0 B21R2.362231 Cc1cc(c(c(c1)O)C(=O)CCc2ccc(cc2)Br)O 1458a_100000036929_100011740612 [0,0,0,0,0,0|2,0,2]=4 1 B21R2.362231 Cc1cc(c(c(c1)O)C(=O)CCc2ccc(cc2)Cl)O 1458a_100000036929_100011713675 [0,0,0,0,0,0|2,0,2]=4 2 B21R2.362231 Cc1cc(c(c(c1)O)C(=O)CCc2ccc(cc2)F)O 1458a_100000036929_100011217392 [0,0,0,0,0,0|2,0,2]=4 3 B21R2.362231 Cc1cc(c(c(c1)O)C(=O)CCc2ccc(cc2)O)C 1458a_100011255216_100009816426 [0,0,0,0,0,0|2,0,2]=4 4 B21R2.362231 Cc1cc(c(c(c1)O)C(=O)CCc2ccc(cc2)O)O 1458a_100000036929_100009816426 [0,0,0,0,0,0|1,0,2]=3 5 B21R2.362231 Cc1cc(c(c(c1)O)C(=O)NCc2ccc(cc2)Br)O 527a_100000174875_100000036929 [0,0,0,0,0,0|3,0,1]=4 6 B21R2.362231 Cc1cc(c(c(c1)O)C(=O)NCc2ccc(cc2)Cl)O 527a_100000174871_100000036929 [0,0,0,0,0,0|3,0,1]=4 7 B21R2.362231 Cc1cc(c(c(c1)O)C(=O)NCc2ccc(cc2)F)O 527a_100000174882_100000036929 [0,0,0,0,0,0|3,0,1]=4 8 B21R2.362231 Cc1cc(c(c(c1)O)C(=O)NCc2ccc(cc2)I)O 527a_100016989417_100000036929 [0,0,0,0,0,0|3,0,1]=4 9 B21R2.362231 Cc1cc(c(c(c1)O)C(=O)NCc2ccc(cc2)O)O 527a_100000185549_100000036929 [0,0,0,0,0,0|2,0,1]=3 10 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Br)O)O 1458a_200000061528_100011740612 [0,0,0,0,0,0|2,0,2]=4 11 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Cl)O)O 1458a_200000061528_100011713675 [0,0,0,0,0,0|2,0,2]=4 12 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)F)O)O 1458a_200000061528_100011217392 [0,0,0,0,0,0|2,0,2]=4 13 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)O)C)O 1458a_100000066486_100009816426 [0,0,0,0,0,0|2,0,2]=4 14 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)O)O)O 1458a_200000061528_100009816426 [0,0,0,0,0,0|1,0,2]=3 15 B21R2.362231 Cc1cc(cc(c1C(=O)NCc2ccc(cc2)O)C)O 240690a_100000185549_100000066486 [0,0,0,0,0,0|3,0,1]=4 16 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2O)C)O 1458a_100000036929_100011713686 [0,0,0,0,0,0|2,0,2]=4 17 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2O)O)C 1458a_200000061528_100011713686 [0,0,0,0,0,0|2,0,2]=4 18 B21R2.362231 Cc1ccc(cc1)CNC(=O)c2c(cc(cc2O)C)O 527a_100000174908_100000036929 [0,0,0,0,0,0|3,0,1]=4 19 B21R2.362231 Cc1ccc(cc1)CNC(=O)c2c(cc(cc2O)O)O 527a_100000174908_100000040092 [0,0,0,0,0,0|2,0,1]=3 20 B21R2.362231 Cc1ccc(cn1)CNC(=O)c2c(cc(cc2O)O)O 527a_100000740942_100000040092 [0,0,0,0,0,0|3,0,1]=4 21 B21R2.362231 Cc1ccc(nc1)CNC(=O)c2c(cc(cc2O)O)O 527a_100015187455_100000040092 [0,0,0,0,0,0|3,0,1]=4 22 B21R2.362231 O=C(CCc1ccc(cc1)O)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100009816426 [0,0,0,0,0,0|2,0,2]=4 23 B21R2.362231 O=C(CCc1ccc(cc1)O)c2c(cc(cc2F)Br)O 1458a_200015963038_100009816426 [0,0,0,0,0,0|2,0,2]=4 24 B21R2.362231 O=C(CCc1ccc(cc1)O)c2c(cc(cc2F)F)O 1458a_100000746385_100009816426 [0,0,0,0,0,0|2,0,2]=4 25 B21R2.362231 O=C(CCc1ccc(cc1)O)c2c(cc(cc2F)O)F 1458a_100000038755_100009816426 [0,0,0,0,0,0|2,0,2]=4 26 B21R2.362231 O=C(NCc1ccc(cc1)Br)c2c(cc(cc2O)O)O 527a_100000174875_100000040092 [0,0,0,0,0,0|2,0,1]=3 27 B21R2.362231 O=C(NCc1ccc(cc1)Cl)c2c(cc(cc2O)O)O 527a_100000174871_100000040092 [0,0,0,0,0,0|2,0,1]=3 28 B21R2.362231 O=C(NCc1ccc(cc1)F)c2c(cc(cc2O)O)O 527a_100000174882_100000040092 [0,0,0,0,0,0|2,0,1]=3 29 B21R2.362231 O=C(NCc1ccc(cc1)I)c2c(cc(cc2O)O)O 527a_100016989417_100000040092 [0,0,0,0,0,0|2,0,1]=3 30 B21R2.362231 O=C(NCc1ccc(cc1)O)c2c(cc(cc2Cl)O)Cl 240690a_100000185549_100010423397 [0,0,0,0,0,0|3,0,1]=4 31 B21R2.362231 O=C(NCc1ccc(cc1)O)c2c(cc(cc2F)Br)O 527a_100000185549_200015963038 [0,0,0,0,0,0|3,0,1]=4 32 B21R2.362231 O=C(NCc1ccc(cc1)O)c2c(cc(cc2F)F)O 240690a_100000185549_100000746385 [0,0,0,0,0,0|3,0,1]=4 33 B21R2.362231 O=C(NCc1ccc(cc1)O)c2c(cc(cc2F)F)O 527a_100000185549_100000746385 [0,0,0,0,0,0|3,0,1]=4 34 B21R2.362231 O=C(NCc1ccc(cc1)O)c2c(cc(cc2F)O)F 240690a_100000185549_100000038755 [0,0,0,0,0,0|3,0,1]=4 35 B21R2.362231 O=C(NCc1ccc(cc1)O)c2c(cc(cc2F)O)F 527a_100000185549_100000038755 [0,0,0,0,0,0|3,0,1]=4 36 B21R2.362231 O=C(NCc1ccc(cc1)O)c2c(cc(cc2O)O)O 527a_100000185549_100000040092 [0,0,0,0,0,0|1,0,1]=2 37 B21R2.362231 O=C(NCc1ccc(cn1)Br)c2c(cc(cc2O)O)O 527a_100015188789_100000040092 [0,0,0,0,0,0|3,0,1]=4 38 B21R2.362231 O=C(NCc1ccc(cn1)Cl)c2c(cc(cc2O)O)O 527a_100000697193_100000040092 [0,0,0,0,0,0|3,0,1]=4 39 B21R2.362231 O=C(NCc1ccc(cn1)F)c2c(cc(cc2O)O)O 527a_100020620131_100000040092 [0,0,0,0,0,0|3,0,1]=4 40 B21R2.362231 O=C(NCc1ccc(nc1)Br)c2c(cc(cc2O)O)O 527a_100009817727_100000040092 [0,0,0,0,0,0|3,0,1]=4 41 B21R2.362231 O=C(NCc1ccc(nc1)Cl)c2c(cc(cc2O)O)O 527a_100000735879_100000040092 [0,0,0,0,0,0|3,0,1]=4 42 B21R2.362231 O=C(NCc1ccc(nc1)F)c2c(cc(cc2O)O)O 527a_100000101913_100000040092 [0,0,0,0,0,0|3,0,1]=4 43 B20R2.15570 Cc1cc(ccc1C(=O)CCc2ccc(cc2)O)O 1458a_100000692822_100009816426 [1,0,0,0,0,0|1,0,2]=4 44 B20R2.15570 Cc1cc(ccc1C(=O)NCc2ccc(cc2)O)O 240690a_100000185549_100000692822 [1,0,0,0,0,0|2,0,1]=4 45 B20R2.15570 Cc1cc(ccc1C(=O)NCc2ccc(cc2)O)O 527a_100000185549_100000692822 [1,0,0,0,0,0|2,0,1]=4 46 B20R2.15570 Cc1ccc(c(c1)O)C(=O)CCc2ccc(cc2)O 1458a_100000212137_100009816426 [1,0,0,0,0,0|1,0,2]=4 47 B20R2.15570 Cc1ccc(c(c1)O)C(=O)NCc2ccc(cc2)O 240690a_100000185549_100000212137 [1,0,0,0,0,0|2,0,1]=4 48 B20R2.15570 Cc1ccc(c(c1)O)C(=O)NCc2ccc(cc2)O 527a_100000185549_100000212137 [1,0,0,0,0,0|2,0,1]=4 49 B20R2.15570 Cc1ccc(cc1)CCC(=O)c2ccc(cc2O)O 1458a_100000212172_100011713686 [1,0,0,0,0,0|1,0,2]=4 50 B20R2.15570 Cc1ccc(cc1)NCC(=O)c2ccc(cc2O)O 34a_100000124888_100009814262 [1,0,0,0,0,0|2,0,1]=4 51 B20R2.15570 Cc1ccc(cc1)NNC(=O)c2ccc(cc2O)O 22a_100000683527_100000212172 [1,0,0,0,0,0|3,0,0]=4 52 B20R2.15570 Cc1ccc(cc1)OCC(=O)c2ccc(cc2O)O 34a_100000210336_100009814262 [1,0,0,0,0,0|2,0,1]=4 53 B20R2.15570 Cc1ccc(cc1)OCC(=O)c2ccc(cc2O)O 7a_100000210336_100009814262 [1,0,0,0,0,0|2,0,1]=4 54 B20R2.15570 Cc1ccc(cc1)SCC(=O)c2ccc(cc2O)O 62a_100000186775_100009814262 [1,0,0,0,0,0|2,0,1]=4 55 B20R2.15570 Cc1ccc(cc1)SCC(=O)c2ccc(cc2O)O 62a_100009814262_100000186775 [1,0,0,0,0,0|2,0,1]=4 56 B20R2.15570 Nc1ccc(cc1)OCC(=O)c2ccc(cc2O)O 34a_100000185829_100009814262 [1,0,0,0,0,0|2,0,1]=4 57 B20R2.15570 Nc1ccc(cc1)SCC(=O)c2ccc(cc2O)O 62a_100000185761_100009814262 [1,0,0,0,0,0|2,0,1]=4 58 B20R2.15570 Nc1ccc(cc1)SCC(=O)c2ccc(cc2O)O 62a_100009814262_100000185761 [1,0,0,0,0,0|2,0,1]=4 59 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2O)O 1458a_100000212172_100011740612 [1,0,0,0,0,0|1,0,2]=4 60 B20R2.15570 O=C(CCc1ccc(cc1)Cl)c2ccc(cc2O)O 1458a_100000212172_100011713675 [1,0,0,0,0,0|1,0,2]=4 61 B20R2.15570 O=C(CCc1ccc(cc1)F)c2ccc(cc2O)O 1458a_100000212172_100011217392 [1,0,0,0,0,0|1,0,2]=4 62 B20R2.15570 O=C(CCc1ccc(cc1)O)c2ccc(cc2Br)O 1458a_100012344906_100009816426 [1,0,0,0,0,0|1,0,2]=4 63 B20R2.15570 O=C(CCc1ccc(cc1)O)c2ccc(cc2Cl)O 1458a_100000702456_100009816426 [1,0,0,0,0,0|1,0,2]=4 64 B20R2.15570 O=C(CCc1ccc(cc1)O)c2ccc(cc2F)O 1458a_100000689029_100009816426 [1,0,0,0,0,0|1,0,2]=4 65 B20R2.15570 O=C(CCc1ccc(cc1)O)c2ccc(cc2O)Br 1458a_100000744433_100009816426 [1,0,0,0,0,0|1,0,2]=4 66 B20R2.15570 O=C(CCc1ccc(cc1)O)c2ccc(cc2O)Cl 1458a_100000188622_100009816426 [1,0,0,0,0,0|1,0,2]=4 67 B20R2.15570 O=C(CCc1ccc(cc1)O)c2ccc(cc2O)F 1458a_100000746061_100009816426 [1,0,0,0,0,0|1,0,2]=4 68 B20R2.15570 O=C(CCc1ccc(cc1)O)c2ccc(cc2O)I 1458a_100000091984_100009816426 [1,0,0,0,0,0|1,0,2]=4 69 B20R2.15570 O=C(CCc1ccc(cc1)O)c2ccc(cc2O)O 1458a_100000212172_100009816426 [1,0,0,0,0,0|0,0,2]=3 70 B20R2.15570 O=C(CNc1ccc(cc1)Br)c2ccc(cc2O)O 34a_100000210018_100009814262 [1,0,0,0,0,0|2,0,1]=4 71 B20R2.15570 O=C(CNc1ccc(cc1)Cl)c2ccc(cc2O)O 34a_100000210052_100009814262 [1,0,0,0,0,0|2,0,1]=4 72 B20R2.15570 O=C(CNc1ccc(cc1)F)c2ccc(cc2O)O 34a_100000185862_100009814262 [1,0,0,0,0,0|2,0,1]=4 73 B20R2.15570 O=C(CNc1ccc(cc1)I)c2ccc(cc2O)O 34a_100000185761_100009814262 [1,0,0,0,0,0|2,0,1]=4 74 B20R2.15570 O=C(CNc1ccc(cc1)O)c2ccc(cc2O)F 34a_100000185829_100009817053 [1,0,0,0,0,0|2,0,1]=4 75 B20R2.15570 O=C(CNc1ccc(cc1)O)c2ccc(cc2O)O 34a_100000185829_100009814262 [1,0,0,0,0,0|1,0,1]=3 76 B20R2.15570 O=C(COc1ccc(cc1)Br)c2ccc(cc2O)O 34a_100000185759_100009814262 [1,0,0,0,0,0|2,0,1]=4 77 B20R2.15570 O=C(COc1ccc(cc1)Br)c2ccc(cc2O)O 7a_100000185759_100009814262 [1,0,0,0,0,0|2,0,1]=4 78 B20R2.15570 O=C(COc1ccc(cc1)Cl)c2ccc(cc2O)O 34a_100000210216_100009814262 [1,0,0,0,0,0|2,0,1]=4 79 B20R2.15570 O=C(COc1ccc(cc1)Cl)c2ccc(cc2O)O 7a_100000210216_100009814262 [1,0,0,0,0,0|2,0,1]=4 80 B20R2.15570 O=C(COc1ccc(cc1)F)c2ccc(cc2O)O 34a_100000210339_100009814262 [1,0,0,0,0,0|2,0,1]=4 81 B20R2.15570 O=C(COc1ccc(cc1)I)c2ccc(cc2O)O 34a_100000212066_100009814262 [1,0,0,0,0,0|2,0,1]=4 82 B20R2.15570 O=C(COc1ccc(cc1)I)c2ccc(cc2O)O 7a_100000212066_100009814262 [1,0,0,0,0,0|2,0,1]=4 83 B20R2.15570 O=C(CSc1ccc(cc1)Br)c2ccc(cc2O)O 62a_100000752885_100009814262 [1,0,0,0,0,0|2,0,1]=4 84 B20R2.15570 O=C(CSc1ccc(cc1)Br)c2ccc(cc2O)O 62a_100009814262_100000752885 [1,0,0,0,0,0|2,0,1]=4 85 B20R2.15570 O=C(CSc1ccc(cc1)Cl)c2ccc(cc2O)O 62a_100000755918_100009814262 [1,0,0,0,0,0|2,0,1]=4 86 B20R2.15570 O=C(CSc1ccc(cc1)Cl)c2ccc(cc2O)O 62a_100009814262_100000755918 [1,0,0,0,0,0|2,0,1]=4 87 B20R2.15570 O=C(CSc1ccc(cc1)F)c2ccc(cc2O)O 62a_100000211213_100009814262 [1,0,0,0,0,0|2,0,1]=4 88 B20R2.15570 O=C(CSc1ccc(cc1)F)c2ccc(cc2O)O 62a_100009814262_100000211213 [1,0,0,0,0,0|2,0,1]=4 89 B20R2.15570 O=C(CSc1ccc(cc1)O)c2ccc(cc2O)F 62a_100009817053_100000185759 [1,0,0,0,0,0|2,0,1]=4 90 B20R2.15570 O=C(CSc1ccc(cc1)O)c2ccc(cc2O)O 62a_100009814262_100000185759 [1,0,0,0,0,0|1,0,1]=3 91 B20R2.15570 O=C(CSc1ccc(cn1)O)c2ccc(cc2O)O 62a_100000685995_100009814262 [1,0,0,0,0,0|2,0,1]=4 92 B20R2.15570 O=C(CSc1ccc(cn1)O)c2ccc(cc2O)O 62a_100009814262_100000744096 [1,0,0,0,0,0|2,0,1]=4 93 B20R2.15570 O=C(NCc1ccc(cc1)O)c2ccc(cc2Br)O 240690a_100000185549_100012344906 [1,0,0,0,0,0|2,0,1]=4 94 B20R2.15570 O=C(NCc1ccc(cc1)O)c2ccc(cc2Br)O 527a_100000185549_100012344906 [1,0,0,0,0,0|2,0,1]=4 95 B20R2.15570 O=C(NCc1ccc(cc1)O)c2ccc(cc2Cl)O 240690a_100000185549_100000702456 [1,0,0,0,0,0|2,0,1]=4 96 B20R2.15570 O=C(NCc1ccc(cc1)O)c2ccc(cc2Cl)O 527a_100000185549_100000702456 [1,0,0,0,0,0|2,0,1]=4 97 B20R2.15570 O=C(NCc1ccc(cc1)O)c2ccc(cc2F)O 240690a_100000185549_100000689029 [1,0,0,0,0,0|2,0,1]=4 98 B20R2.15570 O=C(NCc1ccc(cc1)O)c2ccc(cc2F)O 527a_100000185549_100000689029 [1,0,0,0,0,0|2,0,1]=4 99 B20R2.15570 O=C(NCc1ccc(cc1)O)c2ccc(cc2O)Br 240690a_100000185549_100000744433 [1,0,0,0,0,0|2,0,1]=4 100 B20R2.15570 O=C(NCc1ccc(cc1)O)c2ccc(cc2O)Br 527a_100000185549_100000744433 [1,0,0,0,0,0|2,0,1]=4 101 B20R2.15570 O=C(NCc1ccc(cc1)O)c2ccc(cc2O)Cl 240690a_100000185549_100000188622 [1,0,0,0,0,0|2,0,1]=4 102 B20R2.15570 O=C(NCc1ccc(cc1)O)c2ccc(cc2O)Cl 527a_100000185549_100000188622 [1,0,0,0,0,0|2,0,1]=4 103 B20R2.15570 O=C(NCc1ccc(cc1)O)c2ccc(cc2O)F 240690a_100000185549_100000746061 [1,0,0,0,0,0|2,0,1]=4 104 B20R2.15570 O=C(NCc1ccc(cc1)O)c2ccc(cc2O)F 527a_100000185549_100000746061 [1,0,0,0,0,0|2,0,1]=4 105 B20R2.15570 O=C(NCc1ccc(cc1)O)c2ccc(cc2O)I 240690a_100000185549_100000091984 [1,0,0,0,0,0|2,0,1]=4 106 B20R2.15570 O=C(NCc1ccc(cc1)O)c2ccc(cc2O)I 527a_100000185549_100000091984 [1,0,0,0,0,0|2,0,1]=4 107 B20R2.15570 O=C(NNc1ccc(cc1)Br)c2ccc(cc2O)O 22a_100000735608_100000212172 [1,0,0,0,0,0|3,0,0]=4 108 B20R2.15570 O=C(NNc1ccc(cc1)Cl)c2ccc(cc2O)O 22a_100000683521_100000212172 [1,0,0,0,0,0|3,0,0]=4 109 B20R2.15570 O=C(NNc1ccc(cc1)F)c2ccc(cc2O)O 22a_100000728448_100000212172 [1,0,0,0,0,0|3,0,0]=4 110 B20R2.15570 O=C(NNc1ccc(cc1)I)c2ccc(cc2O)O 22a_100016988836_100000212172 [1,0,0,0,0,0|3,0,0]=4 111 B20R2.23087 Cc1cc(c(c(c1)O)C(=O)CCc2ccccc2)O 1458a_100000036929_100000765856 [1,0,0,0,0,0|1,0,2]=4 112 B20R2.23087 Cc1cc(c(c(c1)O)C(=O)NCc2ccccc2)O 527a_100015324214_100000036929 [1,0,0,0,0,0|2,0,1]=4 113 B20R2.23087 Cc1cc(cc(c1C(=O)CCc2ccccc2)O)O 1458a_200000061528_100000765856 [1,0,0,0,0,0|1,0,2]=4 114 B20R2.23087 O=C(NCc1ccccc1)c2c(cc(cc2O)O)O 527a_100015324214_100000040092 [1,0,0,0,0,0|1,0,1]=3 115 B20R2.23087 O=C(NCc1ccccn1)c2c(cc(cc2O)O)O 527a_100000210449_100000040092 [1,0,0,0,0,0|2,0,1]=4 116 B20R2.23087 O=C(NCc1cccnc1)c2c(cc(cc2O)O)O 527a_100000210453_100000040092 [1,0,0,0,0,0|2,0,1]=4 117 B20R2.23087 O=C(NCc1ccncc1)c2c(cc(cc2O)O)O 527a_100000210450_100000040092 [1,0,0,0,0,0|2,0,1]=4 118 B20R2.237947 Cc1ccc(cc1)CCC(=O)c2c(cccc2O)O 1458a_100000755285_100011713686 [1,0,0,0,0,0|1,0,2]=4 119 B20R2.237947 Cc1ccc(cc1)CNC(=O)c2c(cccc2O)O 527a_100000174908_100000755285 [1,0,0,0,0,0|2,0,1]=4 120 B20R2.237947 Cc1cccc(c1C(=O)CCc2ccc(cc2)O)O 1458a_100011934116_100009816426 [1,0,0,0,0,0|1,0,2]=4 121 B20R2.237947 O=C(CCc1ccc(cc1)Br)c2c(cccc2O)O 1458a_100000755285_100011740612 [1,0,0,0,0,0|1,0,2]=4 122 B20R2.237947 O=C(CCc1ccc(cc1)Cl)c2c(cccc2O)O 1458a_100000755285_100011713675 [1,0,0,0,0,0|1,0,2]=4 123 B20R2.237947 O=C(CCc1ccc(cc1)F)c2c(cccc2O)O 1458a_100000755285_100011217392 [1,0,0,0,0,0|1,0,2]=4 124 B20R2.237947 O=C(CCc1ccc(cc1)O)c2c(cccc2Br)O 1458a_100011935254_100009816426 [1,0,0,0,0,0|1,0,2]=4 125 B20R2.237947 O=C(CCc1ccc(cc1)O)c2c(cccc2Cl)O 1458a_100000745519_100009816426 [1,0,0,0,0,0|1,0,2]=4 126 B20R2.237947 O=C(CCc1ccc(cc1)O)c2c(cccc2F)O 1458a_100000763259_100009816426 [1,0,0,0,0,0|1,0,2]=4 127 B20R2.237947 O=C(CCc1ccc(cc1)O)c2c(cccc2O)O 1458a_100000755285_100009816426 [1,0,0,0,0,0|0,0,2]=3 128 B20R2.237947 O=C(NCc1ccc(cc1)Br)c2c(cccc2O)O 527a_100000174875_100000755285 [1,0,0,0,0,0|2,0,1]=4 129 B20R2.237947 O=C(NCc1ccc(cc1)Cl)c2c(cccc2O)O 527a_100000174871_100000755285 [1,0,0,0,0,0|2,0,1]=4 130 B20R2.237947 O=C(NCc1ccc(cc1)F)c2c(cccc2O)O 527a_100000174882_100000755285 [1,0,0,0,0,0|2,0,1]=4 131 B20R2.237947 O=C(NCc1ccc(cc1)I)c2c(cccc2O)O 527a_100016989417_100000755285 [1,0,0,0,0,0|2,0,1]=4 132 B20R2.237947 O=C(NCc1ccc(cc1)O)c2c(cccc2Br)O 240690a_100000185549_100011935254 [1,0,0,0,0,0|2,0,1]=4 133 B20R2.237947 O=C(NCc1ccc(cc1)O)c2c(cccc2Br)O 527a_100000185549_100011935254 [1,0,0,0,0,0|2,0,1]=4 134 B20R2.237947 O=C(NCc1ccc(cc1)O)c2c(cccc2Cl)O 240690a_100000185549_100000745519 [1,0,0,0,0,0|2,0,1]=4 135 B20R2.237947 O=C(NCc1ccc(cc1)O)c2c(cccc2Cl)O 527a_100000185549_100000745519 [1,0,0,0,0,0|2,0,1]=4 136 B20R2.237947 O=C(NCc1ccc(cc1)O)c2c(cccc2F)O 527a_100000185549_100000763259 [1,0,0,0,0,0|2,0,1]=4 137 B20R2.237947 O=C(NCc1ccc(cc1)O)c2c(cccc2O)O 527a_100000185549_100000755285 [1,0,0,0,0,0|1,0,1]=3 138 B20R2.240458 Cc1ccc(cc1)NN=Cc2c(cc(cc2O)O)O 4a_100000683527_100000039965 [1,0,0,0,0,0|3,0,0]=4 139 B20R2.240458 Oc1cc(c(c(c1)O)C=NNc2ccc(cc2)Br)O 4a_100000735608_100000039965 [1,0,0,0,0,0|3,0,0]=4 140 B20R2.240458 Oc1cc(c(c(c1)O)C=NNc2ccc(cc2)Cl)O 4a_100000683521_100000039965 [1,0,0,0,0,0|3,0,0]=4 141 B20R2.240458 Oc1cc(c(c(c1)O)C=NNc2ccc(cc2)F)O 4a_100000728448_100000039965 [1,0,0,0,0,0|3,0,0]=4 142 B20R2.240458 Oc1cc(c(c(c1)O)C=NNc2ccc(cc2)I)O 4a_100016988836_100000039965 [1,0,0,0,0,0|3,0,0]=4 143 B20R2.240458 Oc1ccc(cc1)CCSc2c(cc(cc2O)O)O 62a_100009816426_200010341185 [1,0,0,0,0,0|1,0,2]=4 144 B22R2.177013 C#Cc1ccc(cc1)CNC(=O)c2c(cc(cc2O)O)O 527a_100015199678_100000040092 [0,1,0,0,0,0|2,0,1]=4 145 B22R2.177013 C=Cc1ccc(cc1)CNC(=O)c2c(cc(cc2O)O)O 527a_200011934891_100000040092 [0,1,0,0,0,0|2,0,1]=4 146 B22R2.177013 CCc1ccc(cc1)CNC(=O)c2c(cc(cc2O)O)O 527a_100000721222_100000040092 [0,1,0,0,0,0|2,0,1]=4 147 B22R2.177013 COc1ccc(cc1)CCC(=O)c2c(cc(cc2O)C)O 1458a_100000036929_100000184700 [0,1,0,0,0,0|1,0,2]=4 148 B22R2.177013 COc1ccc(cc1)CCC(=O)c2c(cc(cc2O)O)C 1458a_200000061528_100000184700 [0,1,0,0,0,0|1,0,2]=4 149 B22R2.177013 COc1ccc(cc1)CNC(=O)c2c(cc(cc2O)C)O 527a_100000185587_100000036929 [0,1,0,0,0,0|2,0,1]=4 150 B22R2.177013 COc1ccc(cc1)CNC(=O)c2c(cc(cc2O)O)O 527a_100000185587_100000040092 [0,1,0,0,0,0|1,0,1]=3 151 B22R2.177013 COc1ccc(cn1)CNC(=O)c2c(cc(cc2O)O)O 527a_100000241975_100000040092 [0,1,0,0,0,0|2,0,1]=4 152 B22R2.177013 COc1ccc(nc1)CNC(=O)c2c(cc(cc2O)O)O 527a_100000703904_100000040092 [0,1,0,0,0,0|2,0,1]=4 153 B22R2.177013 CSc1ccc(cc1)CNC(=O)c2c(cc(cc2O)O)O 527a_100000174980_100000040092 [0,1,0,0,0,0|1,1,1]=4 154 B22R2.177013 Cc1cc(c(c(c1)O)C(=O)NCc2ccc(cc2)CO)O 527a_100015189231_100000036929 [0,1,0,0,0,0|2,0,1]=4 155 B22R2.177013 N#Cc1ccc(cc1)CNC(=O)c2c(cc(cc2O)O)O 527a_100015207190_100000040092 [0,1,0,0,0,0|2,0,1]=4 156 B22R2.177013 O=C(NCc1ccc(cc1)CO)c2c(cc(cc2O)O)O 527a_100015189231_100000040092 [0,1,0,0,0,0|1,0,1]=3 157 B22R2.3901870 C[C@@H](NC(=O)c1c(cc(cc1O)O)O)c2ccc(cc2)Br 527a_100000720352_100000040092 [0,1,0,0,0,0|2,0,1]=4 158 B22R2.3901870 C[C@@H](NC(=O)c1c(cc(cc1O)O)O)c2ccc(cc2)Cl 527a_100015205461_100000040092 [0,1,0,0,0,0|2,0,1]=4 159 B22R2.3901870 C[C@H](NC(=O)c1c(cc(cc1O)O)O)c2ccc(cc2)F 527a_100025705893_100000040092 [0,1,0,0,0,0|2,0,1]=4 160 B22R2.3901870 C[C@H](NC(=O)c1c(cc(cc1O)O)O)c2ccc(cc2)I 527a_100000753911_100000040092 [0,1,0,0,0,0|2,0,1]=4 161 B22R2.3901870 Cc1cc(c(c(c1)O)C(=O)CC(=O)c2ccc(cc2)Br)O 1458a_100000036929_100000188085 [0,1,0,0,0,0|2,0,1]=4 162 B22R2.3901870 Cc1cc(c(c(c1)O)C(=O)CC(=O)c2ccc(cc2)Cl)O 1458a_100000036929_100000211071 [0,1,0,0,0,0|2,0,1]=4 163 B22R2.3901870 Cc1cc(c(c(c1)O)C(=O)CC(=O)c2ccc(cc2)F)O 1458a_100000036929_100000211279 [0,1,0,0,0,0|2,0,1]=4 164 B22R2.3901870 Cc1cc(c(c(c1)O)C(=O)CC(=O)c2ccc(cc2)I)O 1458a_100000036929_100011216261 [0,1,0,0,0,0|2,0,1]=4 165 B22R2.3901870 Cc1cc(c(c(c1)O)C(=O)CC(=O)c2ccc(cc2)O)C 1458a_100011255216_100009814261 [0,1,0,0,0,0|2,0,1]=4 166 B22R2.3901870 Cc1cc(c(c(c1)O)C(=O)CC(=O)c2ccc(cc2)O)O 1458a_100000036929_100009814261 [0,1,0,0,0,0|1,0,1]=3 167 B22R2.3901870 Cc1cc(cc(c1C(=O)CC(=O)c2ccc(cc2)Br)O)O 1458a_200000061528_100000188085 [0,1,0,0,0,0|2,0,1]=4 168 B22R2.3901870 Cc1cc(cc(c1C(=O)CC(=O)c2ccc(cc2)Cl)O)O 1458a_200000061528_100000211071 [0,1,0,0,0,0|2,0,1]=4 169 B22R2.3901870 Cc1cc(cc(c1C(=O)CC(=O)c2ccc(cc2)F)O)O 1458a_200000061528_100000211279 [0,1,0,0,0,0|2,0,1]=4 170 B22R2.3901870 Cc1cc(cc(c1C(=O)CC(=O)c2ccc(cc2)I)O)O 1458a_200000061528_100011216261 [0,1,0,0,0,0|2,0,1]=4 171 B22R2.3901870 Cc1cc(cc(c1C(=O)CC(=O)c2ccc(cc2)O)C)O 1458a_100000066486_100009814261 [0,1,0,0,0,0|2,0,1]=4 172 B22R2.3901870 Cc1cc(cc(c1C(=O)CC(=O)c2ccc(cc2)O)O)O 1458a_200000061528_100009814261 [0,1,0,0,0,0|1,0,1]=3 173 B22R2.3901870 Cc1ccc(cc1)C(=O)CC(=O)c2c(cc(cc2O)C)O 1458a_100000036929_100000211441 [0,1,0,0,0,0|2,0,1]=4 174 B22R2.3901870 Cc1ccc(cc1)C(=O)CC(=O)c2c(cc(cc2O)O)C 1458a_200000061528_100000211441 [0,1,0,0,0,0|2,0,1]=4 175 B22R2.3901870 Cc1ccc(cc1)[C@@H](C)NC(=O)c2c(cc(cc2O)O)O 527a_100016988085_100000040092 [0,1,0,0,0,0|2,0,1]=4 176 B22R2.3901870 O=C(CC(=O)c1c(cc(cc1Cl)O)Cl)c2ccc(cc2)O 1458a_100010423397_100009814261 [0,1,0,0,0,0|2,0,1]=4 177 B22R2.3901870 O=C(CC(=O)c1c(cc(cc1F)Br)O)c2ccc(cc2)O 1458a_200015963038_100009814261 [0,1,0,0,0,0|2,0,1]=4 178 B22R2.3901870 O=C(CC(=O)c1c(cc(cc1F)F)O)c2ccc(cc2)O 1458a_100000746385_100009814261 [0,1,0,0,0,0|2,0,1]=4 179 B22R2.3901870 O=C(CC(=O)c1c(cc(cc1F)O)F)c2ccc(cc2)O 1458a_100000038755_100009814261 [0,1,0,0,0,0|2,0,1]=4 180 B22R2.3902017 CN(Cc1ccc(cc1)Br)C(=O)c2c(cc(cc2O)O)O 527a_100000180866_100000040092 [0,1,0,0,0,0|2,0,1]=4 181 B22R2.3902017 CN(Cc1ccc(cc1)Cl)C(=O)c2c(cc(cc2O)O)O 527a_100000184517_100000040092 [0,1,0,0,0,0|2,0,1]=4 182 B22R2.3902017 CN(Cc1ccc(cc1)F)C(=O)c2c(cc(cc2O)O)O 527a_100000184576_100000040092 [0,1,0,0,0,0|2,0,1]=4 183 B22R2.3902017 CN(Cc1ccc(cc1)O)C(=O)c2c(cc(cc2O)O)O 527a_100000207500_100000040092 [0,1,0,0,0,0|1,0,1]=3 184 B22R2.3902017 Cc1cc(c(c(c1)O)C(=O)N(C)Cc2ccc(cc2)O)O 527a_100000207500_100000036929 [0,1,0,0,0,0|2,0,1]=4 185 B22R2.3902017 Cc1ccc(cc1)CN(C)C(=O)c2c(cc(cc2O)O)O 527a_100000744650_100000040092 [0,1,0,0,0,0|2,0,1]=4 186 B22R2.4081717 Cc1cc(c(c(c1)O)C(=O)NCc2ccc(cc2Cl)O)O 527a_200161156549_100000036929 [0,1,0,0,0,0|2,0,1]=4 187 B22R2.4081717 Cc1cc(ccc1CNC(=O)c2c(cc(cc2O)O)O)Br 527a_100000753881_100000040092 [0,1,0,0,0,0|2,0,1]=4 188 B22R2.4081717 Cc1cc(ccc1CNC(=O)c2c(cc(cc2O)O)O)Cl 527a_103436540063_100000040092 [0,1,0,0,0,0|2,0,1]=4 189 B22R2.4081717 Cc1cc(ccc1CNC(=O)c2c(cc(cc2O)O)O)F 527a_100137329023_100000040092 [0,1,0,0,0,0|2,0,1]=4 190 B22R2.4081717 Cc1ccc(c(c1)C)CNC(=O)c2c(cc(cc2O)O)O 527a_100000737523_100000040092 [0,1,0,0,0,0|2,0,1]=4 191 B22R2.4081717 Cc1ccc(c(c1)Cl)CNC(=O)c2c(cc(cc2O)O)O 527a_100011997539_100000040092 [0,1,0,0,0,0|2,0,1]=4 192 B22R2.4081717 Cc1ccc(c(c1)F)CNC(=O)c2c(cc(cc2O)O)O 527a_100102887089_100000040092 [0,1,0,0,0,0|2,0,1]=4 193 B22R2.4081717 O=C(NCc1ccc(cc1Br)Cl)c2c(cc(cc2O)O)O 527a_100102692131_100000040092 [0,1,0,0,0,0|2,0,1]=4 194 B22R2.4081717 O=C(NCc1ccc(cc1Br)F)c2c(cc(cc2O)O)O 527a_100000708791_100000040092 [0,1,0,0,0,0|2,0,1]=4 195 B22R2.4081717 O=C(NCc1ccc(cc1Cl)Br)c2c(cc(cc2O)O)O 527a_100020628970_100000040092 [0,1,0,0,0,0|2,0,1]=4 196 B22R2.4081717 O=C(NCc1ccc(cc1Cl)Cl)c2c(cc(cc2O)O)O 527a_100000174880_100000040092 [0,1,0,0,0,0|2,0,1]=4 197 B22R2.4081717 O=C(NCc1ccc(cc1Cl)F)c2c(cc(cc2O)O)O 527a_100000174946_100000040092 [0,1,0,0,0,0|2,0,1]=4 198 B22R2.4081717 O=C(NCc1ccc(cc1Cl)O)c2c(cc(cc2O)O)O 527a_200161156549_100000040092 [0,1,0,0,0,0|1,0,1]=3 199 B22R2.4081717 O=C(NCc1ccc(cc1F)Br)c2c(cc(cc2O)O)O 527a_100000754580_100000040092 [0,1,0,0,0,0|2,0,1]=4 200 B22R2.4081717 O=C(NCc1ccc(cc1F)Cl)c2c(cc(cc2O)O)O 527a_100000708496_100000040092 [0,1,0,0,0,0|2,0,1]=4 201 B22R2.4081717 O=C(NCc1ccc(cc1F)F)c2c(cc(cc2O)O)O 527a_100000737868_100000040092 [0,1,0,0,0,0|2,0,1]=4 202 B22R2.8237677 Cc1cc(c(c(c1)O)C(=O)CCc2ccc(c(c2)O)O)O 1458a_100000036929_200010393615 [0,1,0,0,0,0|1,0,2]=4 203 B22R2.8237677 Cc1cc(c(c(c1)O)C(=O)NCc2ccc(c(c2)F)O)O 527a_100000758358_100000036929 [0,1,0,0,0,0|2,0,1]=4 204 B22R2.8237677 Cc1cc(cc(c1C(=O)CCc2ccc(c(c2)O)O)O)O 1458a_200000061528_200010393615 [0,1,0,0,0,0|1,0,2]=4 205 B22R2.8237677 Cc1cc(ccc1Br)CNC(=O)c2c(cc(cc2O)O)O 527a_100015205234_100000040092 [0,1,0,0,0,0|2,0,1]=4 206 B22R2.8237677 Cc1cc(ccc1F)CNC(=O)c2c(cc(cc2O)O)O 527a_100000239911_100000040092 [0,1,0,0,0,0|2,0,1]=4 207 B22R2.8237677 Cc1ccc(cc1C)CNC(=O)c2c(cc(cc2O)O)O 527a_100025706692_100000040092 [0,1,0,0,0,0|2,0,1]=4 208 B22R2.8237677 Cc1ccc(cc1Cl)CNC(=O)c2c(cc(cc2O)O)O 527a_102495364989_100000040092 [0,1,0,0,0,0|2,0,1]=4 209 B22R2.8237677 Cc1ccc(cc1F)CNC(=O)c2c(cc(cc2O)O)O 527a_100102708794_100000040092 [0,1,0,0,0,0|2,0,1]=4 210 B22R2.8237677 O=C(NCc1ccc(c(c1)Br)Br)c2c(cc(cc2O)O)O 527a_100012351559_100000040092 [0,1,0,0,0,0|2,0,1]=4 211 B22R2.8237677 O=C(NCc1ccc(c(c1)Br)Cl)c2c(cc(cc2O)O)O 527a_100012349490_100000040092 [0,1,0,0,0,0|2,0,1]=4 212 B22R2.8237677 O=C(NCc1ccc(c(c1)Br)F)c2c(cc(cc2O)O)O 527a_100015193890_100000040092 [0,1,0,0,0,0|2,0,1]=4 213 B22R2.8237677 O=C(NCc1ccc(c(c1)Cl)Br)c2c(cc(cc2O)O)O 527a_100012362553_100000040092 [0,1,0,0,0,0|2,0,1]=4 214 B22R2.8237677 O=C(NCc1ccc(c(c1)Cl)Cl)c2c(cc(cc2O)O)O 527a_100000174881_100000040092 [0,1,0,0,0,0|2,0,1]=4 215 B22R2.8237677 O=C(NCc1ccc(c(c1)Cl)F)c2c(cc(cc2O)O)O 527a_100000749334_100000040092 [0,1,0,0,0,0|2,0,1]=4 216 B22R2.8237677 O=C(NCc1ccc(c(c1)F)Br)c2c(cc(cc2O)O)O 527a_100000755036_100000040092 [0,1,0,0,0,0|2,0,1]=4 217 B22R2.8237677 O=C(NCc1ccc(c(c1)F)Cl)c2c(cc(cc2O)O)O 527a_100011219866_100000040092 [0,1,0,0,0,0|2,0,1]=4 218 B22R2.8237677 O=C(NCc1ccc(c(c1)F)F)c2c(cc(cc2O)O)O 527a_100000737897_100000040092 [0,1,0,0,0,0|2,0,1]=4 219 B22R2.8237677 O=C(NCc1ccc(c(c1)F)O)c2c(cc(cc2O)O)O 527a_100000758358_100000040092 [0,1,0,0,0,0|1,0,1]=3 220 B22R2.8237677 O=C(NCc1ccc(c(c1)O)Cl)c2c(cc(cc2O)O)O 527a_100020636435_100000040092 [0,1,0,0,0,0|2,0,1]=4 221 B22R2.8237677 O=C(NCc1ccc(c(c1)O)F)c2c(cc(cc2O)O)O 527a_100160469508_100000040092 [0,1,0,0,0,0|2,0,1]=4 222 B22R3.41829772 Cc1cc(c(c(c1)O)c2ccc3ccc(cc3c2)O)C 271570a_100010391161_100009816537 [0,0,0,1,0,0|3,0,0]=4 223 B22R3.41829772 Cc1cc(c(c(c1)O)c2ccc3ccc(cc3n2)O)C 271570a_100010391161_100000079174 [0,0,0,1,0,0|3,0,0]=4 224 B22R3.41829772 Cc1ccc2ncc(cc2c1)c3c(cc(cc3O)O)O 271570a_200010887317_200010341185 [0,0,0,1,0,0|3,0,0]=4 225 B22R3.41829772 O=c1ccc2ccc(cc2o1)c3c(cc(cc3O)O)O 271570a_100010741648_200010341185 [0,0,0,1,0,0|2,0,1]=4 226 B22R3.41829772 Oc1cc(c(c(c1)F)c2ccc3ccc(cc3c2)O)F 271570a_100010390980_100009816537 [0,0,0,1,0,0|3,0,0]=4 227 B22R3.41829772 Oc1cc(c(c(c1)F)c2ccc3ccc(cc3n2)O)F 271570a_100010390980_100000079174 [0,0,0,1,0,0|3,0,0]=4 228 B20R2.239988 Cc1cc(c(c(c1)O)C(=O)Cc2ccc(cc2)Br)O 1458a_100000036929_100000189115 [0,0,0,0,1,0|2,0,1]=4 229 B20R2.239988 Cc1cc(c(c(c1)O)C(=O)Cc2ccc(cc2)Cl)O 1458a_100000036929_100000694040 [0,0,0,0,1,0|2,0,1]=4 230 B20R2.239988 Cc1cc(c(c(c1)O)C(=O)Cc2ccc(cc2)F)O 1458a_100000036929_100000198546 [0,0,0,0,1,0|2,0,1]=4 231 B20R2.239988 Cc1cc(c(c(c1)O)C(=O)Cc2ccc(cc2)I)O 1458a_100000036929_100000189116 [0,0,0,0,1,0|2,0,1]=4 232 B20R2.239988 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(cc2)Br)O 527a_100000210018_100000036929 [0,0,0,0,1,0|3,0,0]=4 233 B20R2.239988 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(cc2)Cl)O 527a_100000210052_100000036929 [0,0,0,0,1,0|3,0,0]=4 234 B20R2.239988 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(cc2)F)O 527a_100000185862_100000036929 [0,0,0,0,1,0|3,0,0]=4 235 B20R2.239988 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(cc2)I)O 527a_100000185761_100000036929 [0,0,0,0,1,0|3,0,0]=4 236 B20R2.239988 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(cc2)O)C 22a_100000185829_100011255216 [0,0,0,0,1,0|3,0,0]=4 237 B20R2.239988 Cc1cc(cc(c1C(=O)Cc2ccc(cc2)Br)O)O 1458a_200000061528_100000189115 [0,0,0,0,1,0|2,0,1]=4 238 B20R2.239988 Cc1cc(cc(c1C(=O)Cc2ccc(cc2)Cl)O)O 1458a_200000061528_100000694040 [0,0,0,0,1,0|2,0,1]=4 239 B20R2.239988 Cc1cc(cc(c1C(=O)Cc2ccc(cc2)F)O)O 1458a_200000061528_100000198546 [0,0,0,0,1,0|2,0,1]=4 240 B20R2.239988 Cc1cc(cc(c1C(=O)Cc2ccc(cc2)I)O)O 1458a_200000061528_100000189116 [0,0,0,0,1,0|2,0,1]=4 241 B20R2.239988 Cc1cc(cc(c1C(=O)Nc2ccc(cc2)O)C)O 22a_100000185829_100000066486 [0,0,0,0,1,0|3,0,0]=4 242 B20R2.239988 Cc1ccc(cc1)CC(=O)c2c(cc(cc2O)C)O 1458a_100000036929_100000210814 [0,0,0,0,1,0|2,0,1]=4 243 B20R2.239988 Cc1ccc(cc1)CC(=O)c2c(cc(cc2O)O)C 1458a_200000061528_100000210814 [0,0,0,0,1,0|2,0,1]=4 244 B20R2.239988 Cc1ccc(cc1)NC(=O)c2c(cc(cc2O)C)O 527a_100000124888_100000036929 [0,0,0,0,1,0|3,0,0]=4 245 B20R2.239988 Cc1ccc(cc1)NC(=O)c2c(cc(cc2O)O)O 527a_100000124888_100000040092 [0,0,0,0,1,0|2,0,0]=3 246 B20R2.239988 O=C(Nc1ccc(cc1)Br)c2c(cc(cc2O)O)O 527a_100000210018_100000040092 [0,0,0,0,1,0|2,0,0]=3 247 B20R2.239988 O=C(Nc1ccc(cc1)Cl)c2c(cc(cc2O)O)O 527a_100000210052_100000040092 [0,0,0,0,1,0|2,0,0]=3 248 B20R2.239988 O=C(Nc1ccc(cc1)F)c2c(cc(cc2O)O)O 527a_100000185862_100000040092 [0,0,0,0,1,0|2,0,0]=3 249 B20R2.239988 O=C(Nc1ccc(cc1)I)c2c(cc(cc2O)O)O 527a_100000185761_100000040092 [0,0,0,0,1,0|2,0,0]=3 250 B20R2.239988 O=C(Nc1ccc(cc1)O)c2c(cc(cc2Cl)O)Cl 22a_100000185829_100010423397 [0,0,0,0,1,0|3,0,0]=4 251 B20R2.239988 O=C(Nc1ccc(cc1)O)c2c(cc(cc2F)Br)O 22a_100000185829_200015963038 [0,0,0,0,1,0|3,0,0]=4 252 B20R2.239988 O=C(Nc1ccc(cc1)O)c2c(cc(cc2F)O)F 22a_100000185829_100000038755 [0,0,0,0,1,0|3,0,0]=4 253 B22R2.8242512 Cc1cc(c(c(c1)O)C(=O)NCCc2ccc(cc2)O)O 527a_100000743037_100000036929 [0,0,0,0,0,1|1,0,2]=4 254 B22R2.8242512 Cc1ccc(cc1)CCNC(=O)c2c(cc(cc2O)O)O 527a_100000705350_100000040092 [0,0,0,0,0,1|1,0,2]=4 255 B22R2.8242512 O=C(NCCc1ccc(cc1)Br)c2c(cc(cc2O)O)O 527a_100000755846_100000040092 [0,0,0,0,0,1|1,0,2]=4 256 B22R2.8242512 O=C(NCCc1ccc(cc1)Cl)c2c(cc(cc2O)O)O 527a_100000185265_100000040092 [0,0,0,0,0,1|1,0,2]=4 257 B22R2.8242512 O=C(NCCc1ccc(cc1)F)c2c(cc(cc2O)O)O 527a_100000199005_100000040092 [0,0,0,0,0,1|1,0,2]=4 258 B22R2.8242512 O=C(NCCc1ccc(cc1)O)c2c(cc(cc2O)O)O 527a_100000743037_100000040092 [0,0,0,0,0,1|0,0,2]=3 259 B22R2.8264761 Cc1cc(c(c(c1)C)NC(=O)C=Cc2ccc(cc2)O)C 22a_100000210045_100016269017 [0,0,0,0,0,1|3,0,0]=4 260 B22R2.8264761 Cc1cc(c(c(c1)Cl)NC(=O)C=Cc2ccc(cc2)Br)O 22a_100015906060_100016267368 [0,0,0,0,0,1|3,0,0]=4 261 B22R2.8264761 Cc1cc(c(c(c1)Cl)NC(=O)C=Cc2ccc(cc2)Cl)O 22a_100015906060_100000184863 [0,0,0,0,0,1|3,0,0]=4 262 B22R2.8264761 Cc1cc(c(c(c1)Cl)NC(=O)C=Cc2ccc(cc2)F)O 22a_100015906060_100000182136 [0,0,0,0,0,1|3,0,0]=4 263 B22R2.8264761 Cc1cc(c(c(c1)Cl)NC(=O)C=Cc2ccc(cc2)I)O 22a_100015906060_100102526154 [0,0,0,0,0,1|3,0,0]=4 264 B22R2.8264761 Cc1cc(c(c(c1)Cl)NC(=O)C=Cc2ccc(cc2)O)O 22a_100015906060_100016269017 [0,0,0,0,0,1|2,0,0]=3 265 B22R2.8264761 Cc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)Br)C)O 22a_100011934200_100016267368 [0,0,0,0,0,1|3,0,0]=4 266 B22R2.8264761 Cc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)Br)O)Br 22a_100010371313_100016267368 [0,0,0,0,0,1|3,0,0]=4 267 B22R2.8264761 Cc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)Cl)C)O 22a_100011934200_100000184863 [0,0,0,0,0,1|3,0,0]=4 268 B22R2.8264761 Cc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)Cl)O)Br 22a_100010371313_100000184863 [0,0,0,0,0,1|3,0,0]=4 269 B22R2.8264761 Cc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)F)C)O 22a_100011934200_100000182136 [0,0,0,0,0,1|3,0,0]=4 270 B22R2.8264761 Cc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)F)O)Br 22a_100010371313_100000182136 [0,0,0,0,0,1|3,0,0]=4 271 B22R2.8264761 Cc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)I)C)O 22a_100011934200_100102526154 [0,0,0,0,0,1|3,0,0]=4 272 B22R2.8264761 Cc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)I)O)Br 22a_100010371313_100102526154 [0,0,0,0,0,1|3,0,0]=4 273 B22R2.8264761 Cc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)O)C)Cl 22a_100000692879_100016269017 [0,0,0,0,0,1|3,0,0]=4 274 B22R2.8264761 Cc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)O)C)F 22a_100011290887_100016269017 [0,0,0,0,0,1|3,0,0]=4 275 B22R2.8264761 Cc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)O)C)I 22a_100011356821_100016269017 [0,0,0,0,0,1|3,0,0]=4 276 B22R2.8264761 Cc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)O)C)O 22a_100011934200_100016269017 [0,0,0,0,0,1|2,0,0]=3 277 B22R2.8264761 Cc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)O)F)Cl 22a_100012017672_100016269017 [0,0,0,0,0,1|3,0,0]=4 278 B22R2.8264761 Cc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)O)O)Br 22a_100010371313_100016269017 [0,0,0,0,0,1|2,0,0]=3 279 B22R2.8264761 Cc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2C)O)C 22a_100011934200_100000716854 [0,0,0,0,0,1|3,0,0]=4 280 B22R2.8264761 Cc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2Cl)C)O 22a_100015906060_100000716854 [0,0,0,0,0,1|3,0,0]=4 281 B22R2.8264761 Cc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2F)Br)O 22a_100015475841_100000716854 [0,0,0,0,0,1|3,0,0]=4 282 B22R2.8264761 Cc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2F)Cl)O 22a_100010883250_100000716854 [0,0,0,0,0,1|3,0,0]=4 283 B22R2.8264761 Cc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2F)F)O 22a_100011217947_100000716854 [0,0,0,0,0,1|3,0,0]=4 284 B22R2.8264761 Cc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2F)O)F 1626a_100000036573_100000716854 [0,0,0,0,0,1|3,0,0]=4 285 B22R2.8264761 Cc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2O)Br)C 22a_100010371313_100000716854 [0,0,0,0,0,1|3,0,0]=4 286 B22R2.8264761 O=C(C=Cc1ccc(cc1)Br)Nc2c(cc(cc2F)Br)O 22a_100015475841_100016267368 [0,0,0,0,0,1|3,0,0]=4 287 B22R2.8264761 O=C(C=Cc1ccc(cc1)Br)Nc2c(cc(cc2F)Cl)O 22a_100010883250_100016267368 [0,0,0,0,0,1|3,0,0]=4 288 B22R2.8264761 O=C(C=Cc1ccc(cc1)Br)Nc2c(cc(cc2F)F)O 22a_100011217947_100016267368 [0,0,0,0,0,1|3,0,0]=4 289 B22R2.8264761 O=C(C=Cc1ccc(cc1)Br)Nc2c(cc(cc2F)O)F 1626a_100000036573_100016267368 [0,0,0,0,0,1|3,0,0]=4 290 B22R2.8264761 O=C(C=Cc1ccc(cc1)Cl)Nc2c(cc(cc2F)Br)O 22a_100015475841_100000184863 [0,0,0,0,0,1|3,0,0]=4 291 B22R2.8264761 O=C(C=Cc1ccc(cc1)Cl)Nc2c(cc(cc2F)Cl)O 22a_100010883250_100000184863 [0,0,0,0,0,1|3,0,0]=4 292 B22R2.8264761 O=C(C=Cc1ccc(cc1)Cl)Nc2c(cc(cc2F)F)O 22a_100011217947_100000184863 [0,0,0,0,0,1|3,0,0]=4 293 B22R2.8264761 O=C(C=Cc1ccc(cc1)Cl)Nc2c(cc(cc2F)O)F 1626a_100000036573_100000184863 [0,0,0,0,0,1|3,0,0]=4 294 B22R2.8264761 O=C(C=Cc1ccc(cc1)F)Nc2c(cc(cc2F)Br)O 22a_100015475841_100000182136 [0,0,0,0,0,1|3,0,0]=4 295 B22R2.8264761 O=C(C=Cc1ccc(cc1)F)Nc2c(cc(cc2F)Cl)O 22a_100010883250_100000182136 [0,0,0,0,0,1|3,0,0]=4 296 B22R2.8264761 O=C(C=Cc1ccc(cc1)F)Nc2c(cc(cc2F)F)O 22a_100011217947_100000182136 [0,0,0,0,0,1|3,0,0]=4 297 B22R2.8264761 O=C(C=Cc1ccc(cc1)F)Nc2c(cc(cc2F)O)F 1626a_100000036573_100000182136 [0,0,0,0,0,1|3,0,0]=4 298 B22R2.8264761 O=C(C=Cc1ccc(cc1)I)Nc2c(cc(cc2F)Br)O 22a_100015475841_100102526154 [0,0,0,0,0,1|3,0,0]=4 299 B22R2.8264761 O=C(C=Cc1ccc(cc1)I)Nc2c(cc(cc2F)Cl)O 22a_100010883250_100102526154 [0,0,0,0,0,1|3,0,0]=4 300 B22R2.8264761 O=C(C=Cc1ccc(cc1)I)Nc2c(cc(cc2F)F)O 22a_100011217947_100102526154 [0,0,0,0,0,1|3,0,0]=4 301 B22R2.8264761 O=C(C=Cc1ccc(cc1)I)Nc2c(cc(cc2F)O)F 1626a_100000036573_100102526154 [0,0,0,0,0,1|3,0,0]=4 302 B22R2.8264761 O=C(C=Cc1ccc(cc1)O)Nc2c(cc(cc2F)Br)O 22a_100015475841_100016269017 [0,0,0,0,0,1|2,0,0]=3 303 B22R2.8264761 O=C(C=Cc1ccc(cc1)O)Nc2c(cc(cc2F)Cl)O 22a_100010883250_100016269017 [0,0,0,0,0,1|2,0,0]=3 304 B22R2.8264761 O=C(C=Cc1ccc(cc1)O)Nc2c(cc(cc2F)F)O 22a_100011217947_100016269017 [0,0,0,0,0,1|2,0,0]=3 305 B19R2.4531 O=C(CCc1ccccc1)c2ccc(cc2O)O 1458a_100000212172_100000765856 [2,0,0,0,0,0|0,0,2]=4 306 B19R2.4531 O=C(CNc1ccccc1)c2ccc(cc2O)O 34a_100000106764_100009814262 [2,0,0,0,0,0|1,0,1]=4 307 B19R2.4531 O=C(COc1ccccc1)c2ccc(cc2O)O 34a_100000210340_100009814262 [2,0,0,0,0,0|1,0,1]=4 308 B19R2.4531 O=C(COc1ccccc1)c2ccc(cc2O)O 7a_100000210340_100009814262 [2,0,0,0,0,0|1,0,1]=4 309 B19R2.4531 O=C(CSc1ccccc1)c2ccc(cc2O)O 62a_100000719477_100009814262 [2,0,0,0,0,0|1,0,1]=4 310 B19R2.4531 O=C(CSc1ccccc1)c2ccc(cc2O)O 62a_100009814262_100000041952 [2,0,0,0,0,0|1,0,1]=4 311 B19R2.4531 O=C(NNc1ccccc1)c2ccc(cc2O)O 22a_100015195140_100000212172 [2,0,0,0,0,0|2,0,0]=4 312 B19R2.11870 O=C(/C=C/c1ccc(cc1)F)c2ccc(cc2)O 271570a_203496583355_200103154542 [2,0,0,0,0,0|1,0,0]=3 313 B19R2.11870 O=C(CCc1ccc(cc1)O)c2ccc(cc2)O 1458a_100000212099_100009816426 [2,0,0,0,0,0|0,0,2]=4 314 B19R2.11870 O=C(CNc1ccc(cc1)O)c2ccc(cc2)O 34a_100000185829_100009814261 [2,0,0,0,0,0|1,0,1]=4 315 B19R2.11870 O=C(CSc1ccc(cc1)O)c2ccc(cc2)O 62a_100009814261_100000185759 [2,0,0,0,0,0|1,0,1]=4 316 B19R2.11870 O=C(NCc1ccc(cc1)O)c2ccc(cc2)O 240690a_100000185549_100000212099 [2,0,0,0,0,0|1,0,1]=4 317 B19R2.11870 O=C(NCc1ccc(cc1)O)c2ccc(cc2)O 527a_100000185549_100000212099 [2,0,0,0,0,0|1,0,1]=4 318 B19R2.12083 O=C(/C=C/c1ccc(cc1)O)c2ccccc2O 271570a_203496583355_200020609928 [2,0,0,0,0,0|0,0,0]=2 319 B19R2.12083 O=C(CCc1ccc(cc1)O)c2ccccc2O 1458a_100015234032_100009816426 [2,0,0,0,0,0|0,0,2]=4 320 B19R2.12083 O=C(CSc1ccc(cc1)O)c2ccccc2O 62a_100000188908_100000185759 [2,0,0,0,0,0|1,0,1]=4 321 B19R2.12083 O=C(NCc1ccc(cc1)O)c2ccccc2O 240690a_100000185549_100015234032 [2,0,0,0,0,0|1,0,1]=4 322 B19R2.12083 O=C(OCc1ccc(cc1)O)c2ccccc2O 271570a_203496583355_100000751000 [2,0,0,0,0,0|1,0,1]=4 323 B19R2.60515 Oc1cc(c(c(c1)O)C=CCc2ccccc2)O 271570a_200016263579_200010341185 [2,0,0,0,0,0|0,0,1]=3 324 B19R2.60515 Oc1cc(c(c(c1)O)C=NNc2ccccc2)O 4a_100015195140_100000039965 [2,0,0,0,0,0|2,0,0]=4 325 B19R2.61554 O=C(CCc1ccccc1)c2c(cccc2O)O 1458a_100000755285_100000765856 [2,0,0,0,0,0|0,0,2]=4 326 B19R2.61554 O=C(NCc1ccccc1)c2c(cccc2O)O 527a_100015324214_100000755285 [2,0,0,0,0,0|1,0,1]=4 327 B21R2.3861 COc1ccc(c(c1)O)C(=O)CCc2ccc(cc2)O 1458a_100000212123_100009816426 [1,1,0,0,0,0|0,0,2]=4 328 B21R2.3861 COc1ccc(c(c1)O)C(=O)NCc2ccc(cc2)O 240690a_100000185549_100000212123 [1,1,0,0,0,0|1,0,1]=4 329 B21R2.3861 COc1ccc(c(c1)O)C(=O)NCc2ccc(cc2)O 527a_100000185549_100000212123 [1,1,0,0,0,0|1,0,1]=4 330 B21R2.6385 COc1ccc(cc1)CCC(=O)c2ccc(cc2O)O 1458a_100000212172_100000184700 [1,1,0,0,0,0|0,0,2]=4 331 B21R2.6385 COc1ccc(cc1)NCC(=O)c2ccc(cc2O)O 34a_100000184247_100009814262 [1,1,0,0,0,0|1,0,1]=4 332 B21R2.6385 COc1ccc(cc1)NNC(=O)c2ccc(cc2O)O 22a_100000005221_100000212172 [1,1,0,0,0,0|2,0,0]=4 333 B21R2.6385 COc1ccc(cc1)OCC(=O)c2ccc(cc2O)O 34a_100000210503_100009814262 [1,1,0,0,0,0|1,0,1]=4 334 B21R2.6385 COc1ccc(cc1)SCC(=O)c2ccc(cc2O)O 62a_100009814262_100000171711 [1,1,0,0,0,0|1,0,1]=4 335 B21R2.6385 O=C(CNc1ccc(cc1)CO)c2ccc(cc2O)O 34a_100011215238_100009814262 [1,1,0,0,0,0|1,0,1]=4 336 B21R2.6385 O=C(COc1ccc(cc1)CO)c2ccc(cc2O)O 34a_100000211755_100009814262 [1,1,0,0,0,0|1,0,1]=4 337 B21R2.6385 O=C(CSc1ccc(cc1)CO)c2ccc(cc2O)O 62a_100000690907_100009814262 [1,1,0,0,0,0|1,0,1]=4 338 B21R2.6385 O=C(CSc1ccc(cc1)CO)c2ccc(cc2O)O 62a_100009814262_100000690907 [1,1,0,0,0,0|1,0,1]=4 339 B21R2.19474 O=C(CCc1ccc(cc1)O)c2ccc(c(c2O)O)O 1458a_100000037941_100009816426 [1,1,0,0,0,0|0,0,2]=4 340 B21R2.97296 CN(CC(=O)c1ccc(cc1O)O)c2ccc(cc2)O 269982a_100000182112_100009814262 [1,1,0,0,0,0|1,0,1]=4 341 B21R2.97296 CN(CC(=O)c1ccc(cc1O)O)c2ccc(cc2)O 34a_100000182112_100009814262 [1,1,0,0,0,0|1,0,1]=4 342 B21R2.97296 Cc1cc(ccc1C(=O)CC(=O)c2ccc(cc2)O)O 1458a_100000692822_100009814261 [1,1,0,0,0,0|1,0,1]=4 343 B21R2.97296 Cc1ccc(c(c1)O)C(=O)CC(=O)c2ccc(cc2)O 1458a_100000212137_100009814261 [1,1,0,0,0,0|1,0,1]=4 344 B21R2.97296 Cc1ccc(cc1)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000188618_100009814262 [1,1,0,0,0,0|1,0,1]=4 345 B21R2.97296 Cc1ccc(cc1)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000212172_100000211441 [1,1,0,0,0,0|1,0,1]=4 346 B21R2.97296 O=C(CC(=O)c1ccc(cc1Br)O)c2ccc(cc2)O 1458a_100012344906_100009814261 [1,1,0,0,0,0|1,0,1]=4 347 B21R2.97296 O=C(CC(=O)c1ccc(cc1Cl)O)c2ccc(cc2)O 1458a_100000702456_100009814261 [1,1,0,0,0,0|1,0,1]=4 348 B21R2.97296 O=C(CC(=O)c1ccc(cc1F)O)c2ccc(cc2)O 1458a_100000689029_100009814261 [1,1,0,0,0,0|1,0,1]=4 349 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)Br)c2ccc(cc2)O 1458a_100000744433_100009814261 [1,1,0,0,0,0|1,0,1]=4 350 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)Cl)c2ccc(cc2)O 1458a_100000188622_100009814261 [1,1,0,0,0,0|1,0,1]=4 351 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)F)c2ccc(cc2)O 1458a_100000212099_100009817053 [1,1,0,0,0,0|1,0,1]=4 352 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)F)c2ccc(cc2)O 1458a_100000746061_100009814261 [1,1,0,0,0,0|1,0,1]=4 353 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)I)c2ccc(cc2)O 1458a_100000091984_100009814261 [1,1,0,0,0,0|1,0,1]=4 354 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)O)c2ccc(cc2)Br 1458a_100000185839_100009814262 [1,1,0,0,0,0|1,0,1]=4 355 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)O)c2ccc(cc2)Br 1458a_100000212172_100000188085 [1,1,0,0,0,0|1,0,1]=4 356 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)O)c2ccc(cc2)Cl 1458a_100000210187_100009814262 [1,1,0,0,0,0|1,0,1]=4 357 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)O)c2ccc(cc2)Cl 1458a_100000212172_100000211071 [1,1,0,0,0,0|1,0,1]=4 358 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)O)c2ccc(cc2)F 1458a_100000187176_100009814262 [1,1,0,0,0,0|1,0,1]=4 359 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)O)c2ccc(cc2)F 1458a_100000212172_100000211279 [1,1,0,0,0,0|1,0,1]=4 360 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)O)c2ccc(cc2)I 1458a_100000187904_100009814262 [1,1,0,0,0,0|1,0,1]=4 361 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)O)c2ccc(cc2)I 1458a_100000212172_100011216261 [1,1,0,0,0,0|1,0,1]=4 362 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)O)c2ccc(cc2)O 1458a_100000212099_100009814262 [1,1,0,0,0,0|0,0,1]=3 363 B21R2.97296 O=C(CC(=O)c1ccc(cc1O)O)c2ccc(cc2)O 1458a_100000212172_100009814261 [1,1,0,0,0,0|0,0,1]=3 364 B21R2.108767 Cc1cc(ccc1NCC(=O)c2ccc(cc2O)O)O 34a_100000756630_100009814262 [1,1,0,0,0,0|1,0,1]=4 365 B21R2.108767 Cc1cc(ccc1SCC(=O)c2ccc(cc2O)O)O 62a_100009814262_100000690111 [1,1,0,0,0,0|1,0,1]=4 366 B21R2.108767 Nc1cc(ccc1SCC(=O)c2ccc(cc2O)O)O 62a_100009814262_100011999798 [1,1,0,0,0,0|1,0,1]=4 367 B21R2.108767 Nc1cc(ccc1SCC(=O)c2ccc(cc2O)O)O 62a_100011999798_100009814262 [1,1,0,0,0,0|1,0,1]=4 368 B21R2.108767 O=C(CNc1ccc(cc1Br)O)c2ccc(cc2O)O 34a_100012001276_100009814262 [1,1,0,0,0,0|1,0,1]=4 369 B21R2.108767 O=C(CNc1ccc(cc1Cl)O)c2ccc(cc2O)O 34a_100011215599_100009814262 [1,1,0,0,0,0|1,0,1]=4 370 B21R2.108767 O=C(CNc1ccc(cc1F)O)c2ccc(cc2O)O 34a_100000759473_100009814262 [1,1,0,0,0,0|1,0,1]=4 371 B21R2.108767 O=C(CNc1ccc(cc1I)O)c2ccc(cc2O)O 34a_100010084370_100009814262 [1,1,0,0,0,0|1,0,1]=4 372 B21R2.108767 O=C(CNc1ccc(cc1O)O)c2ccc(cc2O)O 34a_100000106777_100009814262 [1,1,0,0,0,0|1,0,1]=4 373 B21R2.108767 O=C(CSc1ccc(cc1Br)O)c2ccc(cc2O)O 62a_100000701344_100009814262 [1,1,0,0,0,0|1,0,1]=4 374 B21R2.108767 O=C(CSc1ccc(cc1Br)O)c2ccc(cc2O)O 62a_100009814262_100000701344 [1,1,0,0,0,0|1,0,1]=4 375 B21R2.108767 O=C(CSc1ccc(cc1Cl)O)c2ccc(cc2O)O 62a_100000047559_100009814262 [1,1,0,0,0,0|1,0,1]=4 376 B21R2.108767 O=C(CSc1ccc(cc1Cl)O)c2ccc(cc2O)O 62a_100009814262_100000047559 [1,1,0,0,0,0|1,0,1]=4 377 B21R2.108767 O=C(CSc1ccc(cc1F)O)c2ccc(cc2O)O 62a_100000755031_100009814262 [1,1,0,0,0,0|1,0,1]=4 378 B21R2.108767 O=C(CSc1ccc(cc1F)O)c2ccc(cc2O)O 62a_100009814262_100000755031 [1,1,0,0,0,0|1,0,1]=4 379 B21R2.108767 O=C(CSc1ccc(cc1O)O)c2ccc(cc2O)O 62a_100009814262_100009813921 [1,1,0,0,0,0|1,0,1]=4 380 B21R2.784816 O=C(CCc1ccc(cc1)O)c2cc(c(cc2O)O)Br 1458a_100009813906_100009816426 [1,1,0,0,0,0|0,0,2]=4 381 B21R2.784816 O=C(NCc1ccc(cc1)O)c2cc(c(cc2O)O)Br 527a_100000185549_100009813906 [1,1,0,0,0,0|1,0,1]=4 382 B21R2.4619134 Cc1cc(ccc1O)NCC(=O)c2ccc(cc2O)O 34a_100011218179_100009814262 [1,1,0,0,0,0|1,0,1]=4 383 B21R2.4619134 Cc1cc(ccc1O)NCC(=O)c2ccc(cc2O)O 7a_100011218179_100009814262 [1,1,0,0,0,0|1,0,1]=4 384 B21R2.4619134 Cc1cc(ccc1O)SCC(=O)c2ccc(cc2O)O 62a_100009814262_100000186361 [1,1,0,0,0,0|1,0,1]=4 385 B21R2.4619134 Nc1cc(ccc1O)SCC(=O)c2ccc(cc2O)O 62a_100000752626_100009814262 [1,1,0,0,0,0|1,0,1]=4 386 B21R2.4619134 Nc1cc(ccc1O)SCC(=O)c2ccc(cc2O)O 62a_100009814262_100000752626 [1,1,0,0,0,0|1,0,1]=4 387 B21R2.4619134 O=C(CCc1ccc(c(c1)O)O)c2ccc(cc2O)O 1458a_100000212172_200010393615 [1,1,0,0,0,0|0,0,2]=4 388 B21R2.4619134 O=C(CNc1ccc(c(c1)Br)O)c2ccc(cc2O)O 34a_100011534360_100009814262 [1,1,0,0,0,0|1,0,1]=4 389 B21R2.4619134 O=C(CNc1ccc(c(c1)Cl)O)c2ccc(cc2O)O 34a_100000744943_100009814262 [1,1,0,0,0,0|1,0,1]=4 390 B21R2.4619134 O=C(CNc1ccc(c(c1)F)O)c2ccc(cc2O)O 34a_100011220035_100009814262 [1,1,0,0,0,0|1,0,1]=4 391 B21R2.4619134 O=C(CNc1ccc(c(c1)F)O)c2ccc(cc2O)O 7a_100011220035_100009814262 [1,1,0,0,0,0|1,0,1]=4 392 B21R2.4619134 O=C(CNc1ccc(c(c1)O)O)c2ccc(cc2O)O 34a_100102946323_100009814262 [1,1,0,0,0,0|1,0,1]=4 393 B21R2.4619134 O=C(CSc1ccc(c(c1)Br)O)c2ccc(cc2O)O 62a_100009814262_100012361655 [1,1,0,0,0,0|1,0,1]=4 394 B21R2.4619134 O=C(CSc1ccc(c(c1)Br)O)c2ccc(cc2O)O 62a_100012361655_100009814262 [1,1,0,0,0,0|1,0,1]=4 395 B21R2.4619134 O=C(CSc1ccc(c(c1)Cl)O)c2ccc(cc2O)O 62a_100009814262_100012360047 [1,1,0,0,0,0|1,0,1]=4 396 B21R2.4619134 O=C(CSc1ccc(c(c1)Cl)O)c2ccc(cc2O)O 62a_100012360047_100009814262 [1,1,0,0,0,0|1,0,1]=4 397 B21R2.4619134 O=C(CSc1ccc(c(c1)F)O)c2ccc(cc2O)O 62a_100000185481_100009814262 [1,1,0,0,0,0|1,0,1]=4 398 B21R2.4619134 O=C(CSc1ccc(c(c1)F)O)c2ccc(cc2O)O 62a_100009814262_100000185481 [1,1,0,0,0,0|1,0,1]=4 399 B21R2.4619134 O=C(CSc1ccc(c(c1)O)O)c2ccc(cc2O)O 62a_100009814262_100009813601 [1,1,0,0,0,0|1,0,1]=4 400 B21R2.29924 C[C@@H](NC(=O)c1c(cc(cc1O)O)O)c2ccccc2 527a_100000751104_100000040092 [1,1,0,0,0,0|1,0,1]=4 401 B21R2.29924 Cc1cc(c(c(c1)O)C(=O)CC(=O)c2ccccc2)O 1458a_100000036929_100000211460 [1,1,0,0,0,0|1,0,1]=4 402 B21R2.29924 Cc1cc(cc(c1C(=O)CC(=O)c2ccccc2)O)O 1458a_200000061528_100000211460 [1,1,0,0,0,0|1,0,1]=4 403 B21R2.29930 CN(Cc1ccccc1)C(=O)c2c(cc(cc2O)O)O 527a_100000186898_100000040092 [1,1,0,0,0,0|1,0,1]=4 404 B21R2.3275295 Cc1ccccc1CNC(=O)c2c(cc(cc2O)O)O 527a_100000174972_100000040092 [1,1,0,0,0,0|1,0,1]=4 405 B21R2.3275295 O=C(NCc1ccccc1Br)c2c(cc(cc2O)O)O 527a_100000689332_100000040092 [1,1,0,0,0,0|1,0,1]=4 406 B21R2.3275295 O=C(NCc1ccccc1Cl)c2c(cc(cc2O)O)O 527a_100000174879_100000040092 [1,1,0,0,0,0|1,0,1]=4 407 B21R2.3275295 O=C(NCc1ccccc1F)c2c(cc(cc2O)O)O 527a_100000174869_100000040092 [1,1,0,0,0,0|1,0,1]=4 408 B21R2.3275295 O=C(NCc1ccccc1I)c2c(cc(cc2O)O)O 527a_100015347259_100000040092 [1,1,0,0,0,0|1,0,1]=4 409 B21R2.3275295 O=C(NCc1ccccc1O)c2c(cc(cc2O)O)O 527a_100000185550_100000040092 [1,1,0,0,0,0|1,0,1]=4 410 B21R2.4586690 Cc1cccc(c1)CNC(=O)c2c(cc(cc2O)O)O 527a_100000185548_100000040092 [1,1,0,0,0,0|1,0,1]=4 411 B21R2.4586690 O=C(NCc1cccc(c1)Br)c2c(cc(cc2O)O)O 527a_100000174977_100000040092 [1,1,0,0,0,0|1,0,1]=4 412 B21R2.4586690 O=C(NCc1cccc(c1)Cl)c2c(cc(cc2O)O)O 527a_100000174878_100000040092 [1,1,0,0,0,0|1,0,1]=4 413 B21R2.4586690 O=C(NCc1cccc(c1)F)c2c(cc(cc2O)O)O 527a_100000174948_100000040092 [1,1,0,0,0,0|1,0,1]=4 414 B21R2.4586690 O=C(NCc1cccc(c1)I)c2c(cc(cc2O)O)O 527a_100000106179_100000040092 [1,1,0,0,0,0|1,0,1]=4 415 B21R2.4586690 O=C(NCc1cccc(c1)O)c2c(cc(cc2O)O)O 527a_100000743036_100000040092 [1,1,0,0,0,0|1,0,1]=4 416 B21R2.126982 COc1ccc(cc1)CCC(=O)c2c(cccc2O)O 1458a_100000755285_100000184700 [1,1,0,0,0,0|0,0,2]=4 417 B21R2.126982 COc1ccc(cc1)CNC(=O)c2c(cccc2O)O 527a_100000185587_100000755285 [1,1,0,0,0,0|1,0,1]=4 418 B21R2.126982 O=C(NCc1ccc(cc1)CO)c2c(cccc2O)O 527a_100015189231_100000755285 [1,1,0,0,0,0|1,0,1]=4 419 B21R2.362230 O=C(CCc1ccc(cc1)O)c2c(ccc(c2O)Br)O 1458a_100010008628_100009816426 [1,1,0,0,0,0|0,0,2]=4 420 B21R2.362230 O=C(CCc1ccc(cc1)O)c2c(ccc(c2O)Cl)O 1458a_100000080727_100009816426 [1,1,0,0,0,0|0,0,2]=4 421 B21R2.362230 O=C(NCc1ccc(cc1)O)c2c(ccc(c2O)Br)O 240690a_100000185549_100010008628 [1,1,0,0,0,0|1,0,1]=4 422 B21R2.362230 O=C(NCc1ccc(cc1)O)c2c(ccc(c2O)Br)O 527a_100000185549_100010008628 [1,1,0,0,0,0|1,0,1]=4 423 B21R2.362230 O=C(NCc1ccc(cc1)O)c2c(ccc(c2O)Cl)O 240690a_100000185549_100000080727 [1,1,0,0,0,0|1,0,1]=4 424 B21R2.362230 O=C(NCc1ccc(cc1)O)c2c(ccc(c2O)Cl)O 527a_100000185549_100000080727 [1,1,0,0,0,0|1,0,1]=4 425 B21R2.459857 COc1cccc(c1C(=O)CCc2ccc(cc2)O)O 1458a_100000043310_100009816426 [1,1,0,0,0,0|0,0,2]=4 426 B21R2.459857 COc1cccc(c1C(=O)NCc2ccc(cc2)O)O 240690a_100000185549_100000043310 [1,1,0,0,0,0|1,0,1]=4 427 B21R2.796484 Cc1ccc(cc1)C(=O)CC(=O)c2c(cccc2O)O 1458a_100000755285_100000211441 [1,1,0,0,0,0|1,0,1]=4 428 B21R2.796484 Cc1cccc(c1C(=O)CC(=O)c2ccc(cc2)O)O 1458a_100011934116_100009814261 [1,1,0,0,0,0|1,0,1]=4 429 B21R2.796484 O=C(CC(=O)c1c(cccc1Br)O)c2ccc(cc2)O 1458a_100011935254_100009814261 [1,1,0,0,0,0|1,0,1]=4 430 B21R2.796484 O=C(CC(=O)c1c(cccc1Cl)O)c2ccc(cc2)O 1458a_100000745519_100009814261 [1,1,0,0,0,0|1,0,1]=4 431 B21R2.796484 O=C(CC(=O)c1c(cccc1F)O)c2ccc(cc2)O 1458a_100000763259_100009814261 [1,1,0,0,0,0|1,0,1]=4 432 B21R2.796484 O=C(CC(=O)c1c(cccc1O)O)c2ccc(cc2)Br 1458a_100000755285_100000188085 [1,1,0,0,0,0|1,0,1]=4 433 B21R2.796484 O=C(CC(=O)c1c(cccc1O)O)c2ccc(cc2)Cl 1458a_100000755285_100000211071 [1,1,0,0,0,0|1,0,1]=4 434 B21R2.796484 O=C(CC(=O)c1c(cccc1O)O)c2ccc(cc2)F 1458a_100000755285_100000211279 [1,1,0,0,0,0|1,0,1]=4 435 B21R2.796484 O=C(CC(=O)c1c(cccc1O)O)c2ccc(cc2)I 1458a_100000755285_100011216261 [1,1,0,0,0,0|1,0,1]=4 436 B21R2.796484 O=C(CC(=O)c1c(cccc1O)O)c2ccc(cc2)O 1458a_100000755285_100009814261 [1,1,0,0,0,0|0,0,1]=3 437 B21R2.3173452 CN(Cc1ccc(cc1)O)C(=O)c2c(cccc2O)O 527a_100000207500_100000755285 [1,1,0,0,0,0|1,0,1]=4 438 B21R2.3284841 O=C(NCc1ccc(cc1Cl)O)c2c(cccc2O)O 527a_200161156549_100000755285 [1,1,0,0,0,0|1,0,1]=4 439 B21R2.3544594 O=C(CCc1ccc(c(c1)O)O)c2c(cccc2O)O 1458a_100000755285_200010393615 [1,1,0,0,0,0|0,0,2]=4 440 B21R2.3544594 O=C(NCc1ccc(c(c1)F)O)c2c(cccc2O)O 527a_100000758358_100000755285 [1,1,0,0,0,0|1,0,1]=4 441 B21R2.125637 COc1ccc(cc1)NN=Cc2c(cc(cc2O)O)O 4a_100000005221_100000039965 [1,1,0,0,0,0|2,0,0]=4 442 B21R2.784232 O=C(CSc1c(cc(cc1O)O)O)c2ccc(cc2)O 62a_100009814261_200010341185 [1,1,0,0,0,0|1,0,1]=4 443 B21R2.125542 C#Cc1ccc(cc1)NC(=O)c2c(cc(cc2O)O)O 527a_100011215031_100000040092 [0,1,0,0,1,0|2,0,0]=4 444 B21R2.125542 C=Cc1ccc(cc1)NC(=O)c2c(cc(cc2O)O)O 527a_100011218248_100000040092 [0,1,0,0,1,0|2,0,0]=4 445 B21R2.125542 CCc1ccc(cc1)NC(=O)c2c(cc(cc2O)O)O 527a_100000211069_100000040092 [0,1,0,0,1,0|2,0,0]=4 446 B21R2.125542 COc1ccc(cc1)NC(=O)c2c(cc(cc2O)C)O 527a_100000184247_100000036929 [0,1,0,0,1,0|2,0,0]=4 447 B21R2.125542 COc1ccc(cc1)NC(=O)c2c(cc(cc2O)O)O 527a_100000184247_100000040092 [0,1,0,0,1,0|1,0,0]=3 448 B21R2.125542 CSc1ccc(cc1)NC(=O)c2c(cc(cc2O)O)O 527a_100000212337_100000040092 [0,1,0,0,1,0|1,1,0]=4 449 B21R2.125542 Cc1cc(c(c(c1)O)C(=O)Cc2ccc(cc2)CO)O 1458a_100000036929_100000067286 [0,1,0,0,1,0|1,0,1]=4 450 B21R2.125542 Cc1cc(cc(c1C(=O)Cc2ccc(cc2)CO)O)O 1458a_200000061528_100000067286 [0,1,0,0,1,0|1,0,1]=4 451 B21R2.361242 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(c(c2)Br)O)O 527a_100011534360_100000036929 [0,1,0,0,1,0|2,0,0]=4 452 B21R2.361242 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(c(c2)C)O)O 527a_100011218179_100000036929 [0,1,0,0,1,0|2,0,0]=4 453 B21R2.361242 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(c(c2)F)O)O 527a_100011220035_100000036929 [0,1,0,0,1,0|2,0,0]=4 454 B21R2.361242 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(c(c2)O)O)O 527a_100102946323_100000036929 [0,1,0,0,1,0|2,0,0]=4 455 B21R2.361242 Cc1cc(ccc1Br)NC(=O)c2c(cc(cc2O)O)O 527a_100000210723_100000040092 [0,1,0,0,1,0|2,0,0]=4 456 B21R2.361242 Cc1cc(ccc1Cl)NC(=O)c2c(cc(cc2O)O)O 527a_100000187808_100000040092 [0,1,0,0,1,0|2,0,0]=4 457 B21R2.361242 Cc1cc(ccc1F)NC(=O)c2c(cc(cc2O)O)O 527a_100000750164_100000040092 [0,1,0,0,1,0|2,0,0]=4 458 B21R2.361242 Cc1cc(ccc1I)NC(=O)c2c(cc(cc2O)O)O 527a_100000198070_100000040092 [0,1,0,0,1,0|2,0,0]=4 459 B21R2.361242 Cc1cc(ccc1O)NC(=O)c2c(cc(cc2O)O)O 527a_100011218179_100000040092 [0,1,0,0,1,0|1,0,0]=3 460 B21R2.361242 Cc1ccc(cc1Br)NC(=O)c2c(cc(cc2O)O)O 527a_100000736455_100000040092 [0,1,0,0,1,0|2,0,0]=4 461 B21R2.361242 Cc1ccc(cc1C)NC(=O)c2c(cc(cc2O)O)O 527a_100000724040_100000040092 [0,1,0,0,1,0|2,0,0]=4 462 B21R2.361242 Cc1ccc(cc1Cl)NC(=O)c2c(cc(cc2O)O)O 527a_100000188892_100000040092 [0,1,0,0,1,0|2,0,0]=4 463 B21R2.361242 Cc1ccc(cc1F)NC(=O)c2c(cc(cc2O)O)O 527a_100000210958_100000040092 [0,1,0,0,1,0|2,0,0]=4 464 B21R2.361242 Cc1ccc(cc1I)NC(=O)c2c(cc(cc2O)O)O 527a_100000184131_100000040092 [0,1,0,0,1,0|2,0,0]=4 465 B21R2.361242 Cc1ccc(cc1O)NC(=O)c2c(cc(cc2O)O)O 527a_100000759471_100000040092 [0,1,0,0,1,0|2,0,0]=4 466 B21R2.361242 O=C(Nc1ccc(c(c1)Br)Br)c2c(cc(cc2O)O)O 527a_100011306057_100000040092 [0,1,0,0,1,0|2,0,0]=4 467 B21R2.361242 O=C(Nc1ccc(c(c1)Br)Cl)c2c(cc(cc2O)O)O 527a_100000686031_100000040092 [0,1,0,0,1,0|2,0,0]=4 468 B21R2.361242 O=C(Nc1ccc(c(c1)Br)F)c2c(cc(cc2O)O)O 527a_100000760356_100000040092 [0,1,0,0,1,0|2,0,0]=4 469 B21R2.361242 O=C(Nc1ccc(c(c1)Br)I)c2c(cc(cc2O)O)O 527a_100000750458_100000040092 [0,1,0,0,1,0|2,0,0]=4 470 B21R2.361242 O=C(Nc1ccc(c(c1)Br)O)c2c(cc(cc2O)O)O 527a_100011534360_100000040092 [0,1,0,0,1,0|1,0,0]=3 471 B21R2.361242 O=C(Nc1ccc(c(c1)Cl)Br)c2c(cc(cc2O)O)O 527a_100000687081_100000040092 [0,1,0,0,1,0|2,0,0]=4 472 B21R2.361242 O=C(Nc1ccc(c(c1)Cl)Cl)c2c(cc(cc2O)O)O 527a_100000184108_100000040092 [0,1,0,0,1,0|2,0,0]=4 473 B21R2.361242 O=C(Nc1ccc(c(c1)Cl)F)c2c(cc(cc2O)O)O 527a_100000211060_100000040092 [0,1,0,0,1,0|2,0,0]=4 474 B21R2.361242 O=C(Nc1ccc(c(c1)F)Br)c2c(cc(cc2O)O)O 527a_100000759894_100000040092 [0,1,0,0,1,0|2,0,0]=4 475 B21R2.361242 O=C(Nc1ccc(c(c1)F)O)c2c(cc(cc2O)O)O 527a_100011220035_100000040092 [0,1,0,0,1,0|1,0,0]=3 476 B21R2.361242 O=C(Nc1ccc(c(c1)I)Br)c2c(cc(cc2O)O)O 527a_100000750459_100000040092 [0,1,0,0,1,0|2,0,0]=4 477 B21R2.361242 O=C(Nc1ccc(c(c1)I)Cl)c2c(cc(cc2O)O)O 527a_100012360549_100000040092 [0,1,0,0,1,0|2,0,0]=4 478 B21R2.361242 O=C(Nc1ccc(c(c1)I)F)c2c(cc(cc2O)O)O 527a_114828291077_100000040092 [0,1,0,0,1,0|2,0,0]=4 479 B21R2.361242 O=C(Nc1ccc(c(c1)O)F)c2c(cc(cc2O)O)O 527a_100012017398_100000040092 [0,1,0,0,1,0|2,0,0]=4 480 B21R2.361242 O=C(Nc1ccc(c(c1)O)O)c2c(cc(cc2O)O)O 527a_100102946323_100000040092 [0,1,0,0,1,0|1,0,0]=3 481 B21R2.361378 CN(C(=O)c1c(cc(cc1O)O)O)c2ccc(cc2)O 527a_100000182112_100000040092 [0,1,0,0,1,0|1,0,0]=3 482 B21R2.361378 Cc1cc(c(c(c1)O)C(=O)N(C)c2ccc(cc2)O)O 527a_100000182112_100000036929 [0,1,0,0,1,0|2,0,0]=4 483 B21R2.4623548 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(cc2Br)O)O 527a_100012001276_100000036929 [0,1,0,0,1,0|2,0,0]=4 484 B21R2.4623548 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(cc2C)O)O 527a_100000756630_100000036929 [0,1,0,0,1,0|2,0,0]=4 485 B21R2.4623548 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(cc2Cl)O)O 527a_100011215599_100000036929 [0,1,0,0,1,0|2,0,0]=4 486 B21R2.4623548 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(cc2F)O)O 527a_100000759473_100000036929 [0,1,0,0,1,0|2,0,0]=4 487 B21R2.4623548 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(cc2I)O)O 527a_100010084370_100000036929 [0,1,0,0,1,0|2,0,0]=4 488 B21R2.4623548 Cc1cc(c(c(c1)O)C(=O)Nc2ccc(cc2O)O)O 527a_100000106777_100000036929 [0,1,0,0,1,0|2,0,0]=4 489 B21R2.4623548 Cc1cc(ccc1NC(=O)c2c(cc(cc2O)O)O)F 527a_100000211637_100000040092 [0,1,0,0,1,0|2,0,0]=4 490 B21R2.4623548 Cc1cc(ccc1NC(=O)c2c(cc(cc2O)O)O)O 527a_100000756630_100000040092 [0,1,0,0,1,0|1,0,0]=3 491 B21R2.4623548 Cc1ccc(c(c1)C)NC(=O)c2c(cc(cc2O)O)O 527a_100000736561_100000040092 [0,1,0,0,1,0|2,0,0]=4 492 B21R2.4623548 Cc1ccc(c(c1)F)NC(=O)c2c(cc(cc2O)O)O 527a_100000211023_100000040092 [0,1,0,0,1,0|2,0,0]=4 493 B21R2.4623548 Cc1ccc(c(c1)O)NC(=O)c2c(cc(cc2O)O)O 527a_100000211527_100000040092 [0,1,0,0,1,0|2,0,0]=4 494 B21R2.4623548 O=C(Nc1ccc(cc1Br)O)c2c(cc(cc2O)O)O 527a_100012001276_100000040092 [0,1,0,0,1,0|1,0,0]=3 495 B21R2.4623548 O=C(Nc1ccc(cc1Cl)O)c2c(cc(cc2O)O)O 527a_100011215599_100000040092 [0,1,0,0,1,0|1,0,0]=3 496 B21R2.4623548 O=C(Nc1ccc(cc1F)O)c2c(cc(cc2O)O)O 527a_100000759473_100000040092 [0,1,0,0,1,0|1,0,0]=3 497 B21R2.4623548 O=C(Nc1ccc(cc1I)O)c2c(cc(cc2O)O)O 527a_100010084370_100000040092 [0,1,0,0,1,0|1,0,0]=3 498 B21R2.4623548 O=C(Nc1ccc(cc1O)Br)c2c(cc(cc2O)O)O 527a_100000739049_100000040092 [0,1,0,0,1,0|2,0,0]=4 499 B21R2.4623548 O=C(Nc1ccc(cc1O)Cl)c2c(cc(cc2O)O)O 527a_100000185728_100000040092 [0,1,0,0,1,0|2,0,0]=4 500 B21R2.4623548 O=C(Nc1ccc(cc1O)F)c2c(cc(cc2O)O)O 527a_100000753323_100000040092 [0,1,0,0,1,0|2,0,0]=4 501 B21R2.4623548 O=C(Nc1ccc(cc1O)I)c2c(cc(cc2O)O)O 527a_100000057187_100000040092 [0,1,0,0,1,0|2,0,0]=4 502 B21R2.4623548 O=C(Nc1ccc(cc1O)O)c2c(cc(cc2O)O)O 527a_100000106777_100000040092 [0,1,0,0,1,0|1,0,0]=3 503 B23R2.236948 COc1ccc(cc1)CCNC(=O)c2c(cc(cc2O)O)O 527a_100000210796_100000040092 [0,1,0,0,0,1|0,0,2]=4 504 B23R2.11785464 CC(CNC(=O)c1c(cc(cc1O)O)O)c2ccc(cc2)O 527a_200015188644_100000040092 [0,1,0,0,0,1|0,0,2]=4 505 B23R2.11813968 O=C(NCCc1ccc(c(c1)O)O)c2c(cc(cc2O)O)O 527a_100000210387_100000040092 [0,1,0,0,0,1|0,0,2]=4 506 B23R2.11853957 CC(Cc1ccc(cc1)O)NC(=O)c2c(cc(cc2O)O)O 527a_100102634573_100000040092 [0,1,0,0,0,1|0,0,2]=4 507 B23R2.11853957 Cc1cc(c(c(c1)O)C(=O)CC(=O)Nc2ccc(cc2)O)O 1458a_100000036929_100000233757 [0,1,0,0,0,1|1,0,1]=4 508 B23R2.11853957 Cc1cc(cc(c1C(=O)CC(=O)Nc2ccc(cc2)O)O)O 1458a_200000061528_100000233757 [0,1,0,0,0,1|1,0,1]=4 509 B23R2.14274 COc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)O)C)Br 22a_100000741850_100016269017 [0,1,0,0,0,1|2,0,0]=4 510 B23R2.14274 COc1cc(cc(c1NC(=O)C=Cc2ccc(cc2)O)Cl)Cl 22a_100009955935_100016269017 [0,1,0,0,0,1|2,0,0]=4 511 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2Br)Cl)O 527a_100015696055_100000184205 [0,1,0,0,0,1|2,0,0]=4 512 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2Br)O)Br 527a_200010887395_100000184205 [0,1,0,0,0,1|2,0,0]=4 513 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2C)O)C 22a_100011934200_100000184205 [0,1,0,0,0,1|2,0,0]=4 514 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2C)O)C 527a_100011934200_100000184205 [0,1,0,0,0,1|2,0,0]=4 515 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2Cl)C)O 22a_100015906060_100000184205 [0,1,0,0,0,1|2,0,0]=4 516 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2Cl)C)O 527a_100015906060_100000184205 [0,1,0,0,0,1|2,0,0]=4 517 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2F)Br)O 22a_100015475841_100000184205 [0,1,0,0,0,1|2,0,0]=4 518 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2F)Br)O 527a_100015475841_100000184205 [0,1,0,0,0,1|2,0,0]=4 519 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2F)Cl)O 22a_100010883250_100000184205 [0,1,0,0,0,1|2,0,0]=4 520 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2F)Cl)O 527a_100010883250_100000184205 [0,1,0,0,0,1|2,0,0]=4 521 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2F)F)O 22a_100011217947_100000184205 [0,1,0,0,0,1|2,0,0]=4 522 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2F)F)O 527a_100011217947_100000184205 [0,1,0,0,0,1|2,0,0]=4 523 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2F)O)F 1626a_100000036573_100000184205 [0,1,0,0,0,1|2,0,0]=4 524 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2F)O)F 527a_100000036573_100000184205 [0,1,0,0,0,1|2,0,0]=4 525 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2O)Br)C 22a_100010371313_100000184205 [0,1,0,0,0,1|2,0,0]=4 526 B23R2.237953 COc1ccc(cc1)C=CC(=O)Nc2c(cc(cc2O)Br)C 527a_100010371313_100000184205 [0,1,0,0,0,1|2,0,0]=4 527 B23R2.590560 COc1cc(c(c(c1)C)NC(=O)C=Cc2ccc(cc2)O)C 22a_100009848961_100016269017 [0,1,0,0,0,1|2,0,0]=4 528 B23R2.590560 COc1cc(c(c(c1)Cl)NC(=O)C=Cc2ccc(cc2)O)Cl 22a_100000074854_100016269017 [0,1,0,0,0,1|2,0,0]=4 529 B23R2.590560 COc1cc(c(c(c1)F)NC(=O)C=Cc2ccc(cc2)O)F 22a_100011383474_100016269017 [0,1,0,0,0,1|2,0,0]=4 530 B23R2.11814323 Cc1cc(c(c(c1)Cl)NC(=O)C=Cc2ccc(c(c2)Br)O)O 22a_100015906060_200103079279 [0,1,0,0,0,1|2,0,0]=4 531 B23R2.11814323 Cc1cc(c(c(c1)Cl)NC(=O)C=Cc2ccc(c(c2)Cl)O)O 22a_100015906060_200103117615 [0,1,0,0,0,1|2,0,0]=4 532 B23R2.11814323 Cc1cc(c(c(c1)Cl)NC(=O)C=Cc2ccc(c(c2)O)O)O 22a_100015906060_100011195073 [0,1,0,0,0,1|2,0,0]=4 533 B23R2.11814323 Cc1cc(cc(c1NC(=O)C=Cc2ccc(c(c2)Br)O)C)O 22a_100011934200_200103079279 [0,1,0,0,0,1|2,0,0]=4 534 B23R2.11814323 Cc1cc(cc(c1NC(=O)C=Cc2ccc(c(c2)Br)O)O)Br 22a_100010371313_200103079279 [0,1,0,0,0,1|2,0,0]=4 535 B23R2.11814323 Cc1cc(cc(c1NC(=O)C=Cc2ccc(c(c2)Cl)O)C)O 22a_100011934200_200103117615 [0,1,0,0,0,1|2,0,0]=4 536 B23R2.11814323 Cc1cc(cc(c1NC(=O)C=Cc2ccc(c(c2)Cl)O)O)Br 22a_100010371313_200103117615 [0,1,0,0,0,1|2,0,0]=4 537 B23R2.11814323 Cc1cc(cc(c1NC(=O)C=Cc2ccc(c(c2)O)O)C)O 22a_100011934200_100011195073 [0,1,0,0,0,1|2,0,0]=4 538 B23R2.11814323 Cc1cc(cc(c1NC(=O)C=Cc2ccc(c(c2)O)O)O)Br 22a_100010371313_100011195073 [0,1,0,0,0,1|2,0,0]=4 539 B23R2.11814323 O=C(C=Cc1ccc(c(c1)Br)O)Nc2c(cc(cc2F)Br)O 22a_100015475841_200103079279 [0,1,0,0,0,1|2,0,0]=4 540 B23R2.11814323 O=C(C=Cc1ccc(c(c1)Br)O)Nc2c(cc(cc2F)Cl)O 22a_100010883250_200103079279 [0,1,0,0,0,1|2,0,0]=4 541 B23R2.11814323 O=C(C=Cc1ccc(c(c1)Br)O)Nc2c(cc(cc2F)F)O 22a_100011217947_200103079279 [0,1,0,0,0,1|2,0,0]=4 542 B23R2.11814323 O=C(C=Cc1ccc(c(c1)Cl)O)Nc2c(cc(cc2F)Br)O 22a_100015475841_200103117615 [0,1,0,0,0,1|2,0,0]=4 543 B23R2.11814323 O=C(C=Cc1ccc(c(c1)Cl)O)Nc2c(cc(cc2F)Cl)O 22a_100010883250_200103117615 [0,1,0,0,0,1|2,0,0]=4 544 B23R2.11814323 O=C(C=Cc1ccc(c(c1)Cl)O)Nc2c(cc(cc2F)F)O 22a_100011217947_200103117615 [0,1,0,0,0,1|2,0,0]=4 545 B23R2.11814323 O=C(C=Cc1ccc(c(c1)O)O)Nc2c(cc(cc2F)Br)O 22a_100015475841_100011195073 [0,1,0,0,0,1|2,0,0]=4 546 B23R2.11814323 O=C(C=Cc1ccc(c(c1)O)O)Nc2c(cc(cc2F)Cl)O 22a_100010883250_100011195073 [0,1,0,0,0,1|2,0,0]=4 547 B23R2.11814323 O=C(C=Cc1ccc(c(c1)O)O)Nc2c(cc(cc2F)F)O 22a_100011217947_100011195073 [0,1,0,0,0,1|2,0,0]=4 548 B23R2.33283945 Cc1cc(c(c(c1)Cl)NC(=O)C=Cc2ccc(cc2C)O)O 22a_100015906060_200132309679 [0,1,0,0,0,1|2,0,0]=4 549 B23R2.33283945 Cc1cc(ccc1C=CC(=O)Nc2c(cc(cc2C)O)C)O 22a_100011934200_200132309679 [0,1,0,0,0,1|2,0,0]=4 550 B23R2.33283945 Cc1cc(ccc1C=CC(=O)Nc2c(cc(cc2F)Br)O)O 22a_100015475841_200132309679 [0,1,0,0,0,1|2,0,0]=4 551 B23R2.33283945 Cc1cc(ccc1C=CC(=O)Nc2c(cc(cc2F)Cl)O)O 22a_100010883250_200132309679 [0,1,0,0,0,1|2,0,0]=4 552 B23R2.33283945 Cc1cc(ccc1C=CC(=O)Nc2c(cc(cc2F)F)O)O 22a_100011217947_200132309679 [0,1,0,0,0,1|2,0,0]=4 553 B23R2.33283945 Cc1cc(ccc1C=CC(=O)Nc2c(cc(cc2O)Br)C)O 22a_100010371313_200132309679 [0,1,0,0,0,1|2,0,0]=4 554 B23R2.233480 COc1ccc(cc1)C(=O)CC(=O)c2c(cc(cc2O)C)O 1458a_100000036929_100000212054 [0,2,0,0,0,0|1,0,1]=4 555 B23R2.233480 COc1ccc(cc1)C(=O)CC(=O)c2c(cc(cc2O)O)C 1458a_200000061528_100000212054 [0,2,0,0,0,0|1,0,1]=4 556 B23R2.233480 COc1ccc(cc1)[C@@H](C)NC(=O)c2c(cc(cc2O)O)O 527a_100011830352_100000040092 [0,2,0,0,0,0|1,0,1]=4 557 B23R2.233799 COc1ccc(cc1)CN(C)C(=O)c2c(cc(cc2O)O)O 527a_100000184145_100000040092 [0,2,0,0,0,0|1,0,1]=4 558 B23R2.3017046 CC(O)c1ccc(cc1)CNC(=O)c2c(cc(cc2O)O)O 527a_200000048501_100000040092 [0,2,0,0,0,0|1,0,1]=4 559 B23R2.3937736 COc1ccc(c(c1)Cl)CNC(=O)c2c(cc(cc2O)O)O 527a_100138410423_100000040092 [0,2,0,0,0,0|1,0,1]=4 560 B23R2.3937736 COc1ccc(c(c1)F)CNC(=O)c2c(cc(cc2O)O)O 527a_100000687396_100000040092 [0,2,0,0,0,0|1,0,1]=4 561 B23R2.4973515 CCOc1ccc(cc1)CNC(=O)c2c(cc(cc2O)O)O 527a_100000185588_100000040092 [0,2,0,0,0,0|1,0,1]=4 562 B23R2.4973515 COCc1ccc(cc1)CNC(=O)c2c(cc(cc2O)O)O 527a_100000738208_100000040092 [0,2,0,0,0,0|1,0,1]=4 563 B23R2.22678440 COc1ccc(cc1Br)CNC(=O)c2c(cc(cc2O)O)O 527a_100159240714_100000040092 [0,2,0,0,0,0|1,0,1]=4 564 B23R2.22678440 COc1ccc(cc1C)CNC(=O)c2c(cc(cc2O)O)O 527a_100102679029_100000040092 [0,2,0,0,0,0|1,0,1]=4 565 B23R2.22678440 COc1ccc(cc1Cl)CNC(=O)c2c(cc(cc2O)O)O 527a_100000008799_100000040092 [0,2,0,0,0,0|1,0,1]=4 566 B23R2.22678440 COc1ccc(cc1F)CNC(=O)c2c(cc(cc2O)O)O 527a_100000737316_100000040092 [0,2,0,0,0,0|1,0,1]=4 567 B23R2.22678440 COc1ccc(cc1O)CNC(=O)c2c(cc(cc2O)O)O 527a_100000740000_100000040092 [0,2,0,0,0,0|1,0,1]=4 568 B23R2.4893818 Cc1cc(c(c(c1)O)C(=O)C(C)C(=O)c2ccc(cc2)O)O 1458a_100000036929_200010205864 [0,2,0,0,0,0|1,0,1]=4 569 B23R2.4893818 Cc1cc(cc(c1C(=O)C(C)C(=O)c2ccc(cc2)O)O)O 1458a_200000061528_200010205864 [0,2,0,0,0,0|1,0,1]=4 570 B23R2.8970276 CCC(NC(=O)c1c(cc(cc1O)O)O)c2ccc(cc2)O 527a_100015187210_100000040092 [0,2,0,0,0,0|1,0,1]=4 571 B23R2.11812770 Cc1cc(c(c(c1)O)C(=O)CC(=O)c2ccc(c(c2)Cl)O)O 1458a_100000036929_200010170092 [0,2,0,0,0,0|1,0,1]=4 572 B23R2.11812770 Cc1cc(c(c(c1)O)C(=O)CC(=O)c2ccc(c(c2)O)O)O 1458a_100000036929_100000183813 [0,2,0,0,0,0|1,0,1]=4 573 B23R2.11812770 Cc1cc(cc(c1C(=O)CC(=O)c2ccc(c(c2)Cl)O)O)O 1458a_200000061528_200010170092 [0,2,0,0,0,0|1,0,1]=4 574 B23R2.11812770 Cc1cc(cc(c1C(=O)CC(=O)c2ccc(c(c2)O)O)O)O 1458a_200000061528_100000183813 [0,2,0,0,0,0|1,0,1]=4 575 B23R2.56101412 Cc1cc(c(c(c1)O)C(=O)CC(=O)c2ccc(cc2O)O)O 1458a_100000036929_100009814262 [0,2,0,0,0,0|1,0,1]=4 576 B23R2.56101412 Cc1cc(cc(c1C(=O)CC(=O)c2ccc(cc2O)O)O)O 1458a_200000061528_100009814262 [0,2,0,0,0,0|1,0,1]=4 577 B23R2.3384767 COc1cc(ccc1O)CNC(=O)c2c(cc(cc2O)O)O 527a_100000185554_100000040092 [0,2,0,0,0,0|1,0,1]=4 578 B21R2.2428674 O=C(O)/C=C/c1ccc(cc1)c2c(cc(cc2O)O)O 271570a_100010234720_200010341185 [0,0,1,1,0,0|2,0,0]=4 579 B21R2.4623339 Cc1ccc(cc1NC(=O)c2c(cc(cc2O)O)O)O 527a_100011216113_100000040092 [0,0,1,1,0,0|1,0,1]=4 580 B21R2.4623339 O=C(Nc1cc(ccc1Br)O)c2c(cc(cc2O)O)O 527a_100011999798_100000040092 [0,0,1,1,0,0|2,0,0]=4 581 B21R2.4623339 O=C(Nc1cc(ccc1Cl)O)c2c(cc(cc2O)O)O 527a_100011934297_100000040092 [0,0,1,1,0,0|2,0,0]=4 582 B21R2.4623339 O=C(Nc1cc(ccc1F)O)c2c(cc(cc2O)O)O 527a_100012017239_100000040092 [0,0,1,1,0,0|2,0,0]=4 583 B21R2.1786882 C=Cc1cccc(c1)NC(=O)c2c(cc(cc2O)O)O 527a_100011827668_100000040092 [0,0,1,1,0,0|2,0,0]=4 584 B21R2.4586006 Cc1c(cccc1NC(=O)c2c(cc(cc2O)O)O)O 527a_100011216573_100000040092 [0,0,1,1,0,0|1,0,1]=4 585 B21R3.7511976 Cc1cc(ccc1c2ccc3ccc(cc3c2)O)O 271570a_100000040639_100009816537 [1,0,0,1,0,0|2,0,0]=4 586 B21R3.7511976 Cc1cc(ccc1c2ccc3ccc(cc3n2)O)O 271570a_100000040639_100000079174 [1,0,0,1,0,0|2,0,0]=4 587 B21R3.7511976 Oc1ccc(c(c1)Cl)c2ccc3ccc(cc3c2)O 271570a_100000079644_100009816537 [1,0,0,1,0,0|2,0,0]=4 588 B21R3.7511976 Oc1ccc(c(c1)Cl)c2ccc3ccc(cc3n2)O 271570a_100000079644_100000079174 [1,0,0,1,0,0|2,0,0]=4 589 B21R3.7511976 Oc1ccc(c(c1)F)c2ccc3ccc(cc3c2)O 271570a_100009854227_100009816537 [1,0,0,1,0,0|2,0,0]=4 590 B21R3.7511976 Oc1ccc(c(c1)F)c2ccc3ccc(cc3n2)O 271570a_100009854227_100000079174 [1,0,0,1,0,0|2,0,0]=4 591 B21R3.7511976 Oc1ccc2ccc(cc2c1)c3ccc(cc3O)Cl 271570a_100010081499_100009816537 [1,0,0,1,0,0|2,0,0]=4 592 B21R3.7511976 Oc1ccc2ccc(cc2c1)c3ccc(cc3O)F 271570a_100010081493_100009816537 [1,0,0,1,0,0|2,0,0]=4 593 B21R3.7511976 Oc1ccc2ccc(nc2c1)c3ccc(cc3O)Cl 271570a_100010081499_100000079174 [1,0,0,1,0,0|2,0,0]=4 594 B21R3.7511976 Oc1ccc2ccc(nc2c1)c3ccc(cc3O)F 271570a_100010081493_100000079174 [1,0,0,1,0,0|2,0,0]=4 595 B21R3.46151 Oc1cc(c(c(c1)O)c2ccc3ccccc3c2)O 271570a_100011218693_200010341185 [1,0,0,1,0,0|1,0,0]=3 596 B21R3.46151 Oc1cc(c(c(c1)O)c2ccc3cccnc3c2)O 271570a_100012353946_200010341185 [1,0,0,1,0,0|2,0,0]=4 597 B21R3.46151 Oc1cc(c(c(c1)O)c2ccc3ccncc3c2)O 271570a_100000068421_200010341185 [1,0,0,1,0,0|2,0,0]=4 598 B21R3.46151 Oc1cc(c(c(c1)O)c2ccc3cnccc3c2)O 271570a_100000070448_200010341185 [1,0,0,1,0,0|2,0,0]=4 599 B21R3.46151 Oc1cc(c(c(c1)O)c2ccc3ncccc3c2)O 271570a_100012351079_200010341185 [1,0,0,1,0,0|2,0,0]=4 600 B21R3.46151 Oc1cc(c(c(c1)O)c2cnc3ccccc3c2)O 271570a_100012350238_200010341185 [1,0,0,1,0,0|2,0,0]=4 601 B21R3.106306547 Cc1ccc2cc([nH]c2c1)c3c(cc(cc3O)O)O 271570a_100010246276_200010341185 [0,0,0,1,1,0|2,0,0]=4 602 B21R3.106306547 Oc1cc(c(c(c1)O)c2cc3ccc(cc3[nH]2)Br)O 271570a_200010246288_200010341185 [0,0,0,1,1,0|2,0,0]=4 603 B21R3.106306547 Oc1cc(c(c(c1)O)c2cc3ccc(cc3s2)Br)O 271570a_100015653926_200010341185 [0,0,0,1,1,0|1,1,0]=4 604 B23R3.73373258 Nc1ccc2ccc(cc2c1)Sc3c(cc(cc3O)O)O 62a_100010090036_200010341185 [0,0,0,1,0,1|2,0,0]=4 605 B23R3.46769820 COc1ccc2ccc(cc2n1)c3c(cc(cc3O)O)O 271570a_100010382904_200010341185 [0,1,0,1,0,0|2,0,0]=4 606 B23R3.429819170 O=C(c1c(cc(cc1O)O)O)N2Cc3ccc(cc3C2)O 527a_100015195982_100000040092 [0,1,0,1,0,0|1,0,1]=4 607 B19R2.12255 Cc1ccc(c(c1)O)C(=O)Nc2ccc(cc2)O 22a_100000185829_100000212137 [1,0,0,0,1,0|2,0,0]=4 608 B19R2.12255 Cc1ccc(cc1)CC(=O)c2ccc(cc2O)O 1458a_100000212172_100000210814 [1,0,0,0,1,0|1,0,1]=4 609 B19R2.12255 Cc1ccc(cc1)NC(=O)c2ccc(cc2O)O 22a_100000124888_100000212172 [1,0,0,0,1,0|2,0,0]=4 610 B19R2.12255 O=C(Cc1ccc(cc1)Br)c2ccc(cc2O)O 1458a_100000212172_100000189115 [1,0,0,0,1,0|1,0,1]=4 611 B19R2.12255 O=C(Cc1ccc(cc1)Cl)c2ccc(cc2O)O 1458a_100000212172_100000694040 [1,0,0,0,1,0|1,0,1]=4 612 B19R2.12255 O=C(Cc1ccc(cc1)F)c2ccc(cc2O)O 1458a_100000212172_100000198546 [1,0,0,0,1,0|1,0,1]=4 613 B19R2.12255 O=C(Cc1ccc(cc1)I)c2ccc(cc2O)O 1458a_100000212172_100000189116 [1,0,0,0,1,0|1,0,1]=4 614 B19R2.12255 O=C(Cc1ccc(cc1)O)c2ccc(cc2O)O 271570a_203496583355_100015185591 [1,0,0,0,1,0|0,0,1]=3 615 B19R2.12255 O=C(Nc1ccc(cc1)Br)c2ccc(cc2O)O 22a_100000210018_100000212172 [1,0,0,0,1,0|2,0,0]=4 616 B19R2.12255 O=C(Nc1ccc(cc1)Cl)c2ccc(cc2O)O 22a_100000210052_100000212172 [1,0,0,0,1,0|2,0,0]=4 617 B19R2.12255 O=C(Nc1ccc(cc1)F)c2ccc(cc2O)O 22a_100000185862_100000212172 [1,0,0,0,1,0|2,0,0]=4 618 B19R2.12255 O=C(Nc1ccc(cc1)I)c2ccc(cc2O)O 22a_100000185761_100000212172 [1,0,0,0,1,0|2,0,0]=4 619 B19R2.12255 O=C(Nc1ccc(cc1)O)c2ccc(cc2Br)O 22a_100000185829_100012344906 [1,0,0,0,1,0|2,0,0]=4 620 B19R2.12255 O=C(Nc1ccc(cc1)O)c2ccc(cc2Cl)O 22a_100000185829_100000702456 [1,0,0,0,1,0|2,0,0]=4 621 B19R2.12255 O=C(Nc1ccc(cc1)O)c2ccc(cc2F)O 22a_100000185829_100000689029 [1,0,0,0,1,0|2,0,0]=4 622 B19R2.12255 O=C(Nc1ccc(cc1)O)c2ccc(cc2O)Br 22a_100000185829_100000744433 [1,0,0,0,1,0|2,0,0]=4 623 B19R2.12255 O=C(Nc1ccc(cc1)O)c2ccc(cc2O)Cl 22a_100000185829_100000188622 [1,0,0,0,1,0|2,0,0]=4 624 B19R2.12255 O=C(Nc1ccc(cc1)O)c2ccc(cc2O)F 22a_100000185829_100000746061 [1,0,0,0,1,0|2,0,0]=4 625 B19R2.12255 O=C(Nc1ccc(cc1)O)c2ccc(cc2O)I 22a_100000185829_100000091984 [1,0,0,0,1,0|2,0,0]=4 626 B19R2.12255 O=C(Nc1ccc(cc1)O)c2ccc(cc2O)O 22a_100000185829_100000212172 [1,0,0,0,1,0|1,0,0]=3 627 B19R2.60510 Cc1cc(c(c(c1)O)C(=O)Cc2ccccc2)O 1458a_100000036929_100015291786 [1,0,0,0,1,0|1,0,1]=4 628 B19R2.60510 Cc1cc(c(c(c1)O)C(=O)Nc2ccccc2)O 527a_100000106764_100000036929 [1,0,0,0,1,0|2,0,0]=4 629 B19R2.60510 Cc1cc(cc(c1C(=O)Cc2ccccc2)O)O 1458a_200000061528_100015291786 [1,0,0,0,1,0|1,0,1]=4 630 B19R2.60510 O=C(Nc1ccccc1)c2c(cc(cc2O)O)O 527a_100000106764_100000040092 [1,0,0,0,1,0|1,0,0]=3 631 B19R2.151817 Cc1ccc(cc1)CC(=O)c2c(cccc2O)O 1458a_100000755285_100000210814 [1,0,0,0,1,0|1,0,1]=4 632 B19R2.151817 Cc1ccc(cc1)NC(=O)c2c(cccc2O)O 527a_100000124888_100000755285 [1,0,0,0,1,0|2,0,0]=4 633 B19R2.151817 Cc1cccc(c1C(=O)Nc2ccc(cc2)O)O 22a_100000185829_100011934116 [1,0,0,0,1,0|2,0,0]=4 634 B19R2.151817 O=C(Cc1ccc(cc1)Br)c2c(cccc2O)O 1458a_100000755285_100000189115 [1,0,0,0,1,0|1,0,1]=4 635 B19R2.151817 O=C(Cc1ccc(cc1)Cl)c2c(cccc2O)O 1458a_100000755285_100000694040 [1,0,0,0,1,0|1,0,1]=4 636 B19R2.151817 O=C(Cc1ccc(cc1)F)c2c(cccc2O)O 1458a_100000755285_100000198546 [1,0,0,0,1,0|1,0,1]=4 637 B19R2.151817 O=C(Cc1ccc(cc1)I)c2c(cccc2O)O 1458a_100000755285_100000189116 [1,0,0,0,1,0|1,0,1]=4 638 B19R2.151817 O=C(Nc1ccc(cc1)Br)c2c(cccc2O)O 527a_100000210018_100000755285 [1,0,0,0,1,0|2,0,0]=4 639 B19R2.151817 O=C(Nc1ccc(cc1)Cl)c2c(cccc2O)O 527a_100000210052_100000755285 [1,0,0,0,1,0|2,0,0]=4 640 B19R2.151817 O=C(Nc1ccc(cc1)F)c2c(cccc2O)O 527a_100000185862_100000755285 [1,0,0,0,1,0|2,0,0]=4 641 B19R2.151817 O=C(Nc1ccc(cc1)I)c2c(cccc2O)O 527a_100000185761_100000755285 [1,0,0,0,1,0|2,0,0]=4 642 B19R2.151817 O=C(Nc1ccc(cc1)O)c2c(cccc2Br)O 22a_100000185829_100011935254 [1,0,0,0,1,0|2,0,0]=4 643 B19R2.151817 O=C(Nc1ccc(cc1)O)c2c(cccc2Cl)O 22a_100000185829_100000745519 [1,0,0,0,1,0|2,0,0]=4 644 B19R2.151817 O=C(Nc1ccc(cc1)O)c2c(cccc2F)O 22a_100000185829_100000763259 [1,0,0,0,1,0|2,0,0]=4 645 B19R2.151817 O=C(Nc1ccc(cc1)O)c2c(cccc2O)O 271570a_203496583355_100008315327 [1,0,0,0,1,0|1,0,0]=3 646 B19R2.152257 Cc1ccc(cc1)C=Cc2c(cc(cc2O)O)O 271570a_100102527916_200010341185 [1,0,0,0,1,0|1,0,0]=3 647 B19R2.152257 Oc1cc(c(c(c1)O)C=Cc2ccc(cc2)Br)O 271570a_100102527914_200010341185 [1,0,0,0,1,0|1,0,0]=3 648 B19R2.152257 Oc1cc(c(c(c1)O)C=Cc2ccc(cc2)Cl)O 271570a_100102527930_200010341185 [1,0,0,0,1,0|1,0,0]=3 649 B19R2.152257 Oc1cc(c(c(c1)O)C=Cc2ccc(cc2)F)O 271570a_100102525539_200010341185 [1,0,0,0,1,0|1,0,0]=3 650 B19R2.150226 C=C(c1ccc(cc1)C)c2c(cc(cc2O)O)O 271570a_100010895218_200010341185 [0,0,0,0,2,0|2,0,0]=4 651 B19R2.150226 C=C(c1ccc(cc1)Cl)c2c(cc(cc2O)O)O 271570a_100010171417_200010341185 [0,0,0,0,2,0|2,0,0]=4 652 B19R2.150226 C=C(c1ccc(cc1)F)c2c(cc(cc2O)O)O 271570a_100000068270_200010341185 [0,0,0,0,2,0|2,0,0]=4 653 B21R2.97356 Cc1cc(ccc1NC(=O)C=Cc2ccc(cc2)Br)O 22a_100000756630_100016267368 [1,0,0,0,0,1|2,0,0]=4 654 B21R2.97356 Cc1cc(ccc1NC(=O)C=Cc2ccc(cc2)Cl)O 22a_100000756630_100000184863 [1,0,0,0,0,1|2,0,0]=4 655 B21R2.97356 Cc1cc(ccc1NC(=O)C=Cc2ccc(cc2)F)O 22a_100000756630_100000182136 [1,0,0,0,0,1|2,0,0]=4 656 B21R2.97356 Cc1cc(ccc1NC(=O)C=Cc2ccc(cc2)I)O 22a_100000756630_100102526154 [1,0,0,0,0,1|2,0,0]=4 657 B21R2.97356 Cc1cc(ccc1NC(=O)C=Cc2ccc(cc2)O)Br 22a_100000211769_100016269017 [1,0,0,0,0,1|2,0,0]=4 658 B21R2.97356 Cc1cc(ccc1NC(=O)C=Cc2ccc(cc2)O)Cl 22a_100000210418_100016269017 [1,0,0,0,0,1|2,0,0]=4 659 B21R2.97356 Cc1cc(ccc1NC(=O)C=Cc2ccc(cc2)O)F 22a_100000211637_100016269017 [1,0,0,0,0,1|2,0,0]=4 660 B21R2.97356 Cc1cc(ccc1NC(=O)C=Cc2ccc(cc2)O)I 22a_100000184554_100016269017 [1,0,0,0,0,1|2,0,0]=4 661 B21R2.97356 Cc1cc(ccc1NC(=O)C=Cc2ccc(cc2)O)O 22a_100000756630_100016269017 [1,0,0,0,0,1|1,0,0]=3 662 B21R2.97356 Cc1ccc(c(c1)C)NC(=O)C=Cc2ccc(cc2)O 22a_100000736561_100016269017 [1,0,0,0,0,1|2,0,0]=4 663 B21R2.97356 Cc1ccc(c(c1)Cl)NC(=O)C=Cc2ccc(cc2)O 22a_100000210522_100016269017 [1,0,0,0,0,1|2,0,0]=4 664 B21R2.97356 Cc1ccc(c(c1)F)NC(=O)C=Cc2ccc(cc2)O 22a_100000211023_100016269017 [1,0,0,0,0,1|2,0,0]=4 665 B21R2.97356 Cc1ccc(c(c1)O)NC(=O)C=Cc2ccc(cc2)Br 22a_100000211527_100016267368 [1,0,0,0,0,1|2,0,0]=4 666 B21R2.97356 Cc1ccc(c(c1)O)NC(=O)C=Cc2ccc(cc2)Cl 22a_100000211527_100000184863 [1,0,0,0,0,1|2,0,0]=4 667 B21R2.97356 Cc1ccc(c(c1)O)NC(=O)C=Cc2ccc(cc2)F 22a_100000211527_100000182136 [1,0,0,0,0,1|2,0,0]=4 668 B21R2.97356 Cc1ccc(c(c1)O)NC(=O)C=Cc2ccc(cc2)I 22a_100000211527_100102526154 [1,0,0,0,0,1|2,0,0]=4 669 B21R2.97356 Cc1ccc(c(c1)O)NC(=O)C=Cc2ccc(cc2)O 22a_100000211527_100016269017 [1,0,0,0,0,1|1,0,0]=3 670 B21R2.97356 Cc1ccc(cc1)C=CC(=O)Nc2ccc(cc2Br)O 22a_100012001276_100000716854 [1,0,0,0,0,1|2,0,0]=4 671 B21R2.97356 Cc1ccc(cc1)C=CC(=O)Nc2ccc(cc2C)O 22a_100000756630_100000716854 [1,0,0,0,0,1|2,0,0]=4 672 B21R2.97356 Cc1ccc(cc1)C=CC(=O)Nc2ccc(cc2Cl)O 22a_100011215599_100000716854 [1,0,0,0,0,1|2,0,0]=4 673 B21R2.97356 Cc1ccc(cc1)C=CC(=O)Nc2ccc(cc2F)O 22a_100000759473_100000716854 [1,0,0,0,0,1|2,0,0]=4 674 B21R2.97356 Cc1ccc(cc1)C=CC(=O)Nc2ccc(cc2I)O 22a_100010084370_100000716854 [1,0,0,0,0,1|2,0,0]=4 675 B21R2.97356 Cc1ccc(cc1)C=CC(=O)Nc2ccc(cc2O)Br 22a_100000739049_100000716854 [1,0,0,0,0,1|2,0,0]=4 676 B21R2.97356 Cc1ccc(cc1)C=CC(=O)Nc2ccc(cc2O)C 22a_100000211527_100000716854 [1,0,0,0,0,1|2,0,0]=4 677 B21R2.97356 Cc1ccc(cc1)C=CC(=O)Nc2ccc(cc2O)Cl 22a_100000185728_100000716854 [1,0,0,0,0,1|2,0,0]=4 678 B21R2.97356 Cc1ccc(cc1)C=CC(=O)Nc2ccc(cc2O)F 22a_100000753323_100000716854 [1,0,0,0,0,1|2,0,0]=4 679 B21R2.97356 Cc1ccc(cc1)C=CC(=O)Nc2ccc(cc2O)I 22a_100000057187_100000716854 [1,0,0,0,0,1|2,0,0]=4 680 B21R2.97356 Cc1ccc(cc1)C=CC(=O)Nc2ccc(cc2O)O 22a_100000106777_100000716854 [1,0,0,0,0,1|1,0,0]=3 681 B21R2.97356 O=C(C=Cc1ccc(cc1)Br)Cc2ccc(cc2Cl)O 6a_100000186029_200000084595 [1,0,0,0,0,1|2,0,0]=4 682 B21R2.97356 O=C(C=Cc1ccc(cc1)Br)Nc2ccc(cc2Br)O 22a_100012001276_100016267368 [1,0,0,0,0,1|2,0,0]=4 683 B21R2.97356 O=C(C=Cc1ccc(cc1)Br)Nc2ccc(cc2Cl)O 22a_100011215599_100016267368 [1,0,0,0,0,1|2,0,0]=4 684 B21R2.97356 O=C(C=Cc1ccc(cc1)Br)Nc2ccc(cc2F)O 22a_100000759473_100016267368 [1,0,0,0,0,1|2,0,0]=4 685 B21R2.97356 O=C(C=Cc1ccc(cc1)Br)Nc2ccc(cc2I)O 22a_100010084370_100016267368 [1,0,0,0,0,1|2,0,0]=4 686 B21R2.97356 O=C(C=Cc1ccc(cc1)Br)Nc2ccc(cc2O)Br 22a_100000739049_100016267368 [1,0,0,0,0,1|2,0,0]=4 687 B21R2.97356 O=C(C=Cc1ccc(cc1)Br)Nc2ccc(cc2O)Cl 22a_100000185728_100016267368 [1,0,0,0,0,1|2,0,0]=4 688 B21R2.97356 O=C(C=Cc1ccc(cc1)Br)Nc2ccc(cc2O)F 22a_100000753323_100016267368 [1,0,0,0,0,1|2,0,0]=4 689 B21R2.97356 O=C(C=Cc1ccc(cc1)Br)Nc2ccc(cc2O)I 22a_100000057187_100016267368 [1,0,0,0,0,1|2,0,0]=4 690 B21R2.97356 O=C(C=Cc1ccc(cc1)Br)Nc2ccc(cc2O)O 22a_100000106777_100016267368 [1,0,0,0,0,1|1,0,0]=3 691 B21R2.97356 O=C(C=Cc1ccc(cc1)Cl)Nc2ccc(cc2Br)O 22a_100012001276_100000184863 [1,0,0,0,0,1|2,0,0]=4 692 B21R2.97356 O=C(C=Cc1ccc(cc1)Cl)Nc2ccc(cc2Cl)O 22a_100011215599_100000184863 [1,0,0,0,0,1|2,0,0]=4 693 B21R2.97356 O=C(C=Cc1ccc(cc1)Cl)Nc2ccc(cc2F)O 22a_100000759473_100000184863 [1,0,0,0,0,1|2,0,0]=4 694 B21R2.97356 O=C(C=Cc1ccc(cc1)Cl)Nc2ccc(cc2I)O 22a_100010084370_100000184863 [1,0,0,0,0,1|2,0,0]=4 695 B21R2.97356 O=C(C=Cc1ccc(cc1)Cl)Nc2ccc(cc2O)Br 22a_100000739049_100000184863 [1,0,0,0,0,1|2,0,0]=4 696 B21R2.97356 O=C(C=Cc1ccc(cc1)Cl)Nc2ccc(cc2O)Cl 22a_100000185728_100000184863 [1,0,0,0,0,1|2,0,0]=4 697 B21R2.97356 O=C(C=Cc1ccc(cc1)Cl)Nc2ccc(cc2O)F 22a_100000753323_100000184863 [1,0,0,0,0,1|2,0,0]=4 698 B21R2.97356 O=C(C=Cc1ccc(cc1)Cl)Nc2ccc(cc2O)I 22a_100000057187_100000184863 [1,0,0,0,0,1|2,0,0]=4 699 B21R2.97356 O=C(C=Cc1ccc(cc1)Cl)Nc2ccc(cc2O)O 22a_100000106777_100000184863 [1,0,0,0,0,1|1,0,0]=3 700 B21R2.97356 O=C(C=Cc1ccc(cc1)F)Cc2ccc(cc2Cl)O 6a_100000210084_200000084595 [1,0,0,0,0,1|2,0,0]=4 701 B21R2.97356 O=C(C=Cc1ccc(cc1)F)Nc2ccc(cc2Br)O 22a_100012001276_100000182136 [1,0,0,0,0,1|2,0,0]=4 702 B21R2.97356 O=C(C=Cc1ccc(cc1)F)Nc2ccc(cc2Cl)O 22a_100011215599_100000182136 [1,0,0,0,0,1|2,0,0]=4 703 B21R2.97356 O=C(C=Cc1ccc(cc1)F)Nc2ccc(cc2F)O 22a_100000759473_100000182136 [1,0,0,0,0,1|2,0,0]=4 704 B21R2.97356 O=C(C=Cc1ccc(cc1)F)Nc2ccc(cc2I)O 22a_100010084370_100000182136 [1,0,0,0,0,1|2,0,0]=4 705 B21R2.97356 O=C(C=Cc1ccc(cc1)F)Nc2ccc(cc2O)Br 22a_100000739049_100000182136 [1,0,0,0,0,1|2,0,0]=4 706 B21R2.97356 O=C(C=Cc1ccc(cc1)F)Nc2ccc(cc2O)Cl 22a_100000185728_100000182136 [1,0,0,0,0,1|2,0,0]=4 707 B21R2.97356 O=C(C=Cc1ccc(cc1)F)Nc2ccc(cc2O)F 22a_100000753323_100000182136 [1,0,0,0,0,1|2,0,0]=4 708 B21R2.97356 O=C(C=Cc1ccc(cc1)F)Nc2ccc(cc2O)I 22a_100000057187_100000182136 [1,0,0,0,0,1|2,0,0]=4 709 B21R2.97356 O=C(C=Cc1ccc(cc1)F)Nc2ccc(cc2O)O 22a_100000106777_100000182136 [1,0,0,0,0,1|1,0,0]=3 710 B21R2.97356 O=C(C=Cc1ccc(cc1)I)Cc2ccc(cc2Cl)O 6a_100000188517_200000084595 [1,0,0,0,0,1|2,0,0]=4 711 B21R2.97356 O=C(C=Cc1ccc(cc1)I)Nc2ccc(cc2Br)O 22a_100012001276_100102526154 [1,0,0,0,0,1|2,0,0]=4 712 B21R2.97356 O=C(C=Cc1ccc(cc1)I)Nc2ccc(cc2Cl)O 22a_100011215599_100102526154 [1,0,0,0,0,1|2,0,0]=4 713 B21R2.97356 O=C(C=Cc1ccc(cc1)I)Nc2ccc(cc2F)O 22a_100000759473_100102526154 [1,0,0,0,0,1|2,0,0]=4 714 B21R2.97356 O=C(C=Cc1ccc(cc1)I)Nc2ccc(cc2I)O 22a_100010084370_100102526154 [1,0,0,0,0,1|2,0,0]=4 715 B21R2.97356 O=C(C=Cc1ccc(cc1)I)Nc2ccc(cc2O)Br 22a_100000739049_100102526154 [1,0,0,0,0,1|2,0,0]=4 716 B21R2.97356 O=C(C=Cc1ccc(cc1)I)Nc2ccc(cc2O)Cl 22a_100000185728_100102526154 [1,0,0,0,0,1|2,0,0]=4 717 B21R2.97356 O=C(C=Cc1ccc(cc1)I)Nc2ccc(cc2O)F 22a_100000753323_100102526154 [1,0,0,0,0,1|2,0,0]=4 718 B21R2.97356 O=C(C=Cc1ccc(cc1)I)Nc2ccc(cc2O)I 22a_100000057187_100102526154 [1,0,0,0,0,1|2,0,0]=4 719 B21R2.97356 O=C(C=Cc1ccc(cc1)I)Nc2ccc(cc2O)O 22a_100000106777_100102526154 [1,0,0,0,0,1|1,0,0]=3 720 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2Br)O 22a_100012001276_100016269017 [1,0,0,0,0,1|1,0,0]=3 721 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2Cl)Cl 22a_100000185861_100016269017 [1,0,0,0,0,1|2,0,0]=4 722 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2Cl)F 22a_100000212003_100016269017 [1,0,0,0,0,1|2,0,0]=4 723 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2Cl)I 22a_100011218065_100016269017 [1,0,0,0,0,1|2,0,0]=4 724 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2Cl)O 22a_100011215599_100016269017 [1,0,0,0,0,1|1,0,0]=3 725 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2F)Br 22a_100000210722_100016269017 [1,0,0,0,0,1|2,0,0]=4 726 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2F)Cl 22a_100000211020_100016269017 [1,0,0,0,0,1|2,0,0]=4 727 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2F)F 22a_100000210720_100016269017 [1,0,0,0,0,1|2,0,0]=4 728 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2F)I 22a_100011215594_100016269017 [1,0,0,0,0,1|2,0,0]=4 729 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2F)O 22a_100000759473_100016269017 [1,0,0,0,0,1|1,0,0]=3 730 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2I)F 22a_100000760547_100016269017 [1,0,0,0,0,1|2,0,0]=4 731 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2I)O 22a_100010084370_100016269017 [1,0,0,0,0,1|1,0,0]=3 732 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2O)Br 22a_100000739049_100016269017 [1,0,0,0,0,1|1,0,0]=3 733 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2O)Cl 22a_100000185728_100016269017 [1,0,0,0,0,1|1,0,0]=3 734 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2O)F 22a_100000753323_100016269017 [1,0,0,0,0,1|1,0,0]=3 735 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2O)I 22a_100000057187_100016269017 [1,0,0,0,0,1|1,0,0]=3 736 B21R2.97356 O=C(C=Cc1ccc(cc1)O)Nc2ccc(cc2O)O 22a_100000106777_100016269017 [1,0,0,0,0,1|0,0,0]=2 737 B21R2.97356 O=C(C=Cc1ccc(cn1)F)Nc2ccc(cc2O)O 22a_100000106777_100020630499 [1,0,0,0,0,1|2,0,0]=4 738 B21R2.97356 O=C(C=Cc1ccc(nc1)Br)Nc2ccc(cc2O)O 22a_100000106777_100020588214 [1,0,0,0,0,1|2,0,0]=4 739 B21R2.97356 O=C(CCc1ccc(cc1)O)Nc2ccc(cc2O)O 22a_100000106777_100000742835 [1,0,0,0,0,1|0,0,2]=4 740 B21R2.97356 O=C(COc1ccc(cc1)O)Nc2ccc(cc2O)O 22a_100000106777_100000031633 [1,0,0,0,0,1|1,0,1]=4 741 B21R2.97356 O=C(COc1ccc(cc1)O)Nc2ccc(cc2O)O 527a_100000106777_100000031633 [1,0,0,0,0,1|1,0,1]=4 742 B21R2.97356 O=C(NCc1ccc(cc1)O)Nc2ccc(cc2O)O 2430a_100000106777_100000185549 [1,0,0,0,0,1|1,0,1]=4 743 B21R2.358849 O=C(CNCc1ccc(cc1)O)c2ccc(cc2O)O 34a_100000185549_100009814262 [1,0,0,0,0,1|0,0,2]=4 744 B21R2.30077 Cc1cc(c(c(c1)Cl)NC(=O)C=Cc2ccccc2)O 22a_100015906060_100000210462 [1,0,0,0,0,1|2,0,0]=4 745 B21R2.30077 Cc1cc(cc(c1NC(=O)C=Cc2ccccc2)C)O 22a_100011934200_100000210462 [1,0,0,0,0,1|2,0,0]=4 746 B21R2.30077 Cc1cc(cc(c1NC(=O)C=Cc2ccccc2)O)Br 22a_100010371313_100000210462 [1,0,0,0,0,1|2,0,0]=4 747 B21R2.30077 O=C(C=Cc1ccccc1)Nc2c(cc(cc2F)Br)O 22a_100015475841_100000210462 [1,0,0,0,0,1|2,0,0]=4 748 B21R2.30077 O=C(C=Cc1ccccc1)Nc2c(cc(cc2F)Cl)O 22a_100010883250_100000210462 [1,0,0,0,0,1|2,0,0]=4 749 B21R2.30077 O=C(C=Cc1ccccc1)Nc2c(cc(cc2F)F)O 22a_100011217947_100000210462 [1,0,0,0,0,1|2,0,0]=4 750 B21R2.30077 O=C(C=Cc1ccccc1)Nc2c(cc(cc2F)O)F 1626a_100000036573_100000210462 [1,0,0,0,0,1|2,0,0]=4 751 B21R2.30165 Cc1cc(c(c(c1)O)C(=O)C/C=C/c2ccccc2)C 1458a_100011255216_100016265936 [1,0,0,0,0,1|2,0,0]=4 752 B21R2.30165 Cc1cc(c(c(c1)O)C(=O)C/C=C/c2ccccc2)O 1458a_100000036929_100016265936 [1,0,0,0,0,1|1,0,0]=3 753 B21R2.30165 Cc1cc(cc(c1C(=O)C/C=C/c2ccccc2)C)O 1458a_100000066486_100016265936 [1,0,0,0,0,1|2,0,0]=4 754 B21R2.30165 Cc1cc(cc(c1C(=O)C/C=C/c2ccccc2)O)O 1458a_200000061528_100016265936 [1,0,0,0,0,1|1,0,0]=3 755 B21R2.30165 O=C(C/C=C/c1ccccc1)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100016265936 [1,0,0,0,0,1|2,0,0]=4 756 B21R2.30165 O=C(C/C=C/c1ccccc1)c2c(cc(cc2F)Br)O 1458a_200015963038_100016265936 [1,0,0,0,0,1|2,0,0]=4 757 B21R2.30165 O=C(C/C=C/c1ccccc1)c2c(cc(cc2F)F)O 1458a_100000746385_100016265936 [1,0,0,0,0,1|2,0,0]=4 758 B21R2.30165 O=C(C/C=C/c1ccccc1)c2c(cc(cc2F)O)F 1458a_100000038755_100016265936 [1,0,0,0,0,1|2,0,0]=4 759 B21R2.30165 O=C(NCCc1ccccc1)c2c(cc(cc2O)O)O 527a_100000106460_100000040092 [1,0,0,0,0,1|0,0,2]=4 760 B21R2.362199 Cc1ccc(cc1)C=CC(=O)Nc2c(cccc2Cl)O 22a_100012022510_100000716854 [1,0,0,0,0,1|2,0,0]=4 761 B21R2.362199 Cc1ccc(cc1)C=CC(=O)Nc2c(cccc2F)O 22a_100020591140_100000716854 [1,0,0,0,0,1|2,0,0]=4 762 B21R2.362199 Cc1ccc(cc1)C=CC(=O)Nc2c(cccc2I)O 22a_200000049512_100000716854 [1,0,0,0,0,1|2,0,0]=4 763 B21R2.362199 Cc1ccc(cc1)C=CC(=O)Nc2c(cccc2O)C 22a_100000743429_100000716854 [1,0,0,0,0,1|2,0,0]=4 764 B21R2.362199 Cc1ccc(cc1)C=CC(=O)Nc2c(cccc2O)O 22a_100011995820_100000716854 [1,0,0,0,0,1|1,0,0]=3 765 B21R2.362199 Cc1cccc(c1NC(=O)C=Cc2ccc(cc2)Br)O 22a_100000743429_100016267368 [1,0,0,0,0,1|2,0,0]=4 766 B21R2.362199 Cc1cccc(c1NC(=O)C=Cc2ccc(cc2)Cl)O 22a_100000743429_100000184863 [1,0,0,0,0,1|2,0,0]=4 767 B21R2.362199 Cc1cccc(c1NC(=O)C=Cc2ccc(cc2)F)O 22a_100000743429_100000182136 [1,0,0,0,0,1|2,0,0]=4 768 B21R2.362199 Cc1cccc(c1NC(=O)C=Cc2ccc(cc2)I)O 22a_100000743429_100102526154 [1,0,0,0,0,1|2,0,0]=4 769 B21R2.362199 Cc1cccc(c1NC(=O)C=Cc2ccc(cc2)O)C 22a_100000185769_100016269017 [1,0,0,0,0,1|2,0,0]=4 770 B21R2.362199 Cc1cccc(c1NC(=O)C=Cc2ccc(cc2)O)F 22a_100000766463_100016269017 [1,0,0,0,0,1|2,0,0]=4 771 B21R2.362199 Cc1cccc(c1NC(=O)C=Cc2ccc(cc2)O)O 22a_100000743429_100016269017 [1,0,0,0,0,1|1,0,0]=3 772 B21R2.362199 O=C(C=Cc1ccc(cc1)Br)Nc2c(cccc2Cl)O 22a_100012022510_100016267368 [1,0,0,0,0,1|2,0,0]=4 773 B21R2.362199 O=C(C=Cc1ccc(cc1)Br)Nc2c(cccc2F)O 22a_100020591140_100016267368 [1,0,0,0,0,1|2,0,0]=4 774 B21R2.362199 O=C(C=Cc1ccc(cc1)Br)Nc2c(cccc2I)O 22a_200000049512_100016267368 [1,0,0,0,0,1|2,0,0]=4 775 B21R2.362199 O=C(C=Cc1ccc(cc1)Br)Nc2c(cccc2O)O 22a_100011995820_100016267368 [1,0,0,0,0,1|1,0,0]=3 776 B21R2.362199 O=C(C=Cc1ccc(cc1)Cl)Nc2c(cccc2Cl)O 22a_100012022510_100000184863 [1,0,0,0,0,1|2,0,0]=4 777 B21R2.362199 O=C(C=Cc1ccc(cc1)Cl)Nc2c(cccc2F)O 22a_100020591140_100000184863 [1,0,0,0,0,1|2,0,0]=4 778 B21R2.362199 O=C(C=Cc1ccc(cc1)Cl)Nc2c(cccc2I)O 22a_200000049512_100000184863 [1,0,0,0,0,1|2,0,0]=4 779 B21R2.362199 O=C(C=Cc1ccc(cc1)Cl)Nc2c(cccc2O)O 22a_100011995820_100000184863 [1,0,0,0,0,1|1,0,0]=3 780 B21R2.362199 O=C(C=Cc1ccc(cc1)F)Nc2c(cccc2Cl)O 22a_100012022510_100000182136 [1,0,0,0,0,1|2,0,0]=4 781 B21R2.362199 O=C(C=Cc1ccc(cc1)F)Nc2c(cccc2F)O 22a_100020591140_100000182136 [1,0,0,0,0,1|2,0,0]=4 782 B21R2.362199 O=C(C=Cc1ccc(cc1)F)Nc2c(cccc2I)O 22a_200000049512_100000182136 [1,0,0,0,0,1|2,0,0]=4 783 B21R2.362199 O=C(C=Cc1ccc(cc1)F)Nc2c(cccc2O)O 22a_100011995820_100000182136 [1,0,0,0,0,1|1,0,0]=3 784 B21R2.362199 O=C(C=Cc1ccc(cc1)I)Nc2c(cccc2Cl)O 22a_100012022510_100102526154 [1,0,0,0,0,1|2,0,0]=4 785 B21R2.362199 O=C(C=Cc1ccc(cc1)I)Nc2c(cccc2F)O 22a_100020591140_100102526154 [1,0,0,0,0,1|2,0,0]=4 786 B21R2.362199 O=C(C=Cc1ccc(cc1)I)Nc2c(cccc2I)O 22a_200000049512_100102526154 [1,0,0,0,0,1|2,0,0]=4 787 B21R2.362199 O=C(C=Cc1ccc(cc1)I)Nc2c(cccc2O)O 22a_100011995820_100102526154 [1,0,0,0,0,1|1,0,0]=3 788 B21R2.362199 O=C(C=Cc1ccc(cc1)O)Nc2c(cccc2Cl)O 22a_100012022510_100016269017 [1,0,0,0,0,1|1,0,0]=3 789 B21R2.362199 O=C(C=Cc1ccc(cc1)O)Nc2c(cccc2F)O 22a_100020591140_100016269017 [1,0,0,0,0,1|1,0,0]=3 790 B21R2.362199 O=C(C=Cc1ccc(cc1)O)Nc2c(cccc2I)O 22a_200000049512_100016269017 [1,0,0,0,0,1|1,0,0]=3 791 B21R2.362199 O=C(C=Cc1ccc(cc1)O)Nc2c(cccc2O)O 22a_100011995820_100016269017 [1,0,0,0,0,1|0,0,0]=2 792 B21R2.362199 O=C(C=Cc1ccc(cn1)F)Nc2c(cccc2O)O 22a_100011995820_100020630499 [1,0,0,0,0,1|2,0,0]=4 793 B21R2.362199 O=C(C=Cc1ccc(nc1)Br)Nc2c(cccc2O)O 22a_100011995820_100020588214 [1,0,0,0,0,1|2,0,0]=4 794 B21R2.362199 O=C(CCc1ccc(cc1)O)Nc2c(cccc2O)O 22a_100011995820_100000742835 [1,0,0,0,0,1|0,0,2]=4 795 B21R2.362199 O=C(COc1ccc(cc1)O)Nc2c(cccc2O)O 22a_100011995820_100000031633 [1,0,0,0,0,1|1,0,1]=4 796 B21R2.362199 O=C(COc1ccc(cc1)O)Nc2c(cccc2O)O 527a_100011995820_100000031633 [1,0,0,0,0,1|1,0,1]=4 797 B21R2.772581 O=C(NCCc1ccc(cc1)O)c2c(cccc2O)O 527a_100000743037_100000755285 [1,0,0,0,0,1|0,0,2]=4