0,0,0,0,0|2,1,0]=4 384 B13R1.1808 CCC(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_100000210202 [0,1,0,0,0,0|2,1,0]=4 385 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_100000210202 [0,1,0,0,0,0|3,0,0]=4 386 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)C)Cl 1458a_100010074829_100000210202 [0,1,0,0,0,0|3,0,0]=4 387 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_100000210202 [0,1,0,0,0,0|3,0,0]=4 388 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_100000210202 [0,1,0,0,0,0|3,0,0]=4 389 B13R1.1808 CCC(=O)c1ccc(c(c1F)C)Cl 1458a_100012183103_100000210202 [0,1,0,0,0,0|3,0,0]=4 390 B13R1.1808 CCC(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_100000210202 [0,1,0,0,0,0|3,0,0]=4 391 B13R1.1808 CCC(=O)c1ccc(c(c1F)O)F 1458a_100000084588_100000210202 [0,1,0,0,0,0|2,1,0]=4 392 B13R1.1808 CCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000210202 [0,1,0,0,0,0|3,0,0]=4 393 B13R1.1808 CNC(=O)c1ccc(c(c1Br)O)Br 240690a_100102657272_100016068111 [0,1,0,0,0,0|2,1,0]=4 394 B13R1.1808 CNC(=O)c1ccc(c(c1Br)O)Br 527a_100102657272_100016068111 [0,1,0,0,0,0|2,1,0]=4 395 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Br)Cl 11a_106832991635_100010208263 [0,1,0,0,0,0|3,0,0]=4 396 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Br)Cl 1626a_100102657272_100010208263 [0,1,0,0,0,0|3,0,0]=4 397 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Br)Cl 240690a_100102657272_100010208263 [0,1,0,0,0,0|3,0,0]=4 398 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Br)Cl 527a_100102657272_100010208263 [0,1,0,0,0,0|3,0,0]=4 399 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)Cl 11a_106832991635_100010074829 [0,1,0,0,0,0|3,0,0]=4 400 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)Cl 1626a_100102657272_100010074829 [0,1,0,0,0,0|3,0,0]=4 401 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)Cl 240690a_100102657272_100010074829 [0,1,0,0,0,0|3,0,0]=4 402 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)Cl 527a_100102657272_100010074829 [0,1,0,0,0,0|3,0,0]=4 403 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)Cl 11a_106832991635_200010192171 [0,1,0,0,0,0|3,0,0]=4 404 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)Cl 1626a_100102657272_200010192171 [0,1,0,0,0,0|3,0,0]=4 405 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)Cl 240690a_100102657272_200010192171 [0,1,0,0,0,0|3,0,0]=4 406 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)Cl 527a_100102657272_200010192171 [0,1,0,0,0,0|3,0,0]=4 407 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)O)O 240690a_100102657272_100009910189 [0,1,0,0,0,0|3,0,0]=4 408 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Cl 11a_106832991635_100012183103 [0,1,0,0,0,0|3,0,0]=4 409 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Cl 1626a_100102657272_100012183103 [0,1,0,0,0,0|3,0,0]=4 410 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Cl 240690a_100102657272_100012183103 [0,1,0,0,0,0|3,0,0]=4 411 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Cl 527a_100102657272_100012183103 [0,1,0,0,0,0|3,0,0]=4 412 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Cl 11a_106832991635_100000085317 [0,1,0,0,0,0|3,0,0]=4 413 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Cl 1626a_100102657272_100000085317 [0,1,0,0,0,0|3,0,0]=4 414 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Cl 240690a_100102657272_100000085317 [0,1,0,0,0,0|3,0,0]=4 415 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Cl 527a_100102657272_100000085317 [0,1,0,0,0,0|3,0,0]=4 416 B13R1.1808 CNC(=O)c1ccc(c(c1F)O)F 240690a_100102657272_100000084588 [0,1,0,0,0,0|2,1,0]=4 417 B13R1.1808 COC(=O)c1ccc(c(c1C)C)O 271570a_203496583355_100010761469 [0,1,0,0,0,0|3,0,0]=4 418 B13R1.1808 COC(=O)c1ccc(c(c1C)F)O 271570a_203496583355_100010291505 [0,1,0,0,0,0|3,0,0]=4 419 B13R1.1808 COC(=O)c1ccc(c(c1C)O)C 271570a_203496583355_200010734123 [0,1,0,0,0,0|2,0,0]=3 420 B13R1.1808 COC(=O)c1ccc(c(c1C)O)N 271570a_203496583355_100010764323 [0,1,0,0,0,0|2,0,0]=3 421 B13R1.1808 COC(=O)c1ccc(c(c1C)O)O 271570a_203496583355_100010889012 [0,1,0,0,0,0|2,0,0]=3 422 B13R1.1808 COC(=O)c1ccc(c(c1Cl)O)N 271570a_203496583355_200016031531 [0,1,0,0,0,0|2,0,0]=3 423 B13R1.1808 COC(=O)c1ccc(c(c1F)C)O 271570a_203496583355_100010172522 [0,1,0,0,0,0|3,0,0]=4 424 B13R1.1808 COC(=O)c1ccc(c(c1F)F)O 271570a_203496583355_100010982024 [0,1,0,0,0,0|3,0,0]=4 425 B13R1.1808 COC(=O)c1ccc(c(c1F)O)F 271570a_203496583355_100000697099 [0,1,0,0,0,0|1,1,0]=3 426 B13R1.1808 COC(=O)c1ccc(c(c1F)O)O 271570a_203496583355_100011096176 [0,1,0,0,0,0|2,0,0]=3 427 B13R1.1808 COC(=O)c1ccc(c(c1N)C)O 271570a_203496583355_100000764893 [0,1,0,0,0,0|2,0,0]=3 428 B13R1.1808 COC(=O)c1ccc(c(c1N)F)O 271570a_203496583355_100022009169 [0,1,0,0,0,0|2,0,0]=3 429 B13R1.1808 COC(=O)c1ccc(c(c1O)F)F 271570a_203496583355_100010710315 [0,1,0,0,0,0|2,1,0]=4 430 B13R1.1808 COC(=O)c1ccc(c(c1O)F)O 271570a_203496583355_100011092008 [0,1,0,0,0,0|3,0,0]=4 431 B13R1.1808 Cc1c(ccc(c1Cl)C(=O)CF)Cl 1458a_100010074829_100015361967 [0,1,0,0,0,0|3,0,0]=4 432 B13R1.1808 Cc1c(ccc(c1F)C(=O)CF)Cl 1458a_100012183103_100015361967 [0,1,0,0,0,0|3,0,0]=4 433 B13R1.1808 O=C(CF)c1ccc(c(c1Br)O)Br 1458a_100016068111_100015361967 [0,1,0,0,0,0|2,1,0]=4 434 B13R1.1808 O=C(CF)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_100015361967 [0,1,0,0,0,0|3,0,0]=4 435 B13R1.1808 O=C(CF)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_100015361967 [0,1,0,0,0,0|3,0,0]=4 436 B13R1.1808 O=C(CF)c1ccc(c(c1Cl)O)O 1458a_100009910189_100015361967 [0,1,0,0,0,0|3,0,0]=4 437 B13R1.1808 O=C(CF)c1ccc(c(c1F)F)Cl 1458a_100000085317_100015361967 [0,1,0,0,0,0|3,0,0]=4 438 B13R1.1808 O=C(CF)c1ccc(c(c1F)O)F 1458a_100000084588_100015361967 [0,1,0,0,0,0|2,1,0]=4 439 B13R1.1808 O=C(CF)c1ccc(c(c1O)O)O 1458a_100000037941_100015361967 [0,1,0,0,0,0|3,0,0]=4 440 B13R1.2811 CC(=O)c1cc(c(c(c1Cl)Cl)Cl)Cl 1458a_100009827746_200000210301 [0,1,0,0,0,0|3,0,0]=4 441 B13R1.2811 CC(=O)c1cc(c(c(c1F)O)F)F 1458a_100000737090_200000210301 [0,1,0,0,0,0|2,1,0]=4 442 B13R1.2811 NC(=O)c1cc(c(c(c1N)F)Br)O 271570a_203496583355_102495333281 [0,1,0,0,0,0|2,1,0]=4 443 B13R1.2811 [13CH3]C(=O)c1cc(c(c(c1Cl)Cl)Cl)Cl 1458a_100009827746_200025704644 [0,1,0,0,0,0|3,0,0]=4 444 B13R1.2811 [13CH3]C(=O)c1cc(c(c(c1F)O)F)F 1458a_100000737090_200025704644 [0,1,0,0,0,0|2,1,0]=4 445 B13R1.2812 CC(=O)c1c(cc(c(c1Br)O)Br)Br 1458a_100009813419_200000210301 [0,1,0,0,0,0|2,1,0]=4 446 B13R1.2812 CC(=O)c1c(cc(c(c1Br)O)C)C 1458a_200009992459_200000210301 [0,1,0,0,0,0|3,0,0]=4 447 B13R1.2812 Cc1cc(c(c(c1O)Br)C(=O)[13CH3])C 1458a_200009992459_200025704644 [0,1,0,0,0,0|3,0,0]=4 448 B13R1.2812 [13CH3]C(=O)c1c(cc(c(c1Br)O)Br)Br 1458a_100009813419_200025704644 [0,1,0,0,0,0|2,1,0]=4 449 B13R1.3096 COc1ccc(c(c1O)N)C(=O)C 271570a_203496583355_100010236346 [0,1,0,0,0,0|2,0,0]=3 450 B13R1.3096 COc1ccc(c(c1O)O)C(=O)C 1458a_100000045701_200000210301 [0,1,0,0,0,0|3,0,0]=4 451 B13R1.3096 COc1ccc(c(c1O)O)C(=O)[13CH3] 1458a_100000045701_200025704644 [0,1,0,0,0,0|3,0,0]=4 452 B13R1.3158 COc1c(ccc(c1Cl)Cl)C(=O)C 1458a_100010981877_200000210301 [0,1,0,0,0,0|3,0,0]=4 453 B13R1.3158 COc1c(ccc(c1Cl)Cl)C(=O)[13CH3] 1458a_100010981877_200025704644 [0,1,0,0,0,0|3,0,0]=4 454 B13R1.3230 C=C(C)c1ccc(c(c1F)OC)Cl 271570a_100000694244_200135222481 [0,1,0,0,0,0|3,0,0]=4 455 B13R1.3230 COc1c(ccc(c1F)C(=O)C)Br 1458a_100009816242_200000210301 [0,1,0,0,0,0|2,1,0]=4 456 B13R1.3230 COc1c(ccc(c1F)C(=O)C)Cl 1458a_100010116254_200000210301 [0,1,0,0,0,0|2,0,0]=3 457 B13R1.3230 COc1c(ccc(c1F)C(=O)C)F 1458a_100000061937_200000210301 [0,1,0,0,0,0|2,1,0]=4 458 B13R1.3230 COc1c(ccc(c1F)C(=O)[13CH3])Br 1458a_100009816242_200025704644 [0,1,0,0,0,0|2,1,0]=4 459 B13R1.3230 COc1c(ccc(c1F)C(=O)[13CH3])Cl 1458a_100010116254_200025704644 [0,1,0,0,0,0|2,0,0]=3 460 B13R1.3230 COc1c(ccc(c1F)C(=O)[13CH3])F 1458a_100000061937_200025704644 [0,1,0,0,0,0|2,1,0]=4 461 B13R1.3230 CSc1c(ccc(c1F)C(=O)C)Cl 1458a_200134766191_200000210301 [0,1,0,0,0,0|2,1,0]=4 462 B13R1.3230 CSc1c(ccc(c1F)C(=O)[13CH3])Cl 1458a_200134766191_200025704644 [0,1,0,0,0,0|2,1,0]=4 463 B13R2.5180 Cc1c(ccc2c1COC2=O)O 271570a_203496583355_100010986288 [0,0,0,1,0,0|3,0,0]=4 464 B13R2.5180 Cc1ccc2c(c1O)CCC2=O 271570a_203496583355_100010133459 [0,0,0,1,0,0|3,0,0]=4 465 B13R2.5180 O=C1CCc2c1ccc(c2O)F 271570a_203496583355_200010133454 [0,0,0,1,0,0|2,1,0]=4 466 B13R1.3528 CC(=Cc1ccc(c(c1N)O)Br)C 271570a_100102525489_100020748643 [0,0,0,0,0,1|2,1,0]=4 467 B13R1.3528 CC(=O)Nc1ccc(c(c1Br)Cl)Cl 11a_100021501213_100015343762 [0,0,0,0,0,1|3,0,0]=4 468 B13R1.3528 CC(=O)Nc1ccc(c(c1Br)Cl)Cl 1626a_100021501213_100015343762 [0,0,0,0,0,1|3,0,0]=4 469 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)Cl 11a_100016073598_100015343762 [0,0,0,0,0,1|3,0,0]=4 470 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)Cl 1626a_100016073598_100015343762 [0,0,0,0,0,1|3,0,0]=4 471 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)Cl 22a_100016073598_100000070787 [0,0,0,0,0,1|3,0,0]=4 472 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)Cl 527a_100016073598_100103153847 [0,0,0,0,0,1|3,0,0]=4 473 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Cl)Cl 11a_114948340058_100015343762 [0,0,0,0,0,1|3,0,0]=4 474 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Cl)Cl 1626a_114948340058_100015343762 [0,0,0,0,0,1|3,0,0]=4 475 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)C)Cl 11a_100011935240_100015343762 [0,0,0,0,0,1|3,0,0]=4 476 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)C)Cl 1626a_100011935240_100015343762 [0,0,0,0,0,1|3,0,0]=4 477 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)C)Cl 22a_100011935240_100000070787 [0,0,0,0,0,1|3,0,0]=4 478 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)Cl)Cl 11a_200000033989_100015343762 [0,0,0,0,0,1|3,0,0]=4 479 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)Cl)Cl 1626a_200000033989_100015343762 [0,0,0,0,0,1|3,0,0]=4 480 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)F)Cl 11a_100000069711_100015343762 [0,0,0,0,0,1|3,0,0]=4 481 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)F)Cl 1626a_100000069711_100015343762 [0,0,0,0,0,1|3,0,0]=4 482 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)O)C 11a_100000036876_100015343762 [0,0,0,0,0,1|3,0,0]=4 483 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)O)C 22a_100000036876_100000070787 [0,0,0,0,0,1|3,0,0]=4 484 B13R1.3528 CC(=O)Nc1ccc(c(c1F)Cl)Cl 11a_100000036759_100015343762 [0,0,0,0,0,1|3,0,0]=4 485 B13R1.3528 CC(=O)Nc1ccc(c(c1F)Cl)Cl 1626a_100000036759_100015343762 [0,0,0,0,0,1|3,0,0]=4 486 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)Cl 11a_100000088996_100015343762 [0,0,0,0,0,1|3,0,0]=4 487 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)Cl 1626a_100000088996_100015343762 [0,0,0,0,0,1|3,0,0]=4 488 B13R1.3528 CC(=O)Nc1ccc(c(c1I)Cl)Cl 11a_200011093878_100015343762 [0,0,0,0,0,1|3,0,0]=4 489 B13R1.3528 CC(=O)Nc1ccc(c(c1I)Cl)Cl 1626a_200011093878_100015343762 [0,0,0,0,0,1|3,0,0]=4 490 B13R1.3528 CC(=O)Nc1ccc(c(c1I)F)Cl 11a_100010134325_100015343762 [0,0,0,0,0,1|3,0,0]=4 491 B13R1.3528 CC(=O)Nc1ccc(c(c1I)F)Cl 1626a_100010134325_100015343762 [0,0,0,0,0,1|3,0,0]=4 492 B10R1.13 C=C(C)c1ccc(cc1)Cl 271570a_100000694244_100000755918 [2,0,0,0,0,0|2,0,0]=4 493 B10R1.13 CC(=O)c1ccc(cc1)Br 1458a_100000185839_200000210301 [2,0,0,0,0,0|1,1,0]=4 494 B10R1.13 CC(=O)c1ccc(cc1)C 1458a_100000188618_200000210301 [2,0,0,0,0,0|2,0,0]=4 495 B10R1.13 CC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000210301 [2,0,0,0,0,0|1,0,0]=3 496 B10R1.13 CC(=O)c1ccc(cc1)F 1458a_100000187176_200000210301 [2,0,0,0,0,0|1,1,0]=4 497 B10R1.13 CC(=O)c1ccc(cc1)I 1458a_100000187904_200000210301 [2,0,0,0,0,0|1,1,0]=4 498 B10R1.13 CC(=O)c1ccc(cc1)O 1458a_100000212099_200000210301 [2,0,0,0,0,0|2,0,0]=4 499 B10R1.13 CC(=O)c1ccc(cc1)O 271570a_203496583355_100000185465 [2,0,0,0,0,0|2,0,0]=4 500 B10R1.13 Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000188618_200025704644 [2,0,0,0,0,0|2,0,0]=4 501 B10R1.13 NC(=O)c1ccc(cc1)O 271570a_203496583355_100000162191 [2,0,0,0,0,0|2,0,0]=4 502 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Br 1458a_100000185839_200025704644 [2,0,0,0,0,0|1,1,0]=4 503 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Cl 1458a_100000210187_200025704644 [2,0,0,0,0,0|1,0,0]=3 504 B10R1.13 [13CH3]C(=O)c1ccc(cc1)F 1458a_100000187176_200025704644 [2,0,0,0,0,0|1,1,0]=4 505 B10R1.13 [13CH3]C(=O)c1ccc(cc1)I 1458a_100000187904_200025704644 [2,0,0,0,0,0|1,1,0]=4 506 B10R1.13 [13CH3]C(=O)c1ccc(cc1)O 1458a_100000212099_200025704644 [2,0,0,0,0,0|2,0,0]=4 507 B10R1.113 C=C(C)c1cccc(c1)O 271570a_100000694244_100000211634 [2,0,0,0,0,0|2,0,0]=4 508 B10R1.113 C=C(C)c1cccc(c1)O 271570a_203496583355_100012123953 [2,0,0,0,0,0|2,0,0]=4 509 B10R1.113 CC(=O)c1cc(ccn1)O 271570a_203496583355_100000709912 [2,0,0,0,0,0|2,0,0]=4 510 B10R1.113 CC(=O)c1cccc(c1)Br 1458a_100000210664_200000210301 [2,0,0,0,0,0|2,0,0]=4 511 B10R1.113 CC(=O)c1cccc(c1)C 1458a_100000189346_200000210301 [2,0,0,0,0,0|2,0,0]=4 512 B10R1.113 CC(=O)c1cccc(c1)Cl 1458a_100000210390_200000210301 [2,0,0,0,0,0|2,0,0]=4 513 B10R1.113 CC(=O)c1cccc(c1)F 1458a_100000210950_200000210301 [2,0,0,0,0,0|2,0,0]=4 514 B10R1.113 CC(=O)c1cccc(c1)I 1458a_100000184098_200000210301 [2,0,0,0,0,0|2,0,0]=4 515 B10R1.113 CC(=O)c1cccc(c1)O 1458a_100000183914_200000210301 [2,0,0,0,0,0|1,0,0]=3 516 B10R1.113 CC(=O)c1cccc(c1)O 271570a_203496583355_100000210093 [2,0,0,0,0,0|1,0,0]=3 517 B10R1.113 CC(=O)c1cccc(n1)O 271570a_203496583355_100009816502 [2,0,0,0,0,0|2,0,0]=4 518 B10R1.113 CC(=O)c1ccnc(c1)O 271570a_203496583355_100000685609 [2,0,0,0,0,0|2,0,0]=4 519 B10R1.113 CC(=O)c1cncc(c1)O 271570a_203496583355_100011216243 [2,0,0,0,0,0|2,0,0]=4 520 B10R1.113 CC(O)c1cccc(c1)O 271570a_203496583355_100000246457 [2,0,0,0,0,0|1,0,1]=4 521 B10R1.113 CS(=O)c1cccc(c1)O 271570a_203496583355_100009816267 [2,0,0,0,0,0|2,0,0]=4 522 B10R1.113 Cc1cccc(c1)C(=O)[13CH3] 1458a_100000189346_200025704644 [2,0,0,0,0,0|2,0,0]=4 523 B10R1.113 NC(=O)c1cc(ccn1)O 271570a_203496583355_100000229564 [2,0,0,0,0,0|2,0,0]=4 524 B10R1.113 NC(=O)c1cccc(c1)O 271570a_203496583355_100000162208 [2,0,0,0,0,0|1,0,0]=3 525 B10R1.113 NC(=O)c1cccc(n1)O 271570a_203496583355_100011834053 [2,0,0,0,0,0|2,0,0]=4 526 B10R1.113 NC(=O)c1ccnc(c1)O 271570a_203496583355_100000229836 [2,0,0,0,0,0|2,0,0]=4 527 B10R1.113 NC(=O)c1cncc(c1)O 271570a_203496583355_100000162242 [2,0,0,0,0,0|2,0,0]=4 528 B10R1.113 OB(O)c1cccc(c1)O 271570a_203496583355_100000687717 [2,0,0,0,0,0|1,0,1]=4 529 B10R1.113 [13CH3]C(=O)c1cccc(c1)Br 1458a_100000210664_200025704644 [2,0,0,0,0,0|2,0,0]=4 530 B10R1.113 [13CH3]C(=O)c1cccc(c1)Cl 1458a_100000210390_200025704644 [2,0,0,0,0,0|2,0,0]=4 531 B10R1.113 [13CH3]C(=O)c1cccc(c1)F 1458a_100000210950_200025704644 [2,0,0,0,0,0|2,0,0]=4 532 B10R1.113 [13CH3]C(=O)c1cccc(c1)I 1458a_100000184098_200025704644 [2,0,0,0,0,0|2,0,0]=4 533 B10R1.113 [13CH3]C(=O)c1cccc(c1)O 1458a_100000183914_200025704644 [2,0,0,0,0,0|1,0,0]=3 534 B10R1.176 C=Cc1ccc(c(c1)Br)Cl 271570a_100011290941_100012353702 [2,0,0,0,0,0|2,0,0]=4 535 B10R1.176 C=Cc1ccc(c(c1)C)Cl 271570a_100011290941_100000049509 [2,0,0,0,0,0|2,0,0]=4 536 B10R1.176 C=Cc1ccc(c(c1)Cl)Cl 271570a_100011290941_100011214914 [2,0,0,0,0,0|2,0,0]=4 537 B10R1.176 C=Cc1ccc(c(c1)F)Cl 271570a_100011290941_100011216805 [2,0,0,0,0,0|2,0,0]=4 538 B10R1.176 C=Cc1ccc(c(c1)N)Cl 271570a_100011290941_200000761891 [2,0,0,0,0,0|2,0,0]=4 539 B10R1.176 C=Cc1ccc(c(c1)O)Br 271570a_100011290941_100012356990 [2,0,0,0,0,0|1,1,0]=4 540 B10R1.176 C=Cc1ccc(c(c1)O)C 271570a_100011290941_100000766334 [2,0,0,0,0,0|2,0,0]=4 541 B10R1.176 C=Cc1ccc(c(c1)O)Cl 271570a_100011290941_100011356854 [2,0,0,0,0,0|1,0,0]=3 542 B10R1.176 C=Cc1ccc(c(c1)O)F 271570a_100011290941_100000686035 [2,0,0,0,0,0|1,1,0]=4 543 B10R1.176 C=Cc1ccc(c(c1)O)N 271570a_100011290941_100000739049 [2,0,0,0,0,0|2,0,0]=4 544 B10R1.176 C=Cc1ccc(c(c1)O)O 271570a_100011290941_100009813601 [2,0,0,0,0,0|2,0,0]=4 545 B10R1.176 CNc1ccc(c(c1)O)Cl 34a_100011934209_200000210301 [2,0,0,0,0,0|2,0,0]=4 546 B10R1.176 COc1ccc(c(c1)O)Cl 271570a_203496583355_100011356938 [2,0,0,0,0,0|2,0,0]=4 547 B10R1.176 CSc1ccc(c(c1)O)Cl 62a_100011356854_200000210301 [2,0,0,0,0,0|2,0,0]=4 548 B10R1.176 CSc1ccc(c(c1)O)Cl 62a_200000210301_100011356854 [2,0,0,0,0,0|2,0,0]=4 549 B10R1.176 Cc1cc(ccc1O)C=O 271570a_203496583355_100000765772 [2,0,0,0,0,0|2,0,0]=4 550 B10R1.176 Cc1ccc(cc1O)C=O 271570a_203496583355_100000695567 [2,0,0,0,0,0|1,0,0]=3 551 B10R1.176 Cc1ccc(cc1O)CO 271570a_203496583355_100000050133 [2,0,0,0,0,0|1,0,1]=4 552 B10R1.176 Cc1cnc(cc1O)C=O 271570a_203496583355_100010174032 [2,0,0,0,0,0|2,0,0]=4 553 B10R1.176 N#Cc1ccc(c(c1)O)Cl 271570a_203496583355_100010199462 [2,0,0,0,0,0|1,0,1]=4 554 B10R1.176 Nc1ncc(cc1O)C=O 271570a_203496583355_100010064899 [2,0,0,0,0,0|2,0,0]=4 555 B10R1.176 O=Cc1ccc(c(c1)F)O 271570a_203496583355_100000686674 [2,0,0,0,0,0|2,0,0]=4 556 B10R1.176 O=Cc1ccc(c(c1)O)Br 271570a_203496583355_100010146563 [2,0,0,0,0,0|0,1,0]=3 557 B10R1.176 O=Cc1ccc(c(c1)O)Cl 271570a_203496583355_100010209939 [2,0,0,0,0,0|0,0,0]=2 558 B10R1.176 O=Cc1ccc(c(c1)O)F 271570a_203496583355_100000211747 [2,0,0,0,0,0|0,1,0]=3 559 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000041418 [2,0,0,0,0,0|1,0,0]=3 560 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000184552 [2,0,0,0,0,0|1,0,0]=3 561 B10R1.176 O=Cc1cnc(c(c1)O)O 271570a_203496583355_100010064886 [2,0,0,0,0,0|2,0,0]=4 562 B10R1.176 OCc1ccc(c(c1)O)F 271570a_203496583355_100000246287 [2,0,0,0,0,0|0,1,1]=4 563 B10R1.176 OCc1ccc(c(c1)O)O 271570a_203496583355_100000049605 [2,0,0,0,0,0|1,0,1]=4 564 B10R1.176 OCc1ccc(c(c1)O)O 271570a_203496583355_100011191544 [2,0,0,0,0,0|1,0,1]=4 565 B10R1.176 OCc1cnc(c(c1)O)Cl 271570a_203496583355_200015217190 [2,0,0,0,0,0|1,0,1]=4 566 B10R1.176 [13CH3]Nc1ccc(c(c1)O)Cl 34a_100011934209_200025704644 [2,0,0,0,0,0|2,0,0]=4 567 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Cl 62a_100011356854_200025704644 [2,0,0,0,0,0|2,0,0]=4 568 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Cl 62a_200025704644_100011356854 [2,0,0,0,0,0|2,0,0]=4 569 B10R1.2 C=Cc1cccc(c1Br)O 271570a_100011290941_100010187914 [2,0,0,0,0,0|2,0,0]=4 570 B10R1.2 C=Cc1cccc(c1C)O 271570a_100011290941_100012002258 [2,0,0,0,0,0|2,0,0]=4 571 B10R1.2 C=Cc1cccc(c1Cl)O 271570a_100011290941_100000049636 [2,0,0,0,0,0|2,0,0]=4 572 B10R1.2 C=Cc1cccc(c1F)O 271570a_100011290941_100009817021 [2,0,0,0,0,0|2,0,0]=4 573 B10R1.2 C=Cc1cccc(c1N)Br 271570a_100011290941_100010146558 [2,0,0,0,0,0|2,0,0]=4 574 B10R1.2 C=Cc1cccc(c1N)C 271570a_100011290941_100011834072 [2,0,0,0,0,0|2,0,0]=4 575 B10R1.2 C=Cc1cccc(c1N)Cl 271570a_100011290941_100010190421 [2,0,0,0,0,0|2,0,0]=4 576 B10R1.2 C=Cc1cccc(c1N)F 271570a_100011290941_100000042321 [2,0,0,0,0,0|2,0,0]=4 577 B10R1.2 C=Cc1cccc(c1N)N 271570a_100011290941_100015191791 [2,0,0,0,0,0|2,0,0]=4 578 B10R1.2 C=Cc1cccc(c1N)O 271570a_100011290941_100011934926 [2,0,0,0,0,0|1,0,0]=3 579 B10R1.2 C=Cc1cccc(c1O)O 271570a_100011290941_100009815950 [2,0,0,0,0,0|2,0,0]=4 580 B10R1.2 C=Cc1nccc(c1N)O 271570a_100011290941_100000128729 [2,0,0,0,0,0|2,0,0]=4 581 B10R1.2 CNc1cccc(c1N)O 271570a_203496583355_100000695761 [2,0,0,0,0,0|2,0,0]=4 582 B10R1.2 COc1cccc(c1N)O 271570a_203496583355_100000708083 [2,0,0,0,0,0|2,0,0]=4 583 B10R1.2 CSc1cccc(c1N)O 62a_200000210301_100011934926 [2,0,0,0,0,0|2,0,0]=4 584 B10R1.2 Cc1c(cccc1C=O)O 271570a_203496583355_100012179384 [2,0,0,0,0,0|1,0,0]=3 585 B10R1.2 Cc1c(cccc1CO)O 271570a_203496583355_100000694458 [2,0,0,0,0,0|1,0,1]=4 586 B10R1.2 Cc1c(ccnc1O)C=O 271570a_203496583355_100000096011 [2,0,0,0,0,0|2,0,0]=4 587 B10R1.2 Cc1c(cncc1C=O)O 271570a_203496583355_100010214934 [2,0,0,0,0,0|2,0,0]=4 588 B10R1.2 N#Cc1cccc(c1N)O 271570a_203496583355_100000690598 [2,0,0,0,0,0|1,0,1]=4 589 B10R1.2 Nc1c(cccc1C=O)O 271570a_203496583355_100010144990 [2,0,0,0,0,0|0,0,0]=2 590 B10R1.2 Nc1c(cccc1CO)O 271570a_203496583355_100012349457 [2,0,0,0,0,0|0,0,1]=3 591 B10R1.2 Nc1c(cncc1CO)O 271570a_203496583355_200010988789 [2,0,0,0,0,0|1,0,1]=4 592 B10R1.2 O=Cc1cccc(c1F)O 271570a_203496583355_100000766533 [2,0,0,0,0,0|1,0,0]=3 593 B10R1.2 O=Cc1cccc(c1O)F 271570a_203496583355_100011998484 [2,0,0,0,0,0|2,0,0]=4 594 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100000737635 [2,0,0,0,0,0|1,0,0]=3 595 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100009816417 [2,0,0,0,0,0|1,0,0]=3 596 B10R1.2 O=Cc1ccnc(c1F)O 271570a_203496583355_100010064874 [2,0,0,0,0,0|2,0,0]=4 597 B10R1.2 O=Cc1nccc(c1F)O 271570a_203496583355_100015713984 [2,0,0,0,0,0|2,0,0]=4 598 B10R1.2 OCc1cccc(c1Br)O 271570a_203496583355_100010240205 [2,0,0,0,0,0|1,0,1]=4 599 B10R1.2 OCc1cccc(c1F)O 271570a_203496583355_100011935076 [2,0,0,0,0,0|1,0,1]=4 600 B10R1.2 [13CH3]Sc1cccc(c1N)O 62a_200025704644_100011934926 [2,0,0,0,0,0|2,0,0]=4 601 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [2,0,0,0,0,0|2,0,0]=4 602 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [2,0,0,0,0,0|2,0,0]=4 603 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [2,0,0,0,0,0|2,0,0]=4 604 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [2,0,0,0,0,0|2,0,0]=4 605 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [2,0,0,0,0,0|2,0,0]=4 606 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [2,0,0,0,0,0|2,0,0]=4 607 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [2,0,0,0,0,0|2,0,0]=4 608 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [2,0,0,0,0,0|2,0,0]=4 609 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [2,0,0,0,0,0|2,0,0]=4 610 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [2,0,0,0,0,0|2,0,0]=4 611 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [2,0,0,0,0,0|2,0,0]=4 612 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [2,0,0,0,0,0|2,0,0]=4 613 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [2,0,0,0,0,0|2,0,0]=4 614 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [2,0,0,0,0,0|2,0,0]=4 615 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [2,0,0,0,0,0|2,0,0]=4 616 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [2,0,0,0,0,0|2,0,0]=4 617 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [2,0,0,0,0,0|2,0,0]=4 618 B10R1.25 C=Cc1ccc(cc1Br)Cl 271570a_100011290941_100011219703 [2,0,0,0,0,0|2,0,0]=4 619 B10R1.25 C=Cc1ccc(cc1C)Cl 271570a_100011290941_100011219607 [2,0,0,0,0,0|2,0,0]=4 620 B10R1.25 C=Cc1ccc(cc1Cl)Cl 271570a_100011290941_100000699841 [2,0,0,0,0,0|2,0,0]=4 621 B10R1.25 C=Cc1ccc(cc1F)Cl 271570a_100011290941_100011216042 [2,0,0,0,0,0|2,0,0]=4 622 B10R1.25 C=Cc1ccc(cc1N)Br 271570a_100011290941_100000743836 [2,0,0,0,0,0|1,1,0]=4 623 B10R1.25 C=Cc1ccc(cc1N)C 271570a_100011290941_100011216686 [2,0,0,0,0,0|2,0,0]=4 624 B10R1.25 C=Cc1ccc(cc1N)Cl 271570a_100011290941_100000761886 [2,0,0,0,0,0|1,0,0]=3 625 B10R1.25 C=Cc1ccc(cc1N)F 271570a_100011290941_100011218093 [2,0,0,0,0,0|1,1,0]=4 626 B10R1.25 C=Cc1ccc(cc1N)N 271570a_100011290941_200012175722 [2,0,0,0,0,0|2,0,0]=4 627 B10R1.25 C=Cc1ccc(cc1N)O 271570a_100011290941_100011999798 [2,0,0,0,0,0|2,0,0]=4 628 B10R1.25 C=Cc1ccc(cc1O)Cl 271570a_100011290941_100000050036 [2,0,0,0,0,0|2,0,0]=4 629 B10R1.25 C=Cc1ccc(nc1N)Cl 271570a_100011290941_100010171640 [2,0,0,0,0,0|2,0,0]=4 630 B10R1.25 COc1ccc(cc1N)Cl 34a_100000210500_200000210301 [2,0,0,0,0,0|2,0,0]=4 631 B10R1.25 COc1ccc(cc1N)Cl 7a_100000210500_200000210301 [2,0,0,0,0,0|2,0,0]=4 632 B10R1.25 CSc1ccc(cc1N)Cl 62a_100000761886_200000210301 [2,0,0,0,0,0|2,0,0]=4 633 B10R1.25 CSc1ccc(cc1N)Cl 62a_200000210301_100000761886 [2,0,0,0,0,0|2,0,0]=4 634 B10R1.25 Cc1cc(ccc1C=O)O 271570a_203496583355_100000687586 [2,0,0,0,0,0|2,0,0]=4 635 B10R1.25 Cc1ccc(c(c1)O)C=O 271570a_203496583355_100000692596 [2,0,0,0,0,0|2,0,0]=4 636 B10R1.25 Nc1cc(ccc1C=O)O 271570a_203496583355_100009814810 [2,0,0,0,0,0|1,0,0]=3 637 B10R1.25 Nc1cc(ccc1CO)O 271570a_203496583355_100000718831 [2,0,0,0,0,0|1,0,1]=4 638 B10R1.25 O=Cc1ccc(cc1Br)O 271570a_203496583355_100010185650 [2,0,0,0,0,0|2,0,0]=4 639 B10R1.25 O=Cc1ccc(cc1Cl)O 271570a_203496583355_100000727542 [2,0,0,0,0,0|2,0,0]=4 640 B10R1.25 O=Cc1ccc(cc1F)O 271570a_203496583355_100000211676 [2,0,0,0,0,0|2,0,0]=4 641 B10R1.25 O=Cc1ccc(cc1O)Br 271570a_203496583355_100010146562 [2,0,0,0,0,0|1,1,0]=4 642 B10R1.25 O=Cc1ccc(cc1O)F 271570a_203496583355_100000752949 [2,0,0,0,0,0|1,1,0]=4 643 B10R1.25 O=Cc1ccc(cc1O)O 271570a_203496583355_100011236494 [2,0,0,0,0,0|2,0,0]=4 644 B10R1.25 O=Cc1ccc(cc1O)O 271570a_203496583355_100011277552 [2,0,0,0,0,0|2,0,0]=4 645 B10R1.25 OCc1ccc(cc1O)Cl 271570a_203496583355_100000722340 [2,0,0,0,0,0|1,0,1]=4 646 B10R1.25 [13CH3]Oc1ccc(cc1N)Cl 34a_100000210500_200025704644 [2,0,0,0,0,0|2,0,0]=4 647 B10R1.25 [13CH3]Oc1ccc(cc1N)Cl 7a_100000210500_200025704644 [2,0,0,0,0,0|2,0,0]=4 648 B10R1.25 [13CH3]Sc1ccc(cc1N)Cl 62a_100000761886_200025704644 [2,0,0,0,0,0|2,0,0]=4 649 B10R1.25 [13CH3]Sc1ccc(cc1N)Cl 62a_200025704644_100000761886 [2,0,0,0,0,0|2,0,0]=4 650 B10R1.119 Cc1c(ccc(c1Cl)O)Cl 271570a_203496583355_100010730154 [2,0,0,0,0,0|2,0,0]=4 651 B10R1.119 Cc1c(ccc(c1N)O)F 271570a_203496583355_100011009917 [2,0,0,0,0,0|1,1,0]=4 652 B10R1.119 Cc1c(ccc(c1N)O)O 271570a_203496583355_100013039247 [2,0,0,0,0,0|2,0,0]=4 653 B10R1.119 Cc1ccc(c(c1O)C)O 271570a_203496583355_100010659238 [2,0,0,0,0,0|2,0,0]=4 654 B10R1.119 Nc1c(ccc(c1F)F)O 271570a_203496583355_100010008850 [2,0,0,0,0,0|1,1,0]=4 655 B10R1.119 Nc1c(ccc(c1N)F)O 271570a_203496583355_100011102919 [2,0,0,0,0,0|1,1,0]=4 656 B10R1.119 Nc1c(ccc(c1O)Br)O 271570a_203496583355_100020748643 [2,0,0,0,0,0|0,1,0]=3 657 B10R1.119 Nc1c(ccc(c1O)F)F 271570a_203496583355_100014094178 [2,0,0,0,0,0|1,1,0]=4 658 B10R1.119 Nc1ccc(c(c1N)O)F 271570a_203496583355_100010128261 [2,0,0,0,0,0|1,1,0]=4 659 B10R1.119 Oc1c(ccc(c1Cl)Cl)Cl 271570a_203496583355_200010170825 [2,0,0,0,0,0|2,0,0]=4 660 B10R1.119 Oc1c(ccc(c1F)Br)Cl 271570a_203496583355_100011092007 [2,0,0,0,0,0|2,0,0]=4 661 B10R1.119 Oc1ccc(c(c1F)O)Br 271570a_203496583355_200010782288 [2,0,0,0,0,0|1,1,0]=4 662 B10R1.119 Oc1ccc(c(c1F)O)F 271570a_203496583355_100010167067 [2,0,0,0,0,0|1,1,0]=4 663 B12R1.48 C=Cc1ccc(cc1O)C(=O)N 271570a_100011290941_100012344895 [1,1,0,0,0,0|2,0,0]=4 664 B12R1.48 CCc1ccc(cc1O)C(=O)C 1458a_100000089006_200000210301 [1,1,0,0,0,0|2,0,0]=4 665 B12R1.48 CCc1ccc(cc1O)C(=O)[13CH3] 1458a_100000089006_200025704644 [1,1,0,0,0,0|2,0,0]=4 666 B12R1.48 COc1ccc(cc1O)C(=O)C 1458a_100000766810_200000210301 [1,1,0,0,0,0|2,0,0]=4 667 B12R1.48 COc1ccc(cc1O)C(=O)C 271570a_203496583355_100000185153 [1,1,0,0,0,0|2,0,0]=4 668 B12R1.48 COc1ccc(cc1O)C(=O)[13CH3] 1458a_100000766810_200025704644 [1,1,0,0,0,0|2,0,0]=4 669 B12R1.48 CSc1ccc(cc1O)C(=O)N 62a_100012344895_200000210301 [1,1,0,0,0,0|2,0,0]=4 670 B12R1.48 CSc1ccc(cc1O)C(=O)N 62a_200000210301_100012344895 [1,1,0,0,0,0|2,0,0]=4 671 B12R1.48 [13CH3]Sc1ccc(cc1O)C(=O)N 62a_100012344895_200025704644 [1,1,0,0,0,0|2,0,0]=4 672 B12R1.48 [13CH3]Sc1ccc(cc1O)C(=O)N 62a_200025704644_100012344895 [1,1,0,0,0,0|2,0,0]=4 673 B12R1.56 C=C(C)c1ccc(c(c1)CO)Cl 271570a_100000694244_100010128486 [1,1,0,0,0,0|2,0,0]=4 674 B12R1.56 C=C(C)c1ccc(c(c1)OC)Cl 271570a_100000694244_100011356853 [1,1,0,0,0,0|2,0,0]=4 675 B12R1.56 CC(=O)c1ccc(c(c1)C#N)Cl 1458a_100000696165_200000210301 [1,1,0,0,0,0|2,0,0]=4 676 B12R1.56 CC(=O)c1ccc(c(c1)CO)Br 1458a_100010218026_200000210301 [1,1,0,0,0,0|1,1,0]=4 677 B12R1.56 CC(=O)c1ccc(c(c1)CO)F 1458a_100011803322_200000210301 [1,1,0,0,0,0|1,1,0]=4 678 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000084092_200025704644 [1,1,0,0,0,0|2,0,0]=4 679 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000084092_200025704644 [1,1,0,0,0,0|2,0,0]=4 680 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000117923_200025704644 [1,1,0,0,0,0|1,1,0]=4 681 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000117923_200025704644 [1,1,0,0,0,0|1,1,0]=4 682 B12R1.56 CCc1cc(ccc1Cl)C(=O)C 1458a_100000102533_200000210301 [1,1,0,0,0,0|2,0,0]=4 683 B12R1.56 CCc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000102533_200025704644 [1,1,0,0,0,0|2,0,0]=4 684 B12R1.56 CNc1cc(ccc1Cl)C(=O)N 34a_100000736751_200000210301 [1,1,0,0,0,0|2,0,0]=4 685 B12R1.56 COc1cc(ccc1Br)C(=O)C 1458a_100011934951_200000210301 [1,1,0,0,0,0|1,1,0]=4 686 B12R1.56 COc1cc(ccc1Br)C(=O)N 34a_100012344895_200000210301 [1,1,0,0,0,0|1,1,0]=4 687 B12R1.56 COc1cc(ccc1Br)C(=O)N 7a_100012344895_200000210301 [1,1,0,0,0,0|1,1,0]=4 688 B12R1.56 COc1cc(ccc1Br)C(=O)[13CH3] 1458a_100011934951_200025704644 [1,1,0,0,0,0|1,1,0]=4 689 B12R1.56 COc1cc(ccc1C)C(=O)C 1458a_100000212341_200000210301 [1,1,0,0,0,0|2,0,0]=4 690 B12R1.56 COc1cc(ccc1C)C(=O)C 34a_100000084092_200000210301 [1,1,0,0,0,0|2,0,0]=4 691 B12R1.56 COc1cc(ccc1C)C(=O)C 7a_100000084092_200000210301 [1,1,0,0,0,0|2,0,0]=4 692 B12R1.56 COc1cc(ccc1C)C(=O)[13CH3] 1458a_100000212341_200025704644 [1,1,0,0,0,0|2,0,0]=4 693 B12R1.56 COc1cc(ccc1Cl)C(=O)C 1458a_100000181799_200000210301 [1,1,0,0,0,0|1,0,0]=3 694 B12R1.56 COc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000181799_200025704644 [1,1,0,0,0,0|1,0,0]=3 695 B12R1.56 COc1cc(ccc1Cl)[N+](=O)[O-] 34a_100000188705_200000210301 [1,1,0,0,0,0|1,0,1]=4 696 B12R1.56 COc1cc(ccc1Cl)[N+](=O)[O-] 7a_100000188705_200000210301 [1,1,0,0,0,0|1,0,1]=4 697 B12R1.56 COc1cc(ccc1F)C(=O)C 1458a_100000757635_200000210301 [1,1,0,0,0,0|1,1,0]=4 698 B12R1.56 COc1cc(ccc1F)C(=O)C 34a_100000117923_200000210301 [1,1,0,0,0,0|1,1,0]=4 699 B12R1.56 COc1cc(ccc1F)C(=O)C 7a_100000117923_200000210301 [1,1,0,0,0,0|1,1,0]=4 700 B12R1.56 COc1cc(ccc1F)C(=O)[13CH3] 1458a_100000757635_200025704644 [1,1,0,0,0,0|1,1,0]=4 701 B12R1.56 COc1cc(ccc1I)C(=O)C 1458a_100012356290_200000210301 [1,1,0,0,0,0|1,1,0]=4 702 B12R1.56 COc1cc(ccc1I)C(=O)[13CH3] 1458a_100012356290_200025704644 [1,1,0,0,0,0|1,1,0]=4 703 B12R1.56 COc1cc(ccc1N)C(=O)N 34a_100011850428_200000210301 [1,1,0,0,0,0|2,0,0]=4 704 B12R1.56 COc1cc(ccc1N)C(=O)N 7a_100011850428_200000210301 [1,1,0,0,0,0|2,0,0]=4 705 B12R1.56 COc1cc(ccc1O)C(=O)C 1458a_100000687070_200000210301 [1,1,0,0,0,0|2,0,0]=4 706 B12R1.56 COc1cc(ccc1O)C(=O)C 271570a_203496583355_100010110075 [1,1,0,0,0,0|2,0,0]=4 707 B12R1.56 COc1cc(ccc1O)C(=O)N 271570a_203496583355_100009817049 [1,1,0,0,0,0|2,0,0]=4 708 B12R1.56 COc1cc(ccc1O)C(=O)[13CH3] 1458a_100000687070_200025704644 [1,1,0,0,0,0|2,0,0]=4 709 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)Cl 1458a_100000696165_200025704644 [1,1,0,0,0,0|2,0,0]=4 710 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)CO)Br 1458a_100010218026_200025704644 [1,1,0,0,0,0|1,1,0]=4 711 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)CO)F 1458a_100011803322_200025704644 [1,1,0,0,0,0|1,1,0]=4 712 B12R1.56 [13CH3]Nc1cc(ccc1Cl)C(=O)N 34a_100000736751_200025704644 [1,1,0,0,0,0|2,0,0]=4 713 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 34a_100012344895_200025704644 [1,1,0,0,0,0|1,1,0]=4 714 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 7a_100012344895_200025704644 [1,1,0,0,0,0|1,1,0]=4 715 B12R1.56 [13CH3]Oc1cc(ccc1Cl)[N+](=O)[O-] 34a_100000188705_200025704644 [1,1,0,0,0,0|1,0,1]=4 716 B12R1.56 [13CH3]Oc1cc(ccc1Cl)[N+](=O)[O-] 7a_100000188705_200025704644 [1,1,0,0,0,0|1,0,1]=4 717 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 34a_100011850428_200025704644 [1,1,0,0,0,0|2,0,0]=4 718 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 7a_100011850428_200025704644 [1,1,0,0,0,0|2,0,0]=4 719 B12R1.232 C=C(C)c1cc(c(cc1Br)Cl)O 271570a_100000694244_100021297947 [1,1,0,0,0,0|2,0,0]=4 720 B12R1.232 C=C(C)c1cc(c(cc1F)Cl)O 271570a_100000694244_100010735246 [1,1,0,0,0,0|2,0,0]=4 721 B12R1.232 CC(=O)c1cc(c(cc1C)Cl)Cl 1458a_100010439669_200000210301 [1,1,0,0,0,0|2,0,0]=4 722 B12R1.232 CC(=O)c1cc(c(cc1C)Cl)F 1458a_200010768543_200000210301 [1,1,0,0,0,0|2,0,0]=4 723 B12R1.232 CC(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_200000210301 [1,1,0,0,0,0|2,0,0]=4 724 B12R1.232 CC(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_200000210301 [1,1,0,0,0,0|2,0,0]=4 725 B12R1.232 CC(=O)c1cc(c(cc1F)C)O 1458a_100009839767_200000210301 [1,1,0,0,0,0|2,0,0]=4 726 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_200000210301 [1,1,0,0,0,0|2,0,0]=4 727 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_200000210301 [1,1,0,0,0,0|2,0,0]=4 728 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_200000210301 [1,1,0,0,0,0|2,0,0]=4 729 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_200000210301 [1,1,0,0,0,0|2,0,0]=4 730 B12R1.232 CC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100009817148 [1,1,0,0,0,0|1,1,0]=4 731 B12R1.232 CC(=O)c1cc(c(cc1O)C)O 271570a_203496583355_200010233951 [1,1,0,0,0,0|2,0,0]=4 732 B12R1.232 CC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_200000210301 [1,1,0,0,0,0|2,0,0]=4 733 B12R1.232 CC(=O)c1cc(c(cc1O)F)O 271570a_203496583355_100000691652 [1,1,0,0,0,0|1,1,0]=4 734 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])Cl)Cl 1458a_100010439669_200025704644 [1,1,0,0,0,0|2,0,0]=4 735 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])F)Cl 1458a_200010768543_200025704644 [1,1,0,0,0,0|2,0,0]=4 736 B12R1.232 Cc1cc(c(cc1O)C(=O)[13CH3])F 1458a_100009839767_200025704644 [1,1,0,0,0,0|2,0,0]=4 737 B12R1.232 NC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100015235948 [1,1,0,0,0,0|1,1,0]=4 738 B12R1.232 NC(=O)c1cc(c(cc1N)F)O 271570a_203496583355_100015444839 [1,1,0,0,0,0|1,1,0]=4 739 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_200025704644 [1,1,0,0,0,0|2,0,0]=4 740 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_200025704644 [1,1,0,0,0,0|2,0,0]=4 741 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_200025704644 [1,1,0,0,0,0|2,0,0]=4 742 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_200025704644 [1,1,0,0,0,0|2,0,0]=4 743 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_200025704644 [1,1,0,0,0,0|2,0,0]=4 744 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_200025704644 [1,1,0,0,0,0|2,0,0]=4 745 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_200025704644 [1,1,0,0,0,0|2,0,0]=4 746 B12R1.367 CCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210202 [1,1,0,0,0,0|2,0,0]=4 747 B12R1.367 CCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210202 [1,1,0,0,0,0|2,0,0]=4 748 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210202 [1,1,0,0,0,0|2,0,0]=4 749 B12R1.367 CCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210202 [1,1,0,0,0,0|2,0,0]=4 750 B12R1.367 CCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210202 [1,1,0,0,0,0|2,0,0]=4 751 B12R1.367 CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210202 [1,1,0,0,0,0|1,1,0]=4 752 B12R1.367 CCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210202 [1,1,0,0,0,0|2,0,0]=4 753 B12R1.367 CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210202 [1,1,0,0,0,0|1,0,0]=3 754 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210202 [1,1,0,0,0,0|1,1,0]=4 755 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011216493 [1,1,0,0,0,0|1,1,0]=4 756 B12R1.367 CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210202 [1,1,0,0,0,0|1,1,0]=4 757 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [1,1,0,0,0,0|2,0,0]=4 758 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 11a_106832991635_100000691181 [1,1,0,0,0,0|2,0,0]=4 759 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 1626a_100102657272_100000691181 [1,1,0,0,0,0|2,0,0]=4 760 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 240690a_100102657272_100000691181 [1,1,0,0,0,0|2,0,0]=4 761 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 527a_100102657272_100000691181 [1,1,0,0,0,0|2,0,0]=4 762 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 11a_106832991635_100000686306 [1,1,0,0,0,0|2,0,0]=4 763 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 1626a_100102657272_100000686306 [1,1,0,0,0,0|2,0,0]=4 764 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 240690a_100102657272_100000686306 [1,1,0,0,0,0|2,0,0]=4 765 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 527a_100102657272_100000686306 [1,1,0,0,0,0|2,0,0]=4 766 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 11a_106832991635_100000210401 [1,1,0,0,0,0|2,0,0]=4 767 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100102657272_100000210401 [1,1,0,0,0,0|2,0,0]=4 768 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100102657272_100000210401 [1,1,0,0,0,0|2,0,0]=4 769 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 527a_100102657272_100000210401 [1,1,0,0,0,0|2,0,0]=4 770 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 11a_106832991635_100000743183 [1,1,0,0,0,0|2,0,0]=4 771 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 1626a_100102657272_100000743183 [1,1,0,0,0,0|2,0,0]=4 772 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 240690a_100102657272_100000743183 [1,1,0,0,0,0|2,0,0]=4 773 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 527a_100102657272_100000743183 [1,1,0,0,0,0|2,0,0]=4 774 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 11a_106832991635_100000739381 [1,1,0,0,0,0|2,0,0]=4 775 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 1626a_100102657272_100000739381 [1,1,0,0,0,0|2,0,0]=4 776 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 240690a_100102657272_100000739381 [1,1,0,0,0,0|2,0,0]=4 777 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 527a_100102657272_100000739381 [1,1,0,0,0,0|2,0,0]=4 778 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br 240690a_100102657272_100000689001 [1,1,0,0,0,0|1,1,0]=4 779 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br 527a_100102657272_100000689001 [1,1,0,0,0,0|1,1,0]=4 780 B12R1.367 CNC(=O)c1ccc(c(c1)O)C 240690a_100102657272_100000233767 [1,1,0,0,0,0|2,0,0]=4 781 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl 240690a_100102657272_100011933997 [1,1,0,0,0,0|1,0,0]=3 782 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl 527a_100102657272_100011933997 [1,1,0,0,0,0|1,0,0]=3 783 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 240690a_100102657272_100000035894 [1,1,0,0,0,0|1,1,0]=4 784 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359898 [1,1,0,0,0,0|1,1,0]=4 785 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 527a_100102657272_100000035894 [1,1,0,0,0,0|1,1,0]=4 786 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 1626a_100102657272_100000239334 [1,1,0,0,0,0|1,1,0]=4 787 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 240690a_100102657272_100000239334 [1,1,0,0,0,0|1,1,0]=4 788 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 527a_100102657272_100000239334 [1,1,0,0,0,0|1,1,0]=4 789 B12R1.367 COC(=O)c1cc(c(cn1)C)O 271570a_203496583355_100000065005 [1,1,0,0,0,0|2,0,0]=4 790 B12R1.367 COC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100011294788 [1,1,0,0,0,0|2,0,0]=4 791 B12R1.367 COC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100011215878 [1,1,0,0,0,0|2,0,0]=4 792 B12R1.367 COC(=O)c1ccc(c(c1)Cl)O 271570a_203496583355_100012356344 [1,1,0,0,0,0|2,0,0]=4 793 B12R1.367 COC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000703229 [1,1,0,0,0,0|2,0,0]=4 794 B12R1.367 COC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100011450966 [1,1,0,0,0,0|2,0,0]=4 795 B12R1.367 COC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100012349818 [1,1,0,0,0,0|0,1,0]=3 796 B12R1.367 COC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011218856 [1,1,0,0,0,0|1,0,0]=3 797 B12R1.367 COC(=O)c1ccc(c(c1)O)Cl 271570a_203496583355_100011294800 [1,1,0,0,0,0|0,0,0]=2 798 B12R1.367 COC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000722584 [1,1,0,0,0,0|0,1,0]=3 799 B12R1.367 COC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100000187552 [1,1,0,0,0,0|1,0,0]=3 800 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100000216328 [1,1,0,0,0,0|1,0,0]=3 801 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012350776 [1,1,0,0,0,0|1,0,0]=3 802 B12R1.367 COC(=O)c1ccc(c(n1)O)C 271570a_203496583355_100010143800 [1,1,0,0,0,0|2,0,0]=4 803 B12R1.367 COC(=O)c1ccc(c(n1)O)F 271570a_203496583355_100010189626 [1,1,0,0,0,0|1,1,0]=4 804 B12R1.367 COC(=O)c1ccc(c(n1)O)O 271570a_203496583355_100010189637 [1,1,0,0,0,0|2,0,0]=4 805 B12R1.367 COC(=O)c1ccc(c(n1)O)O 271570a_203496583355_200009815348 [1,1,0,0,0,0|2,0,0]=4 806 B12R1.367 COC(=O)c1cnc(c(c1)O)Cl 271570a_203496583355_100010188758 [1,1,0,0,0,0|1,0,0]=3 807 B12R1.367 COC(=O)c1cnc(c(c1)O)F 271570a_203496583355_100000117919 [1,1,0,0,0,0|1,1,0]=4 808 B12R1.367 COC(=O)c1cnc(c(c1)O)N 271570a_203496583355_100009816800 [1,1,0,0,0,0|2,0,0]=4 809 B12R1.367 COC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010109663 [1,1,0,0,0,0|2,0,0]=4 810 B12R1.367 COC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010999399 [1,1,0,0,0,0|2,0,0]=4 811 B12R1.367 COC(=O)c1coc(=O)c(c1)O 271570a_203496583355_100009812866 [1,1,0,0,0,0|2,0,0]=4 812 B12R1.367 Cc1cc(ccc1Cl)C(=O)CF 1458a_100000686306_100015361967 [1,1,0,0,0,0|2,0,0]=4 813 B12R1.367 Cc1ccc(cc1O)C(=O)CF 1458a_100000233767_100015361967 [1,1,0,0,0,0|2,0,0]=4 814 B12R1.367 Cc1ccc(cc1O)C(=O)NN 271570a_203496583355_100000188075 [1,1,0,0,0,0|2,0,0]=4 815 B12R1.367 NNC(=O)c1ccc(c(c1)O)Cl 271570a_203496583355_100000046573 [1,1,0,0,0,0|1,0,0]=3 816 B12R1.367 O=C(CF)c1ccc(c(c1)Br)Cl 1458a_100000691181_100015361967 [1,1,0,0,0,0|2,0,0]=4 817 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100015361967 [1,1,0,0,0,0|2,0,0]=4 818 B12R1.367 O=C(CF)c1ccc(c(c1)F)Cl 1458a_100000743183_100015361967 [1,1,0,0,0,0|2,0,0]=4 819 B12R1.367 O=C(CF)c1ccc(c(c1)I)Cl 1458a_100000739381_100015361967 [1,1,0,0,0,0|2,0,0]=4 820 B12R1.367 O=C(CF)c1ccc(c(c1)O)Br 1458a_100000689001_100015361967 [1,1,0,0,0,0|1,1,0]=4 821 B12R1.367 O=C(CF)c1ccc(c(c1)O)Cl 1458a_100011933997_100015361967 [1,1,0,0,0,0|1,0,0]=3 822 B12R1.367 O=C(CF)c1ccc(c(c1)O)F 1458a_100000035894_100015361967 [1,1,0,0,0,0|1,1,0]=4 823 B12R1.367 O=C(CF)c1ccc(c(c1)O)I 1458a_100000239334_100015361967 [1,1,0,0,0,0|1,1,0]=4 824 B12R1.367 O=C(CF)c1ccc(c(c1)O)O 1458a_100000212155_100015361967 [1,1,0,0,0,0|2,0,0]=4 825 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)Cl)Cl 1458a_200012920480_200000210301 [1,1,0,0,0,0|2,0,0]=4 826 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)Cl)F 1458a_100010291025_200000210301 [1,1,0,0,0,0|2,0,0]=4 827 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_200000210301 [1,1,0,0,0,0|2,0,0]=4 828 B12R1.1005 CC(=O)c1cc(c(c(c1)C)Cl)C 1458a_100000102532_200000210301 [1,1,0,0,0,0|2,0,0]=4 829 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1458a_100012339221_200000210301 [1,1,0,0,0,0|2,0,0]=4 830 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)Cl)F 1458a_200010244527_200000210301 [1,1,0,0,0,0|2,0,0]=4 831 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_200000210301 [1,1,0,0,0,0|2,0,0]=4 832 B12R1.1005 CC(=O)c1cc(c(c(c1)F)Cl)F 1458a_100000104779_200000210301 [1,1,0,0,0,0|2,0,0]=4 833 B12R1.1005 CC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_200000210301 [1,1,0,0,0,0|1,1,0]=4 834 B12R1.1005 CC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_200000210301 [1,1,0,0,0,0|2,0,0]=4 835 B12R1.1005 CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_200000210301 [1,1,0,0,0,0|1,0,0]=3 836 B12R1.1005 CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200000210301 [1,1,0,0,0,0|2,0,0]=4 837 B12R1.1005 Cc1c(cc(cc1O)C(=O)[13CH3])O 1458a_100000031928_200025704644 [1,1,0,0,0,0|2,0,0]=4 838 B12R1.1005 Cc1cc(cc(c1Cl)C)C(=O)[13CH3] 1458a_100000102532_200025704644 [1,1,0,0,0,0|2,0,0]=4 839 B12R1.1005 NC(=O)c1cc(c(c(c1)O)O)O 271570a_203496583355_200009814324 [1,1,0,0,0,0|2,0,0]=4 840 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)Cl)Cl 1458a_200012920480_200025704644 [1,1,0,0,0,0|2,0,0]=4 841 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)Cl)F 1458a_100010291025_200025704644 [1,1,0,0,0,0|2,0,0]=4 842 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_200025704644 [1,1,0,0,0,0|2,0,0]=4 843 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)Cl)Cl 1458a_100012339221_200025704644 [1,1,0,0,0,0|2,0,0]=4 844 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)Cl)F 1458a_200010244527_200025704644 [1,1,0,0,0,0|2,0,0]=4 845 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_200025704644 [1,1,0,0,0,0|2,0,0]=4 846 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)F)Cl)F 1458a_100000104779_200025704644 [1,1,0,0,0,0|2,0,0]=4 847 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_200025704644 [1,1,0,0,0,0|1,1,0]=4 848 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_200025704644 [1,1,0,0,0,0|1,0,0]=3 849 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200025704644 [1,1,0,0,0,0|2,0,0]=4 850 B12R1.24 CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210202 [1,1,0,0,0,0|2,0,0]=4 851 B12R1.24 CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210202 [1,1,0,0,0,0|2,0,0]=4 852 B12R1.24 CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210202 [1,1,0,0,0,0|2,0,0]=4 853 B12R1.24 CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210202 [1,1,0,0,0,0|2,0,0]=4 854 B12R1.24 CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210202 [1,1,0,0,0,0|2,0,0]=4 855 B12R1.24 CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210202 [1,1,0,0,0,0|2,0,0]=4 856 B12R1.24 CNC(=O)c1cccc(c1Br)O 240690a_100102657272_100010230362 [1,1,0,0,0,0|2,0,0]=4 857 B12R1.24 CNC(=O)c1cccc(c1Br)O 527a_100102657272_100010230362 [1,1,0,0,0,0|2,0,0]=4 858 B12R1.24 CNC(=O)c1cccc(c1C)O 240690a_100102657272_100000766327 [1,1,0,0,0,0|2,0,0]=4 859 B12R1.24 CNC(=O)c1cccc(c1C)O 527a_100102657272_100000766327 [1,1,0,0,0,0|2,0,0]=4 860 B12R1.24 CNC(=O)c1cccc(c1Cl)O 240690a_100102657272_100000092362 [1,1,0,0,0,0|2,0,0]=4 861 B12R1.24 CNC(=O)c1cccc(c1Cl)O 527a_100102657272_100000092362 [1,1,0,0,0,0|2,0,0]=4 862 B12R1.24 CNC(=O)c1cccc(c1F)O 240690a_100102657272_100000037433 [1,1,0,0,0,0|2,0,0]=4 863 B12R1.24 CNC(=O)c1cccc(c1F)O 527a_100102657272_100000037433 [1,1,0,0,0,0|2,0,0]=4 864 B12R1.24 CNC(=O)c1cccc(c1I)O 527a_100102657272_100010084636 [1,1,0,0,0,0|2,0,0]=4 865 B12R1.24 CNC(=O)c1cccc(c1O)O 527a_100102657272_100000690420 [1,1,0,0,0,0|2,0,0]=4 866 B12R1.24 COC(=O)c1c[nH]cc(c1=O)O 271570a_203496583355_100010873956 [1,1,0,0,0,0|2,0,0]=4 867 B12R1.24 COC(=O)c1cccc(c1Br)O 271570a_203496583355_100010240208 [1,1,0,0,0,0|1,0,0]=3 868 B12R1.24 COC(=O)c1cccc(c1C)O 271570a_203496583355_100012298220 [1,1,0,0,0,0|1,0,0]=3 869 B12R1.24 COC(=O)c1cccc(c1F)O 271570a_203496583355_100012355674 [1,1,0,0,0,0|1,0,0]=3 870 B12R1.24 COC(=O)c1cccc(c1N)O 271570a_203496583355_100011356556 [1,1,0,0,0,0|0,0,0]=2 871 B12R1.24 COC(=O)c1cccc(c1O)Br 271570a_203496583355_100010150843 [1,1,0,0,0,0|2,0,0]=4 872 B12R1.24 COC(=O)c1cccc(c1O)C 271570a_203496583355_100012002529 [1,1,0,0,0,0|2,0,0]=4 873 B12R1.24 COC(=O)c1cccc(c1O)F 271570a_203496583355_100012357630 [1,1,0,0,0,0|2,0,0]=4 874 B12R1.24 COC(=O)c1cccc(c1O)N 271570a_203496583355_100000719424 [1,1,0,0,0,0|2,0,0]=4 875 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_100009816214 [1,1,0,0,0,0|1,0,0]=3 876 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_200010230364 [1,1,0,0,0,0|1,0,0]=3 877 B12R1.24 COC(=O)c1ccnc(c1C)O 271570a_203496583355_100000087782 [1,1,0,0,0,0|2,0,0]=4 878 B12R1.24 COC(=O)c1ccnc(c1F)O 271570a_203496583355_100000081818 [1,1,0,0,0,0|2,0,0]=4 879 B12R1.24 COC(=O)c1ccnc(c1N)O 271570a_203496583355_100000067308 [1,1,0,0,0,0|1,0,0]=3 880 B12R1.24 COC(=O)c1cncc(c1C)O 271570a_203496583355_100010713144 [1,1,0,0,0,0|2,0,0]=4 881 B12R1.24 COC(=O)c1nccc(c1C)O 271570a_203496583355_100000094583 [1,1,0,0,0,0|2,0,0]=4 882 B12R1.24 COC(=O)c1nccc(c1F)O 271570a_203496583355_100000687924 [1,1,0,0,0,0|2,0,0]=4 883 B12R1.24 Cc1c(cccc1C(=O)CF)O 1458a_100000766327_100015361967 [1,1,0,0,0,0|2,0,0]=4 884 B12R1.24 Cc1c(cccc1C(=O)NN)O 271570a_203496583355_200012298103 [1,1,0,0,0,0|2,0,0]=4 885 B12R1.24 O=C(CF)c1cccc(c1Br)O 1458a_100010230362_100015361967 [1,1,0,0,0,0|2,0,0]=4 886 B12R1.24 O=C(CF)c1cccc(c1Cl)O 1458a_100000092362_100015361967 [1,1,0,0,0,0|2,0,0]=4 887 B12R1.24 O=C(CF)c1cccc(c1F)O 1458a_100000037433_100015361967 [1,1,0,0,0,0|2,0,0]=4 888 B12R1.24 O=C(CF)c1cccc(c1I)O 1458a_100010084636_100015361967 [1,1,0,0,0,0|2,0,0]=4 889 B12R1.24 O=C(CF)c1cccc(c1O)O 1458a_100000690420_100015361967 [1,1,0,0,0,0|2,0,0]=4 890 B12R1.87 CNc1c(cccc1C(=O)N)C 34a_100000223273_200000210301 [1,1,0,0,0,0|2,0,0]=4 891 B12R1.87 CNc1c(cccc1C(=O)N)Cl 34a_200011997947_200000210301 [1,1,0,0,0,0|2,0,0]=4 892 B12R1.87 CNc1c(cccc1C(=O)N)F 34a_100011722151_200000210301 [1,1,0,0,0,0|2,0,0]=4 893 B12R1.87 COc1c(cccc1C(=O)C)O 1458a_100000080799_200000210301 [1,1,0,0,0,0|2,0,0]=4 894 B12R1.87 COc1c(cccc1C(=O)C)O 271570a_203496583355_100010725610 [1,1,0,0,0,0|2,0,0]=4 895 B12R1.87 COc1c(cccc1C(=O)N)O 271570a_203496583355_100010146779 [1,1,0,0,0,0|2,0,0]=4 896 B12R1.87 COc1c(cccc1C(=O)[13CH3])O 1458a_100000080799_200025704644 [1,1,0,0,0,0|2,0,0]=4 897 B12R1.87 Cc1cccc(c1N[13CH3])C(=O)N 34a_100000223273_200025704644 [1,1,0,0,0,0|2,0,0]=4 898 B12R1.87 [13CH3]Nc1c(cccc1C(=O)N)Cl 34a_200011997947_200025704644 [1,1,0,0,0,0|2,0,0]=4 899 B12R1.87 [13CH3]Nc1c(cccc1C(=O)N)F 34a_100011722151_200025704644 [1,1,0,0,0,0|2,0,0]=4 900 B12R1.440 C=C(C)c1cccc(c1N)CO 271570a_100000694244_100012349457 [1,1,0,0,0,0|2,0,0]=4 901 B12R1.440 C=C(C)c1cccc(c1N)OC 271570a_100000694244_100000708083 [1,1,0,0,0,0|2,0,0]=4 902 B12R1.440 C=Cc1cccc(c1N)C(=O)N 271570a_100011290941_100010144993 [1,1,0,0,0,0|2,0,0]=4 903 B12R1.440 CC(=O)c1cccc(c1C)O[13CH3] 34a_200009877264_200025704644 [1,1,0,0,0,0|2,0,0]=4 904 B12R1.440 CC(=O)c1cccc(c1C)O[13CH3] 7a_200009877264_200025704644 [1,1,0,0,0,0|2,0,0]=4 905 B12R1.440 CC(=O)c1cccc(c1F)O[13CH3] 34a_100009856408_200025704644 [1,1,0,0,0,0|2,0,0]=4 906 B12R1.440 CC(=O)c1cccc(c1F)O[13CH3] 7a_100009856408_200025704644 [1,1,0,0,0,0|2,0,0]=4 907 B12R1.440 CC(=O)c1cccc(c1N)O[13CH3] 7a_100000036053_200025704644 [1,1,0,0,0,0|1,0,0]=3 908 B12R1.440 COc1cccc(c1Br)C(=O)C 1458a_100010245468_200000210301 [1,1,0,0,0,0|2,0,0]=4 909 B12R1.440 COc1cccc(c1Br)C(=O)[13CH3] 1458a_100010245468_200025704644 [1,1,0,0,0,0|2,0,0]=4 910 B12R1.440 COc1cccc(c1C)C(=O)C 1458a_100011217801_200000210301 [1,1,0,0,0,0|2,0,0]=4 911 B12R1.440 COc1cccc(c1C)C(=O)C 34a_200009877264_200000210301 [1,1,0,0,0,0|2,0,0]=4 912 B12R1.440 COc1cccc(c1C)C(=O)C 7a_200009877264_200000210301 [1,1,0,0,0,0|2,0,0]=4 913 B12R1.440 COc1cccc(c1C)C(=O)[13CH3] 1458a_100011217801_200025704644 [1,1,0,0,0,0|2,0,0]=4 914 B12R1.440 COc1cccc(c1Cl)C(=O)C 1458a_100000068443_200000210301 [1,1,0,0,0,0|2,0,0]=4 915 B12R1.440 COc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000068443_200025704644 [1,1,0,0,0,0|2,0,0]=4 916 B12R1.440 COc1cccc(c1F)C(=O)C 1458a_100000766180_200000210301 [1,1,0,0,0,0|2,0,0]=4 917 B12R1.440 COc1cccc(c1F)C(=O)C 34a_100009856408_200000210301 [1,1,0,0,0,0|2,0,0]=4 918 B12R1.440 COc1cccc(c1F)C(=O)C 7a_100009856408_200000210301 [1,1,0,0,0,0|2,0,0]=4 919 B12R1.440 COc1cccc(c1F)C(=O)N 34a_100009841371_200000210301 [1,1,0,0,0,0|2,0,0]=4 920 B12R1.440 COc1cccc(c1F)C(=O)N 7a_100009841371_200000210301 [1,1,0,0,0,0|2,0,0]=4 921 B12R1.440 COc1cccc(c1F)C(=O)[13CH3] 1458a_100000766180_200025704644 [1,1,0,0,0,0|2,0,0]=4 922 B12R1.440 COc1cccc(c1I)C(=O)C 1458a_100010075502_200000210301 [1,1,0,0,0,0|2,0,0]=4 923 B12R1.440 COc1cccc(c1I)C(=O)[13CH3] 1458a_100010075502_200025704644 [1,1,0,0,0,0|2,0,0]=4 924 B12R1.440 COc1cccc(c1N)C(=O)C 7a_100000036053_200000210301 [1,1,0,0,0,0|1,0,0]=3 925 B12R1.440 COc1cccc(c1N)[N+](=O)[O-] 7a_100000739591_200000210301 [1,1,0,0,0,0|1,0,1]=4 926 B12R1.440 COc1cccc(c1O)C(=O)C 1458a_100000212136_200000210301 [1,1,0,0,0,0|2,0,0]=4 927 B12R1.440 COc1cccc(c1O)C(=O)[13CH3] 1458a_100000212136_200025704644 [1,1,0,0,0,0|2,0,0]=4 928 B12R1.440 CSc1cccc(c1N)C(=O)N 62a_100010144993_200000210301 [1,1,0,0,0,0|1,1,0]=4 929 B12R1.440 [13CH3]Oc1cccc(c1F)C(=O)N 34a_100009841371_200025704644 [1,1,0,0,0,0|2,0,0]=4 930 B12R1.440 [13CH3]Oc1cccc(c1F)C(=O)N 7a_100009841371_200025704644 [1,1,0,0,0,0|2,0,0]=4 931 B12R1.440 [13CH3]Oc1cccc(c1N)[N+](=O)[O-] 7a_100000739591_200025704644 [1,1,0,0,0,0|1,0,1]=4 932 B12R1.440 [13CH3]Sc1cccc(c1N)C(=O)N 62a_100010144993_200025704644 [1,1,0,0,0,0|1,1,0]=4 933 B12R1.511 CC(=O)c1cc(cc(c1C)O)Br 1458a_100011101721_200000210301 [1,1,0,0,0,0|2,0,0]=4 934 B12R1.511 CC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_200000210301 [1,1,0,0,0,0|2,0,0]=4 935 B12R1.511 CC(=O)c1cc(cc(c1O)O)C 271570a_203496583355_100011659362 [1,1,0,0,0,0|2,0,0]=4 936 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)O 1458a_100011101721_200025704644 [1,1,0,0,0,0|2,0,0]=4 937 B12R1.511 NC(=O)c1cc(cc(c1O)O)F 271570a_203496583355_200135271384 [1,1,0,0,0,0|2,0,0]=4 938 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_200025704644 [1,1,0,0,0,0|2,0,0]=4 939 B12R1.894 CC(=O)c1c(ccc(c1F)O)F 1458a_100000068660_200000210301 [1,1,0,0,0,0|2,0,0]=4 940 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)O)F 1458a_100000068660_200025704644 [1,1,0,0,0,0|2,0,0]=4 941 B12R1.57 CC(=O)c1ccc(cc1O[13CH3])Cl 34a_100000061402_200025704644 [1,1,0,0,0,0|2,0,0]=4 942 B12R1.57 CC(=O)c1ccc(cc1O[13CH3])Cl 7a_100000061402_200025704644 [1,1,0,0,0,0|2,0,0]=4 943 B12R1.57 CNc1cc(ccc1C(=O)C)F 27a_100102657272_100000686192 [1,1,0,0,0,0|1,1,0]=4 944 B12R1.57 CNc1cc(ccc1C(=O)N)Br 27a_100102657272_100009815748 [1,1,0,0,0,0|1,1,0]=4 945 B12R1.57 CNc1cc(ccc1C(=O)N)Br 7a_100012349972_200000210301 [1,1,0,0,0,0|1,1,0]=4 946 B12R1.57 CNc1cc(ccc1C(=O)N)C 34a_100011219537_200000210301 [1,1,0,0,0,0|2,0,0]=4 947 B12R1.57 CNc1cc(ccc1C(=O)N)C 7a_100011219537_200000210301 [1,1,0,0,0,0|2,0,0]=4 948 B12R1.57 CNc1cc(ccc1C(=O)N)Cl 34a_100000738103_200000210301 [1,1,0,0,0,0|1,0,0]=3 949 B12R1.57 CNc1cc(ccc1C(=O)N)Cl 7a_100000738103_200000210301 [1,1,0,0,0,0|1,0,0]=3 950 B12R1.57 CNc1cc(ccc1C(=O)N)F 27a_100102657272_100000206404 [1,1,0,0,0,0|1,1,0]=4 951 B12R1.57 CNc1cc(ccc1C(=O)N)F 34a_100011298637_200000210301 [1,1,0,0,0,0|1,1,0]=4 952 B12R1.57 COc1cc(ccc1C(=O)C)Cl 1458a_100000217211_200000210301 [1,1,0,0,0,0|2,0,0]=4 953 B12R1.57 COc1cc(ccc1C(=O)C)Cl 34a_100000061402_200000210301 [1,1,0,0,0,0|2,0,0]=4 954 B12R1.57 COc1cc(ccc1C(=O)C)Cl 7a_100000061402_200000210301 [1,1,0,0,0,0|2,0,0]=4 955 B12R1.57 COc1cc(ccc1C(=O)N)Cl 34a_100000192836_200000210301 [1,1,0,0,0,0|2,0,0]=4 956 B12R1.57 COc1cc(ccc1C(=O)N)Cl 7a_100000192836_200000210301 [1,1,0,0,0,0|2,0,0]=4 957 B12R1.57 COc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000217211_200025704644 [1,1,0,0,0,0|2,0,0]=4 958 B12R1.57 Cc1ccc(c(c1)N[13CH3])C(=O)N 34a_100011219537_200025704644 [1,1,0,0,0,0|2,0,0]=4 959 B12R1.57 Cc1ccc(c(c1)N[13CH3])C(=O)N 7a_100011219537_200025704644 [1,1,0,0,0,0|2,0,0]=4 960 B12R1.57 [13CH3]Nc1cc(ccc1C(=O)N)Br 7a_100012349972_200025704644 [1,1,0,0,0,0|1,1,0]=4 961 B12R1.57 [13CH3]Nc1cc(ccc1C(=O)N)Cl 34a_100000738103_200025704644 [1,1,0,0,0,0|1,0,0]=3 962 B12R1.57 [13CH3]Nc1cc(ccc1C(=O)N)Cl 7a_100000738103_200025704644 [1,1,0,0,0,0|1,0,0]=3 963 B12R1.57 [13CH3]Nc1cc(ccc1C(=O)N)F 34a_100011298637_200025704644 [1,1,0,0,0,0|1,1,0]=4 964 B12R1.57 [13CH3]Oc1cc(ccc1C(=O)N)Cl 34a_100000192836_200025704644 [1,1,0,0,0,0|2,0,0]=4 965 B12R1.57 [13CH3]Oc1cc(ccc1C(=O)N)Cl 7a_100000192836_200025704644 [1,1,0,0,0,0|2,0,0]=4 966 B12R1.452 C=Cc1ccc(c(c1)N)C(=O)C 271570a_100011290941_100011590516 [1,1,0,0,0,0|2,0,0]=4 967 B12R1.452 C=Cc1ccc(c(c1)N)C(=O)N 271570a_100011290941_100012349972 [1,1,0,0,0,0|2,0,0]=4 968 B12R1.452 CC(=O)c1ccc(cc1N)S[13CH3] 62a_100011590516_200025704644 [1,1,0,0,0,0|2,0,0]=4 969 B12R1.452 COc1ccc(c(c1)N)C(=O)N 34a_100012186684_200000210301 [1,1,0,0,0,0|2,0,0]=4 970 B12R1.452 COc1ccc(c(c1)N)C(=O)N 7a_100012186684_200000210301 [1,1,0,0,0,0|2,0,0]=4 971 B12R1.452 CSc1ccc(c(c1)N)C(=O)C 62a_100011590516_200000210301 [1,1,0,0,0,0|2,0,0]=4 972 B12R1.452 CSc1ccc(c(c1)N)C(=O)N 62a_100012349972_200000210301 [1,1,0,0,0,0|2,0,0]=4 973 B12R1.452 [13CH3]Oc1ccc(c(c1)N)C(=O)N 34a_100012186684_200025704644 [1,1,0,0,0,0|2,0,0]=4 974 B12R1.452 [13CH3]Oc1ccc(c(c1)N)C(=O)N 7a_100012186684_200025704644 [1,1,0,0,0,0|2,0,0]=4 975 B12R1.452 [13CH3]Sc1ccc(c(c1)N)C(=O)N 62a_100012349972_200025704644 [1,1,0,0,0,0|2,0,0]=4 976 B12R1.1000 C=C(C)c1c(cc(cc1F)Cl)N 271570a_100000694244_200021297760 [1,1,0,0,0,0|2,0,0]=4 977 B12R1.1000 C=C(C)c1c(cc(cc1N)Cl)C 271570a_100000694244_100000698757 [1,1,0,0,0,0|2,0,0]=4 978 B12R1.1000 CC(=O)c1c(cc(cc1Br)Cl)F 1458a_100010244364_200000210301 [1,1,0,0,0,0|2,0,0]=4 979 B12R1.1000 CC(=O)c1c(cc(cc1C)Cl)C 1458a_100000088873_200000210301 [1,1,0,0,0,0|2,0,0]=4 980 B12R1.1000 CC(=O)c1c(cc(cc1Cl)Cl)Cl 1458a_100011215713_200000210301 [1,1,0,0,0,0|2,0,0]=4 981 B12R1.1000 CC(=O)c1c(cc(cc1Cl)Cl)F 1458a_100010068318_200000210301 [1,1,0,0,0,0|2,0,0]=4 982 B12R1.1000 CC(=O)c1c(cc(cc1F)Cl)C 1458a_100010768517_200000210301 [1,1,0,0,0,0|2,0,0]=4 983 B12R1.1000 CC(=O)c1c(cc(cc1F)Cl)F 1458a_100000062413_200000210301 [1,1,0,0,0,0|2,0,0]=4 984 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])C)Cl 1458a_100000088873_200025704644 [1,1,0,0,0,0|2,0,0]=4 985 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])F)Cl 1458a_100010768517_200025704644 [1,1,0,0,0,0|2,0,0]=4 986 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Br)Cl)F 1458a_100010244364_200025704644 [1,1,0,0,0,0|2,0,0]=4 987 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)Cl)Cl 1458a_100011215713_200025704644 [1,1,0,0,0,0|2,0,0]=4 988 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)Cl)F 1458a_100010068318_200025704644 [1,1,0,0,0,0|2,0,0]=4 989 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1F)Cl)F 1458a_100000062413_200025704644 [1,1,0,0,0,0|2,0,0]=4 990 B12R1.1703 CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210202 [1,1,0,0,0,0|2,0,0]=4 991 B12R1.1703 CCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210202 [1,1,0,0,0,0|2,0,0]=4 992 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210202 [1,1,0,0,0,0|2,0,0]=4 993 B12R1.1703 CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210202 [1,1,0,0,0,0|2,0,0]=4 994 B12R1.1703 CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210202 [1,1,0,0,0,0|2,0,0]=4 995 B12R1.1703 CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210202 [1,1,0,0,0,0|2,0,0]=4 996 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 11a_106832991635_100000766353 [1,1,0,0,0,0|2,0,0]=4 997 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 1626a_100102657272_100000766353 [1,1,0,0,0,0|2,0,0]=4 998 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 240690a_100102657272_100000766353 [1,1,0,0,0,0|2,0,0]=4 999 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 527a_100102657272_100000766353 [1,1,0,0,0,0|2,0,0]=4 1000 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 11a_106832991635_100000688705 [1,1,0,0,0,0|2,0,0]=4 1001 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 1626a_100102657272_100000688705 [1,1,0,0,0,0|2,0,0]=4 1002 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 240690a_100102657272_100000688705 [1,1,0,0,0,0|2,0,0]=4 1003 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 527a_100102657272_100000688705 [1,1,0,0,0,0|2,0,0]=4 1004 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 11a_106832991635_100000185840 [1,1,0,0,0,0|2,0,0]=4 1005 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 1626a_100102657272_100000185840 [1,1,0,0,0,0|2,0,0]=4 1006 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 240690a_100102657272_100000185840 [1,1,0,0,0,0|2,0,0]=4 1007 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 527a_100102657272_100000185840 [1,1,0,0,0,0|2,0,0]=4 1008 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 11a_106832991635_100000212326 [1,1,0,0,0,0|2,0,0]=4 1009 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 1626a_100102657272_100000212326 [1,1,0,0,0,0|2,0,0]=4 1010 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 240690a_100102657272_100000212326 [1,1,0,0,0,0|2,0,0]=4 1011 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 527a_100102657272_100000212326 [1,1,0,0,0,0|2,0,0]=4 1012 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 11a_106832991635_100000739380 [1,1,0,0,0,0|2,0,0]=4 1013 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 1626a_100102657272_100000739380 [1,1,0,0,0,0|2,0,0]=4 1014 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 240690a_100102657272_100000739380 [1,1,0,0,0,0|2,0,0]=4 1015 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 527a_100102657272_100000739380 [1,1,0,0,0,0|2,0,0]=4 1016 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 11a_106832991635_100000188622 [1,1,0,0,0,0|2,0,0]=4 1017 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 240690a_100102657272_100000188622 [1,1,0,0,0,0|2,0,0]=4 1018 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 527a_100102657272_100000188622 [1,1,0,0,0,0|2,0,0]=4 1019 B12R1.1703 COC(=O)c1ccc(cc1Br)O 271570a_203496583355_100010247156 [1,1,0,0,0,0|2,0,0]=4 1020 B12R1.1703 COC(=O)c1ccc(cc1C)O 271570a_203496583355_100000747612 [1,1,0,0,0,0|2,0,0]=4 1021 B12R1.1703 COC(=O)c1ccc(cc1Cl)O 271570a_203496583355_100000060724 [1,1,0,0,0,0|2,0,0]=4 1022 B12R1.1703 COC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216654 [1,1,0,0,0,0|2,0,0]=4 1023 B12R1.1703 COC(=O)c1ccc(cc1N)O 271570a_203496583355_100011373473 [1,1,0,0,0,0|1,0,0]=3 1024 B12R1.1703 COC(=O)c1ccc(cc1O)Br 271570a_203496583355_100000701758 [1,1,0,0,0,0|1,1,0]=4 1025 B12R1.1703 COC(=O)c1ccc(cc1O)C 271570a_203496583355_100012340597 [1,1,0,0,0,0|2,0,0]=4 1026 B12R1.1703 COC(=O)c1ccc(cc1O)Cl 271570a_203496583355_100000047510 [1,1,0,0,0,0|1,0,0]=3 1027 B12R1.1703 COC(=O)c1ccc(cc1O)F 271570a_203496583355_100000204356 [1,1,0,0,0,0|1,1,0]=4 1028 B12R1.1703 COC(=O)c1ccc(cc1O)N 271570a_203496583355_100009998378 [1,1,0,0,0,0|2,0,0]=4 1029 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100000062286 [1,1,0,0,0,0|2,0,0]=4 1030 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100010150825 [1,1,0,0,0,0|2,0,0]=4 1031 B12R1.1703 COC(=O)c1ccc(nc1N)O 271570a_203496583355_100000142702 [1,1,0,0,0,0|2,0,0]=4 1032 B12R1.1703 COC(=O)c1cnc(cc1N)O 271570a_203496583355_100009862510 [1,1,0,0,0,0|2,0,0]=4 1033 B12R1.1703 COC(=O)c1ncc(cc1N)O 271570a_203496583355_100010090751 [1,1,0,0,0,0|2,0,0]=4 1034 B12R1.1703 Cc1cc(ccc1C(=O)CF)Cl 1458a_100000688705_100015361967 [1,1,0,0,0,0|2,0,0]=4 1035 B12R1.1703 O=C(CF)c1ccc(cc1Br)Cl 1458a_100000766353_100015361967 [1,1,0,0,0,0|2,0,0]=4 1036 B12R1.1703 O=C(CF)c1ccc(cc1Cl)Cl 1458a_100000185840_100015361967 [1,1,0,0,0,0|2,0,0]=4 1037 B12R1.1703 O=C(CF)c1ccc(cc1F)Cl 1458a_100000212326_100015361967 [1,1,0,0,0,0|2,0,0]=4 1038 B12R1.1703 O=C(CF)c1ccc(cc1I)Cl 1458a_100000739380_100015361967 [1,1,0,0,0,0|2,0,0]=4 1039 B12R1.1703 O=C(CF)c1ccc(cc1O)Cl 1458a_100000188622_100015361967 [1,1,0,0,0,0|2,0,0]=4 1040 B12R1.14 O=Cc1cc(c(c(c1F)O)F)F 271570a_203496583355_100009864613 [1,1,0,0,0,0|1,1,0]=4 1041 B12R1.544 C=C=Cc1ccc(c(c1N)O)Br 271570a_100015277604_100020748643 [1,1,0,0,0,0|1,1,0]=4 1042 B12R1.544 CC=Cc1ccc(c(c1N)O)Br 271570a_100016259895_100020748643 [1,1,0,0,0,0|1,1,0]=4 1043 B12R1.652 CSc1c(ccc(c1O)O)C=O 62a_200000210301_200010659824 [1,1,0,0,0,0|2,0,0]=4 1044 B12R1.652 [13CH3]Sc1c(ccc(c1O)O)C=O 62a_200025704644_200010659824 [1,1,0,0,0,0|2,0,0]=4 1045 B12R1.654 C=Cc1ccc(c(c1F)OC)Cl 271570a_100011290941_200135222481 [1,1,0,0,0,0|2,0,0]=4 1046 B12R1.654 COc1c(ccc(c1F)C=O)O 271570a_203496583355_200010981996 [1,1,0,0,0,0|2,0,0]=4 1047 B14R1.4106 COc1c(ccc(c1F)CC(=O)C)Cl 1458a_100000070787_100010116237 [0,1,0,0,0,1|2,0,0]=4 1048 B14R1.8824 Cc1c(ccc(c1Br)Cl)NC(=O)CO 22a_100016073598_100000210174 [0,1,0,0,0,1|2,0,0]=4 1049 B14R1.8824 Cc1c(ccc(c1Br)Cl)NC(=O)CO 527a_100016073598_100000210174 [0,1,0,0,0,1|2,0,0]=4 1050 B14R1.8824 Cc1c(ccc(c1Cl)NC(=O)CO)Cl 22a_100011935240_100000210174 [0,1,0,0,0,1|2,0,0]=4 1051 B14R1.8824 Cc1ccc(c(c1O)Cl)NC(=O)CO 22a_100000036876_100000210174 [0,1,0,0,0,1|2,0,0]=4 1052 B14R1.2316 C=Cc1ccc(c(c1C)N)C(=O)OC 271570a_100011290941_100000764893 [0,2,0,0,0,0|2,0,0]=4 1053 B14R1.2316 C=Cc1ccc(c(c1F)N)C(=O)OC 271570a_100011290941_100022009169 [0,2,0,0,0,0|2,0,0]=4 1054 B14R1.2316 C=Cc1ccc(c(c1O)C)C(=O)OC 271570a_100011290941_100010889012 [0,2,0,0,0,0|2,0,0]=4 1055 B14R1.2316 C=Cc1ccc(c(c1O)F)C(=O)OC 271570a_100011290941_100011096176 [0,2,0,0,0,0|2,0,0]=4 1056 B14R1.2316 COC(=O)c1ccc(c(c1C)O)OC 271570a_203496583355_100010761468 [0,2,0,0,0,0|2,0,0]=4 1057 B14R1.2316 COC(=O)c1ccc(c(c1C)O)SC 62a_100010889012_200000210301 [0,2,0,0,0,0|2,0,0]=4 1058 B14R1.2316 COC(=O)c1ccc(c(c1C)O)SC 62a_200000210301_100010889012 [0,2,0,0,0,0|2,0,0]=4 1059 B14R1.2316 COC(=O)c1ccc(c(c1C)O)S[13CH3] 62a_100010889012_200025704644 [0,2,0,0,0,0|2,0,0]=4 1060 B14R1.2316 COC(=O)c1ccc(c(c1C)O)S[13CH3] 62a_200025704644_100010889012 [0,2,0,0,0,0|2,0,0]=4 1061 B14R1.2316 COC(=O)c1ccc(c(c1F)O)SC 62a_100011096176_200000210301 [0,2,0,0,0,0|2,0,0]=4 1062 B14R1.2316 COC(=O)c1ccc(c(c1F)O)SC 62a_200000210301_100011096176 [0,2,0,0,0,0|2,0,0]=4 1063 B14R1.2316 COC(=O)c1ccc(c(c1F)O)S[13CH3] 62a_100011096176_200025704644 [0,2,0,0,0,0|2,0,0]=4 1064 B14R1.2316 COC(=O)c1ccc(c(c1F)O)S[13CH3] 62a_200025704644_100011096176 [0,2,0,0,0,0|2,0,0]=4 1065 B14R1.2316 COC(=O)c1ccc(c(c1N)C)SC 62a_100000764893_200000210301 [0,2,0,0,0,0|2,0,0]=4 1066 B14R1.2316 COC(=O)c1ccc(c(c1N)C)S[13CH3] 62a_100000764893_200025704644 [0,2,0,0,0,0|2,0,0]=4 1067 B14R1.2316 COC(=O)c1ccc(c(c1N)F)SC 62a_100022009169_200000210301 [0,2,0,0,0,0|2,0,0]=4 1068 B14R1.2316 COC(=O)c1ccc(c(c1N)F)S[13CH3] 62a_100022009169_200025704644 [0,2,0,0,0,0|2,0,0]=4 1069 B14R1.2876 COC(=O)c1cc(c(c(c1F)O)F)F 271570a_203496583355_100010238687 [0,2,0,0,0,0|1,1,0]=4 1070 B14R1.4114 CCC(=O)c1ccc(c(c1F)OC)Cl 1458a_100010116254_100000210202 [0,2,0,0,0,0|2,0,0]=4 1071 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)Cl 11a_106832991635_100010116254 [0,2,0,0,0,0|2,0,0]=4 1072 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)Cl 1626a_100102657272_100010116254 [0,2,0,0,0,0|2,0,0]=4 1073 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)Cl 240690a_100102657272_100010116254 [0,2,0,0,0,0|2,0,0]=4 1074 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)Cl 527a_100102657272_100010116254 [0,2,0,0,0,0|2,0,0]=4 1075 B14R1.4114 COC(=O)c1ccc(c(c1C)OC)Br 34a_100010889012_200000210301 [0,2,0,0,0,0|1,1,0]=4 1076 B14R1.4114 COC(=O)c1ccc(c(c1C)OC)Br 7a_100010889012_200000210301 [0,2,0,0,0,0|1,1,0]=4 1077 B14R1.4114 COC(=O)c1ccc(c(c1C)O[13CH3])Br 34a_100010889012_200025704644 [0,2,0,0,0,0|1,1,0]=4 1078 B14R1.4114 COC(=O)c1ccc(c(c1C)O[13CH3])Br 7a_100010889012_200025704644 [0,2,0,0,0,0|1,1,0]=4 1079 B14R1.4114 COC(=O)c1ccc(c(c1F)OC)Br 34a_100011096176_200000210301 [0,2,0,0,0,0|1,1,0]=4 1080 B14R1.4114 COC(=O)c1ccc(c(c1F)OC)Br 7a_100011096176_200000210301 [0,2,0,0,0,0|1,1,0]=4 1081 B14R1.4114 COC(=O)c1ccc(c(c1F)O[13CH3])Br 34a_100011096176_200025704644 [0,2,0,0,0,0|1,1,0]=4 1082 B14R1.4114 COC(=O)c1ccc(c(c1F)O[13CH3])Br 7a_100011096176_200025704644 [0,2,0,0,0,0|1,1,0]=4 1083 B14R1.4114 COc1c(ccc(c1F)C(=O)CF)Cl 1458a_100010116254_100015361967 [0,2,0,0,0,0|2,0,0]=4 1084 B14R1.7265 CCOC(=O)c1ccc(c(c1C)O)F 271570a_203496583355_200000729658 [0,2,0,0,0,0|1,1,0]=4 1085 B14R1.7265 Cc1c(ccc(c1Cl)C(=O)CCO)Cl 1458a_100010074829_100000211926 [0,2,0,0,0,0|2,0,0]=4 1086 B14R1.7265 Cc1c(ccc(c1F)C(=O)CCO)Cl 1458a_100012183103_100000211926 [0,2,0,0,0,0|2,0,0]=4 1087 B14R1.7265 O=C(CCO)c1ccc(c(c1Br)O)Br 1458a_100016068111_100000211926 [0,2,0,0,0,0|1,1,0]=4 1088 B14R1.7265 O=C(CCO)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_100000211926 [0,2,0,0,0,0|2,0,0]=4 1089 B14R1.7265 O=C(CCO)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_100000211926 [0,2,0,0,0,0|2,0,0]=4 1090 B14R1.7265 O=C(CCO)c1ccc(c(c1Cl)O)O 1458a_100009910189_100000211926 [0,2,0,0,0,0|2,0,0]=4 1091 B14R1.7265 O=C(CCO)c1ccc(c(c1F)F)Cl 1458a_100000085317_100000211926 [0,2,0,0,0,0|2,0,0]=4 1092 B14R1.7265 O=C(CCO)c1ccc(c(c1F)O)F 1458a_100000084588_100000211926 [0,2,0,0,0,0|1,1,0]=4 1093 B14R1.7265 O=C(CCO)c1ccc(c(c1O)O)O 1458a_100000037941_100000211926 [0,2,0,0,0,0|2,0,0]=4 1094 B14R1.4189 COc1c(cc(c(c1F)C(=O)C)Cl)Cl 1458a_100160470565_200000210301 [0,2,0,0,0,0|2,0,0]=4 1095 B14R1.4189 COc1c(cc(c(c1F)C(=O)[13CH3])Cl)Cl 1458a_100160470565_200025704644 [0,2,0,0,0,0|2,0,0]=4 1096 B14R1.5389 CCOc1c(ccc(c1F)C(=O)C)Cl 1458a_100010116260_200000210301 [0,2,0,0,0,0|2,0,0]=4 1097 B14R1.5389 CCOc1c(ccc(c1F)C(=O)[13CH3])Cl 1458a_100010116260_200025704644 [0,2,0,0,0,0|2,0,0]=4 1098 B12R2.196 Cc1c[nH]c2c1cccc2O 271570a_203496583355_100010186758 [1,0,0,1,0,0|2,0,0]=4 1099 B12R2.196 Cc1cccc2c1[nH]nc2O 271570a_203496583355_100010186057 [1,0,0,1,0,0|2,0,0]=4 1100 B12R2.196 Cc1n[nH]c2c1cccc2O 271570a_203496583355_100010255084 [1,0,0,1,0,0|2,0,0]=4 1101 B12R2.196 Nc1cccc2c1[nH]nc2O 271570a_203496583355_100009888981 [1,0,0,1,0,0|2,0,0]=4 1102 B12R2.196 Nc1n[nH]c2c1cccc2O 271570a_203496583355_100010069757 [1,0,0,1,0,0|2,0,0]=4 1103 B12R2.196 O=C1CCc2c1cccc2O 271570a_203496583355_100000744605 [1,0,0,1,0,0|2,0,0]=4 1104 B12R2.196 O=C1COc2c1cccc2O 271570a_203496583355_100011230590 [1,0,0,1,0,0|2,0,0]=4 1105 B12R2.196 O=C1NCc2c1cccc2O 271570a_203496583355_100000688282 [1,0,0,1,0,0|2,0,0]=4 1106 B12R2.196 O=C1OCc2c1cccc2O 271570a_203496583355_100010167076 [1,0,0,1,0,0|1,0,0]=3 1107 B12R2.196 O=c1[nH][nH]c2c1cccc2O 271570a_203496583355_100012199144 [1,0,0,1,0,0|1,0,0]=3 1108 B12R2.196 Oc1n[nH]c2c1cccc2Br 271570a_203496583355_100010197283 [1,0,0,1,0,0|2,0,0]=4 1109 B12R2.196 Oc1n[nH]c2c1cccc2Cl 271570a_203496583355_100000050086 [1,0,0,1,0,0|2,0,0]=4 1110 B12R2.196 Oc1n[nH]c2c1cccc2F 271570a_203496583355_100010231504 [1,0,0,1,0,0|2,0,0]=4 1111 B12R2.196 Oc1n[nH]c2c1cccc2O 271570a_203496583355_200010988877 [1,0,0,1,0,0|1,0,0]=3 1112 B12R2.612 Cc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100000049534 [1,0,0,1,0,0|2,0,0]=4 1113 B12R2.612 Nc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100009816878 [1,0,0,1,0,0|2,0,0]=4 1114 B12R2.612 O=C1OCc2c1ccc(c2)O 271570a_203496583355_100009816608 [1,0,0,1,0,0|2,0,0]=4 1115 B12R2.612 O=c1[nH][nH]c2c1ccc(c2)O 271570a_203496583355_100012353722 [1,0,0,1,0,0|2,0,0]=4 1116 B12R2.612 Oc1n[nH]c2c1ccc(c2)Br 271570a_203496583355_100010186045 [1,0,0,1,0,0|1,1,0]=4 1117 B12R2.612 Oc1n[nH]c2c1ccc(c2)Cl 271570a_203496583355_100000049627 [1,0,0,1,0,0|1,0,0]=3 1118 B12R2.612 Oc1n[nH]c2c1ccc(c2)F 271570a_203496583355_100000049990 [1,0,0,1,0,0|1,1,0]=4 1119 B12R2.82 Cc1ccc2cc[nH]c2c1O 271570a_203496583355_100010717004 [1,0,0,1,0,0|2,0,0]=4 1120 B12R2.82 Cc1ccc2cn[nH]c2c1O 271570a_203496583355_100009817202 [1,0,0,1,0,0|2,0,0]=4 1121 B12R2.82 Oc1c(ccc2c1[nH]nc2)F 271570a_203496583355_100010762478 [1,0,0,1,0,0|1,1,0]=4 1122 B14R2.8653 CC(=O)c1ccc(c2c1[nH]cc2)Cl 1458a_100009924714_200000210301 [0,1,0,1,0,0|2,0,0]=4 1123 B14R2.8653 [13CH3]C(=O)c1ccc(c2c1[nH]cc2)Cl 1458a_100009924714_200025704644 [0,1,0,1,0,0|2,0,0]=4 1124 B12R1.233 CC(=Cc1ccc(cc1N)Cl)C 271570a_100102525489_100000761886 [1,0,0,0,0,1|2,0,0]=4 1125 B12R1.233 CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000070787_100000755608 [1,0,0,0,0,1|2,0,0]=4 1126 B12R1.233 CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_200000210301 [1,0,0,0,0,1|2,0,0]=4 1127 B12R1.233 CC(=O)Cc1ccc(cc1C)Cl 1458a_100000070787_100012361307 [1,0,0,0,0,1|2,0,0]=4 1128 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000070787_100000188473 [1,0,0,0,0,1|2,0,0]=4 1129 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_200000210301 [1,0,0,0,0,1|2,0,0]=4 1130 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1458a_100000070787_100000709361 [1,0,0,0,0,1|2,0,0]=4 1131 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_200000210301 [1,0,0,0,0,1|2,0,0]=4 1132 B12R1.233 CC(=O)Cc1ccc(cc1I)Cl 1458a_100000070787_100010254388 [1,0,0,0,0,1|2,0,0]=4 1133 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl 11a_100000752454_100015343762 [1,0,0,0,0,1|2,0,0]=4 1134 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl 1626a_100000752454_100015343762 [1,0,0,0,0,1|2,0,0]=4 1135 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 11a_100000210418_100015343762 [1,0,0,0,0,1|2,0,0]=4 1136 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 1626a_100000210418_100015343762 [1,0,0,0,0,1|2,0,0]=4 1137 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 22a_100000210418_100000070787 [1,0,0,0,0,1|2,0,0]=4 1138 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 11a_100000185861_100015343762 [1,0,0,0,0,1|2,0,0]=4 1139 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 1626a_100000185861_100015343762 [1,0,0,0,0,1|2,0,0]=4 1140 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100000070787 [1,0,0,0,0,1|2,0,0]=4 1141 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 11a_100000211020_100015343762 [1,0,0,0,0,1|2,0,0]=4 1142 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 1626a_100000211020_100015343762 [1,0,0,0,0,1|2,0,0]=4 1143 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 22a_100000211020_100000070787 [1,0,0,0,0,1|2,0,0]=4 1144 B12R1.233 CC(=O)Nc1ccc(cc1I)Cl 11a_100000761889_100015343762 [1,0,0,0,0,1|2,0,0]=4 1145 B12R1.233 CC(=O)Nc1ccc(cc1I)Cl 1626a_100000761889_100015343762 [1,0,0,0,0,1|2,0,0]=4 1146 B12R1.233 CC(=O)Nc1ccc(cc1N)O 271570a_203496583355_100000749274 [1,0,0,0,0,1|2,0,0]=4 1147 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000070787 [1,0,0,0,0,1|2,0,0]=4 1148 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100103153847 [1,0,0,0,0,1|2,0,0]=4 1149 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_200025704644 [1,0,0,0,0,1|2,0,0]=4 1150 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_200025704644 [1,0,0,0,0,1|2,0,0]=4 1151 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_200025704644 [1,0,0,0,0,1|2,0,0]=4 1152 B14R1.6059 NC(=O)CSc1ccc(c(c1N)O)Br 62a_100020748643_100000747473 [0,0,0,0,0,2|1,1,0]=4 1153 B14R1.6059 Nc1c(ccc(c1O)Br)SCC(=O)[O-] 62a_100020748643_100020667443 [0,0,0,0,0,2|0,1,1]=4