0 B21R2.362231 Cc1cc(c(c(c1)Br)C(=O)CCc2ccc(cc2)Br)F 1458a_100010768510_100011740612 [0,0,0,0,0,0|4,0,0]=4 1 B21R2.362231 Cc1cc(c(c(c1)Br)C(=O)CCc2ccc(cc2)Cl)F 1458a_100010768510_100011713675 [0,0,0,0,0,0|4,0,0]=4 2 B21R2.362231 Cc1cc(c(c(c1)C)C(=O)CCc2ccc(cc2)Br)C 1458a_100000211658_100011740612 [0,0,0,0,0,0|4,0,0]=4 3 B21R2.362231 Cc1cc(c(c(c1)C)C(=O)CCc2ccc(cc2)Cl)C 1458a_100000211658_100011713675 [0,0,0,0,0,0|4,0,0]=4 4 B21R2.362231 Cc1cc(c(c(c1)Cl)C(=O)CCc2ccc(cc2)Br)Cl 1458a_100009989429_100011740612 [0,0,0,0,0,0|4,0,0]=4 5 B21R2.362231 Cc1cc(c(c(c1)Cl)C(=O)CCc2ccc(cc2)Cl)Cl 1458a_100009989429_100011713675 [0,0,0,0,0,0|4,0,0]=4 6 B21R2.362231 Cc1cc(c(c(c1)Cl)C(=O)CCc2ccc(cc2)F)Cl 1458a_100009989429_100011217392 [0,0,0,0,0,0|4,0,0]=4 7 B21R2.362231 Cc1cc(c(c(c1)I)C(=O)CCc2ccc(cc2)Br)I 1458a_200010371430_100011740612 [0,0,0,0,0,0|4,0,0]=4 8 B21R2.362231 Cc1cc(c(c(c1)I)C(=O)CCc2ccc(cc2)Cl)I 1458a_200010371430_100011713675 [0,0,0,0,0,0|4,0,0]=4 9 B21R2.362231 Cc1cc(c(c(c1)I)C(=O)CCc2ccc(cc2)F)I 1458a_200010371430_100011217392 [0,0,0,0,0,0|4,0,0]=4 10 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Br)Br)F 1458a_100010204434_100011740612 [0,0,0,0,0,0|4,0,0]=4 11 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Br)C)Br 1458a_100000739581_100011740612 [0,0,0,0,0,0|4,0,0]=4 12 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Br)C)Cl 1458a_100000088873_100011740612 [0,0,0,0,0,0|4,0,0]=4 13 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Br)C)F 1458a_100012017201_100011740612 [0,0,0,0,0,0|4,0,0]=4 14 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Br)Cl)Br 1458a_100000698028_100011740612 [0,0,0,0,0,0|4,0,0]=4 15 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Br)F)Br 1458a_100000708665_100011740612 [0,0,0,0,0,0|4,0,0]=4 16 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Br)F)Cl 1458a_100010768517_100011740612 [0,0,0,0,0,0|4,0,0]=4 17 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Br)I)F 1458a_200010371433_100011740612 [0,0,0,0,0,0|4,0,0]=4 18 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Cl)Br)F 1458a_100010204434_100011713675 [0,0,0,0,0,0|4,0,0]=4 19 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Cl)C)Br 1458a_100000739581_100011713675 [0,0,0,0,0,0|4,0,0]=4 20 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Cl)C)Cl 1458a_100000088873_100011713675 [0,0,0,0,0,0|4,0,0]=4 21 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Cl)Cl)Br 1458a_100000698028_100011713675 [0,0,0,0,0,0|4,0,0]=4 22 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Cl)F)Br 1458a_100000708665_100011713675 [0,0,0,0,0,0|4,0,0]=4 23 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Cl)F)Cl 1458a_100010768517_100011713675 [0,0,0,0,0,0|4,0,0]=4 24 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)Cl)I)F 1458a_200010371433_100011713675 [0,0,0,0,0,0|4,0,0]=4 25 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)F)C)Br 1458a_100000739581_100011217392 [0,0,0,0,0,0|4,0,0]=4 26 B21R2.362231 Cc1cc(cc(c1C(=O)CCc2ccc(cc2)F)Cl)Br 1458a_100000698028_100011217392 [0,0,0,0,0,0|4,0,0]=4 27 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2Br)Br)F 1458a_100009813784_100011713686 [0,0,0,0,0,0|4,0,0]=4 28 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2Br)C)F 1458a_100010768510_100011713686 [0,0,0,0,0,0|4,0,0]=4 29 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2Br)Cl)F 1458a_100010244364_100011713686 [0,0,0,0,0,0|4,0,0]=4 30 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2Br)F)Br 1458a_200015320377_100011713686 [0,0,0,0,0,0|4,0,0]=4 31 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2Br)F)C 1458a_100010204434_100011713686 [0,0,0,0,0,0|4,0,0]=4 32 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2C)Br)C 1458a_100000739581_100011713686 [0,0,0,0,0,0|4,0,0]=4 33 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2C)Cl)C 1458a_100000088873_100011713686 [0,0,0,0,0,0|4,0,0]=4 34 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)Br)C 1458a_100000698028_100011713686 [0,0,0,0,0,0|4,0,0]=4 35 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)Br)Cl 1458a_100012360385_100011713686 [0,0,0,0,0,0|4,0,0]=4 36 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)Br)F 1458a_100010078411_100011713686 [0,0,0,0,0,0|4,0,0]=4 37 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)C)Cl 1458a_100009989429_100011713686 [0,0,0,0,0,0|4,0,0]=4 38 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)Cl)Cl 1458a_100011215713_100011713686 [0,0,0,0,0,0|4,0,0]=4 39 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)Cl)F 1458a_100010068318_100011713686 [0,0,0,0,0,0|4,0,0]=4 40 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)F)Cl 1458a_100000703918_100011713686 [0,0,0,0,0,0|4,0,0]=4 41 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)I)Cl 1458a_100010740244_100011713686 [0,0,0,0,0,0|4,0,0]=4 42 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2F)Br)C 1458a_100000708665_100011713686 [0,0,0,0,0,0|4,0,0]=4 43 B21R2.362231 Cc1ccc(cc1)CCC(=O)c2c(cc(cc2I)C)I 1458a_200010371430_100011713686 [0,0,0,0,0,0|4,0,0]=4 44 B21R2.362231 O=C(CCc1ccc(cc1)Br)c2c(cc(cc2Br)Br)F 1458a_100009813784_100011740612 [0,0,0,0,0,0|4,0,0]=4 45 B21R2.362231 O=C(CCc1ccc(cc1)Br)c2c(cc(cc2Br)Cl)F 1458a_100010244364_100011740612 [0,0,0,0,0,0|4,0,0]=4 46 B21R2.362231 O=C(CCc1ccc(cc1)Br)c2c(cc(cc2Br)F)Br 1458a_200015320377_100011740612 [0,0,0,0,0,0|4,0,0]=4 47 B21R2.362231 O=C(CCc1ccc(cc1)Br)c2c(cc(cc2Br)F)F 1458a_100013316034_100011740612 [0,0,0,0,0,0|4,0,0]=4 48 B21R2.362231 O=C(CCc1ccc(cc1)Br)c2c(cc(cc2Cl)Br)F 1458a_100010078411_100011740612 [0,0,0,0,0,0|4,0,0]=4 49 B21R2.362231 O=C(CCc1ccc(cc1)Br)c2c(cc(cc2Cl)Cl)F 1458a_100010068318_100011740612 [0,0,0,0,0,0|4,0,0]=4 50 B21R2.362231 O=C(CCc1ccc(cc1)Br)c2c(cc(cc2Cl)F)Cl 1458a_100000703918_100011740612 [0,0,0,0,0,0|4,0,0]=4 51 B21R2.362231 O=C(CCc1ccc(cc1)Br)c2c(cc(cc2Cl)F)F 1458a_100000119028_100011740612 [0,0,0,0,0,0|4,0,0]=4 52 B21R2.362231 O=C(CCc1ccc(cc1)Br)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100011740612 [0,0,0,0,0,0|3,0,0]=3 53 B21R2.362231 O=C(CCc1ccc(cc1)Br)c2c(cc(cc2F)Br)F 1458a_100000766946_100011740612 [0,0,0,0,0,0|4,0,0]=4 54 B21R2.362231 O=C(CCc1ccc(cc1)Br)c2c(cc(cc2F)Cl)F 1458a_100000062413_100011740612 [0,0,0,0,0,0|4,0,0]=4 55 B21R2.362231 O=C(CCc1ccc(cc1)Cl)c2c(cc(cc2Br)Br)F 1458a_100009813784_100011713675 [0,0,0,0,0,0|4,0,0]=4 56 B21R2.362231 O=C(CCc1ccc(cc1)Cl)c2c(cc(cc2Br)Cl)F 1458a_100010244364_100011713675 [0,0,0,0,0,0|4,0,0]=4 57 B21R2.362231 O=C(CCc1ccc(cc1)Cl)c2c(cc(cc2Br)F)Br 1458a_200015320377_100011713675 [0,0,0,0,0,0|4,0,0]=4 58 B21R2.362231 O=C(CCc1ccc(cc1)Cl)c2c(cc(cc2Br)F)F 1458a_100013316034_100011713675 [0,0,0,0,0,0|4,0,0]=4 59 B21R2.362231 O=C(CCc1ccc(cc1)Cl)c2c(cc(cc2Cl)Br)F 1458a_100010078411_100011713675 [0,0,0,0,0,0|4,0,0]=4 60 B21R2.362231 O=C(CCc1ccc(cc1)Cl)c2c(cc(cc2Cl)Cl)F 1458a_100010068318_100011713675 [0,0,0,0,0,0|4,0,0]=4 61 B21R2.362231 O=C(CCc1ccc(cc1)Cl)c2c(cc(cc2Cl)F)Cl 1458a_100000703918_100011713675 [0,0,0,0,0,0|4,0,0]=4 62 B21R2.362231 O=C(CCc1ccc(cc1)Cl)c2c(cc(cc2Cl)F)F 1458a_100000119028_100011713675 [0,0,0,0,0,0|4,0,0]=4 63 B21R2.362231 O=C(CCc1ccc(cc1)Cl)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100011713675 [0,0,0,0,0,0|3,0,0]=3 64 B21R2.362231 O=C(CCc1ccc(cc1)Cl)c2c(cc(cc2F)Br)F 1458a_100000766946_100011713675 [0,0,0,0,0,0|4,0,0]=4 65 B21R2.362231 O=C(CCc1ccc(cc1)Cl)c2c(cc(cc2F)Cl)F 1458a_100000062413_100011713675 [0,0,0,0,0,0|4,0,0]=4 66 B21R2.362231 O=C(CCc1ccc(cc1)F)c2c(cc(cc2Br)Br)Br 1458a_100011217931_100011217392 [0,0,0,0,0,0|4,0,0]=4 67 B21R2.362231 O=C(CCc1ccc(cc1)F)c2c(cc(cc2Br)Br)F 1458a_100009813784_100011217392 [0,0,0,0,0,0|4,0,0]=4 68 B21R2.362231 O=C(CCc1ccc(cc1)F)c2c(cc(cc2Br)Cl)F 1458a_100010244364_100011217392 [0,0,0,0,0,0|4,0,0]=4 69 B21R2.362231 O=C(CCc1ccc(cc1)F)c2c(cc(cc2Br)F)Br 1458a_200015320377_100011217392 [0,0,0,0,0,0|4,0,0]=4 70 B21R2.362231 O=C(CCc1ccc(cc1)F)c2c(cc(cc2Cl)Br)Cl 1458a_100012360385_100011217392 [0,0,0,0,0,0|4,0,0]=4 71 B21R2.362231 O=C(CCc1ccc(cc1)F)c2c(cc(cc2Cl)Br)F 1458a_100010078411_100011217392 [0,0,0,0,0,0|4,0,0]=4 72 B21R2.362231 O=C(CCc1ccc(cc1)F)c2c(cc(cc2Cl)Cl)Cl 1458a_100011215713_100011217392 [0,0,0,0,0,0|4,0,0]=4 73 B21R2.362231 O=C(CCc1ccc(cc1)F)c2c(cc(cc2Cl)Cl)F 1458a_100010068318_100011217392 [0,0,0,0,0,0|4,0,0]=4 74 B21R2.362231 O=C(CCc1ccc(cc1)F)c2c(cc(cc2Cl)F)Cl 1458a_100000703918_100011217392 [0,0,0,0,0,0|4,0,0]=4 75 B21R2.362231 O=C(CCc1ccc(cc1)F)c2c(cc(cc2Cl)I)Cl 1458a_100010740244_100011217392 [0,0,0,0,0,0|4,0,0]=4 76 B21R2.362231 O=C(CCc1ccc(cc1)O)c2c(cc(cc2Br)Br)Br 1458a_100011217931_100009816426 [0,0,0,0,0,0|3,0,0]=3 77 B21R2.362231 O=C(CCc1ccc(cc1)O)c2c(cc(cc2Cl)Br)Cl 1458a_100012360385_100009816426 [0,0,0,0,0,0|3,0,0]=3 78 B21R2.362231 O=C(CCc1ccc(cc1)O)c2c(cc(cc2Cl)Cl)Cl 1458a_100011215713_100009816426 [0,0,0,0,0,0|3,0,0]=3 79 B21R2.362231 O=C(CCc1ccc(cc1)O)c2c(cc(cc2Cl)I)Cl 1458a_100010740244_100009816426 [0,0,0,0,0,0|3,0,0]=3 80 B21R2.362231 O=C(NCc1ccc(cc1)O)c2c(cc(cc2O)O)O 527a_100000185549_100000040092 [0,0,0,0,0,0|1,0,0]=1 81 B20R2.15570 Cc1cc(ccc1C(=O)CCc2ccc(cc2)Br)Br 1458a_100000741311_100011740612 [1,0,0,0,0,0|3,0,0]=4 82 B20R2.15570 Cc1cc(ccc1C(=O)CCc2ccc(cc2)Br)Cl 1458a_100000688705_100011740612 [1,0,0,0,0,0|3,0,0]=4 83 B20R2.15570 Cc1cc(ccc1C(=O)CCc2ccc(cc2)Br)I 1458a_100010189873_100011740612 [1,0,0,0,0,0|3,0,0]=4 84 B20R2.15570 Cc1cc(ccc1C(=O)CCc2ccc(cc2)Cl)Br 1458a_100000741311_100011713675 [1,0,0,0,0,0|3,0,0]=4 85 B20R2.15570 Cc1cc(ccc1C(=O)CCc2ccc(cc2)Cl)Cl 1458a_100000688705_100011713675 [1,0,0,0,0,0|3,0,0]=4 86 B20R2.15570 Cc1cc(ccc1C(=O)CCc2ccc(cc2)Cl)I 1458a_100010189873_100011713675 [1,0,0,0,0,0|3,0,0]=4 87 B20R2.15570 Cc1ccc(c(c1)Br)C(=O)CCc2ccc(cc2)Br 1458a_100000685072_100011740612 [1,0,0,0,0,0|3,0,0]=4 88 B20R2.15570 Cc1ccc(c(c1)Br)C(=O)CCc2ccc(cc2)Cl 1458a_100000685072_100011713675 [1,0,0,0,0,0|3,0,0]=4 89 B20R2.15570 Cc1ccc(c(c1)Cl)C(=O)CCc2ccc(cc2)Br 1458a_100000766932_100011740612 [1,0,0,0,0,0|3,0,0]=4 90 B20R2.15570 Cc1ccc(c(c1)Cl)C(=O)CCc2ccc(cc2)Cl 1458a_100000766932_100011713675 [1,0,0,0,0,0|3,0,0]=4 91 B20R2.15570 Cc1ccc(c(c1)I)C(=O)CCc2ccc(cc2)Br 1458a_100009999607_100011740612 [1,0,0,0,0,0|3,0,0]=4 92 B20R2.15570 Cc1ccc(c(c1)I)C(=O)CCc2ccc(cc2)Cl 1458a_100009999607_100011713675 [1,0,0,0,0,0|3,0,0]=4 93 B20R2.15570 Cc1ccc(cc1)CCC(=O)c2ccc(cc2Br)Br 1458a_100000762965_100011713686 [1,0,0,0,0,0|3,0,0]=4 94 B20R2.15570 Cc1ccc(cc1)CCC(=O)c2ccc(cc2Br)Cl 1458a_100000766353_100011713686 [1,0,0,0,0,0|3,0,0]=4 95 B20R2.15570 Cc1ccc(cc1)CCC(=O)c2ccc(cc2Br)I 1458a_100012360512_100011713686 [1,0,0,0,0,0|3,0,0]=4 96 B20R2.15570 Cc1ccc(cc1)CCC(=O)c2ccc(cc2Cl)Br 1458a_100000741628_100011713686 [1,0,0,0,0,0|3,0,0]=4 97 B20R2.15570 Cc1ccc(cc1)CCC(=O)c2ccc(cc2Cl)Cl 1458a_100000185840_100011713686 [1,0,0,0,0,0|3,0,0]=4 98 B20R2.15570 Cc1ccc(cc1)CCC(=O)c2ccc(cc2Cl)I 1458a_100000751301_100011713686 [1,0,0,0,0,0|3,0,0]=4 99 B20R2.15570 Cc1ccc(cc1)CCC(=O)c2ccc(cc2I)Br 1458a_100000751167_100011713686 [1,0,0,0,0,0|3,0,0]=4 100 B20R2.15570 Cc1ccc(cc1)CCC(=O)c2ccc(cc2I)Cl 1458a_100000739380_100011713686 [1,0,0,0,0,0|3,0,0]=4 101 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2Br)Br 1458a_100000762965_100011740612 [1,0,0,0,0,0|3,0,0]=4 102 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2Br)Cl 1458a_100000766353_100011740612 [1,0,0,0,0,0|3,0,0]=4 103 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2Br)F 1458a_100000212304_100011740612 [1,0,0,0,0,0|3,0,0]=4 104 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2Br)I 1458a_100012360512_100011740612 [1,0,0,0,0,0|3,0,0]=4 105 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2Cl)Br 1458a_100000741628_100011740612 [1,0,0,0,0,0|3,0,0]=4 106 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2Cl)Cl 1458a_100000185840_100011740612 [1,0,0,0,0,0|3,0,0]=4 107 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2Cl)F 1458a_100000211397_100011740612 [1,0,0,0,0,0|3,0,0]=4 108 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2Cl)I 1458a_100000751301_100011740612 [1,0,0,0,0,0|3,0,0]=4 109 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2F)Br 1458a_100000214689_100011740612 [1,0,0,0,0,0|3,0,0]=4 110 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2F)Cl 1458a_100000212326_100011740612 [1,0,0,0,0,0|3,0,0]=4 111 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2F)I 1458a_100000037189_100011740612 [1,0,0,0,0,0|3,0,0]=4 112 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2I)Br 1458a_100000751167_100011740612 [1,0,0,0,0,0|3,0,0]=4 113 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2I)Cl 1458a_100000739380_100011740612 [1,0,0,0,0,0|3,0,0]=4 114 B20R2.15570 O=C(CCc1ccc(cc1)Br)c2ccc(cc2I)F 1458a_100000739341_100011740612 [1,0,0,0,0,0|3,0,0]=4 115 B20R2.15570 O=C(CCc1ccc(cc1)Cl)c2ccc(cc2Br)Br 1458a_100000762965_100011713675 [1,0,0,0,0,0|3,0,0]=4 116 B20R2.15570 O=C(CCc1ccc(cc1)Cl)c2ccc(cc2Br)Cl 1458a_100000766353_100011713675 [1,0,0,0,0,0|3,0,0]=4 117 B20R2.15570 O=C(CCc1ccc(cc1)Cl)c2ccc(cc2Br)F 1458a_100000212304_100011713675 [1,0,0,0,0,0|3,0,0]=4 118 B20R2.15570 O=C(CCc1ccc(cc1)Cl)c2ccc(cc2Br)I 1458a_100012360512_100011713675 [1,0,0,0,0,0|3,0,0]=4 119 B20R2.15570 O=C(CCc1ccc(cc1)Cl)c2ccc(cc2Cl)Br 1458a_100000741628_100011713675 [1,0,0,0,0,0|3,0,0]=4 120 B20R2.15570 O=C(CCc1ccc(cc1)Cl)c2ccc(cc2Cl)Cl 1458a_100000185840_100011713675 [1,0,0,0,0,0|3,0,0]=4 121 B20R2.15570 O=C(CCc1ccc(cc1)Cl)c2ccc(cc2Cl)I 1458a_100000751301_100011713675 [1,0,0,0,0,0|3,0,0]=4 122 B20R2.15570 O=C(CCc1ccc(cc1)Cl)c2ccc(cc2F)Br 1458a_100000214689_100011713675 [1,0,0,0,0,0|3,0,0]=4 123 B20R2.15570 O=C(CCc1ccc(cc1)Cl)c2ccc(cc2I)Br 1458a_100000751167_100011713675 [1,0,0,0,0,0|3,0,0]=4 124 B20R2.15570 O=C(CCc1ccc(cc1)Cl)c2ccc(cc2I)Cl 1458a_100000739380_100011713675 [1,0,0,0,0,0|3,0,0]=4 125 B20R2.15570 O=C(CCc1ccc(cc1)F)c2ccc(cc2Br)Br 1458a_100000762965_100011217392 [1,0,0,0,0,0|3,0,0]=4 126 B20R2.15570 O=C(CCc1ccc(cc1)F)c2ccc(cc2Br)Cl 1458a_100000766353_100011217392 [1,0,0,0,0,0|3,0,0]=4 127 B20R2.15570 O=C(CCc1ccc(cc1)F)c2ccc(cc2Br)I 1458a_100012360512_100011217392 [1,0,0,0,0,0|3,0,0]=4 128 B20R2.15570 O=C(CCc1ccc(cc1)F)c2ccc(cc2Cl)Br 1458a_100000741628_100011217392 [1,0,0,0,0,0|3,0,0]=4 129 B20R2.15570 O=C(CCc1ccc(cc1)F)c2ccc(cc2I)Br 1458a_100000751167_100011217392 [1,0,0,0,0,0|3,0,0]=4 130 B20R2.23087 Cc1cc(c(c(c1)Cl)C(=O)CCc2ccccc2)Cl 1458a_100009989429_100000765856 [1,0,0,0,0,0|3,0,0]=4 131 B20R2.23087 Cc1cc(c(c(c1)I)C(=O)CCc2ccccc2)I 1458a_200010371430_100000765856 [1,0,0,0,0,0|3,0,0]=4 132 B20R2.23087 Cc1cc(cc(c1C(=O)CCc2ccccc2)Cl)Br 1458a_100000698028_100000765856 [1,0,0,0,0,0|3,0,0]=4 133 B20R2.23087 O=C(CCc1ccccc1)c2c(cc(cc2Br)Br)Br 1458a_100011217931_100000765856 [1,0,0,0,0,0|3,0,0]=4 134 B20R2.23087 O=C(CCc1ccccc1)c2c(cc(cc2Br)Br)F 1458a_100009813784_100000765856 [1,0,0,0,0,0|3,0,0]=4 135 B20R2.23087 O=C(CCc1ccccc1)c2c(cc(cc2Br)Cl)F 1458a_100010244364_100000765856 [1,0,0,0,0,0|3,0,0]=4 136 B20R2.23087 O=C(CCc1ccccc1)c2c(cc(cc2Br)F)Br 1458a_200015320377_100000765856 [1,0,0,0,0,0|3,0,0]=4 137 B20R2.23087 O=C(CCc1ccccc1)c2c(cc(cc2Cl)Br)Cl 1458a_100012360385_100000765856 [1,0,0,0,0,0|3,0,0]=4 138 B20R2.23087 O=C(CCc1ccccc1)c2c(cc(cc2Cl)Br)F 1458a_100010078411_100000765856 [1,0,0,0,0,0|3,0,0]=4 139 B20R2.23087 O=C(CCc1ccccc1)c2c(cc(cc2Cl)Cl)Cl 1458a_100011215713_100000765856 [1,0,0,0,0,0|3,0,0]=4 140 B20R2.23087 O=C(CCc1ccccc1)c2c(cc(cc2Cl)I)Cl 1458a_100010740244_100000765856 [1,0,0,0,0,0|3,0,0]=4 141 B20R2.237947 Cc1ccc(cc1)CCC(=O)c2c(cccc2Br)Br 1458a_100000690891_100011713686 [1,0,0,0,0,0|3,0,0]=4 142 B20R2.237947 Cc1ccc(cc1)CCC(=O)c2c(cccc2Br)Cl 1458a_100011253703_100011713686 [1,0,0,0,0,0|3,0,0]=4 143 B20R2.237947 Cc1ccc(cc1)CCC(=O)c2c(cccc2Cl)Cl 1458a_100000210656_100011713686 [1,0,0,0,0,0|3,0,0]=4 144 B20R2.237947 Cc1ccc(cc1)CCC(=O)c2c(cccc2I)Br 1458a_100010232521_100011713686 [1,0,0,0,0,0|3,0,0]=4 145 B20R2.237947 Cc1ccc(cc1)CCC(=O)c2c(cccc2I)Cl 1458a_100000702859_100011713686 [1,0,0,0,0,0|3,0,0]=4 146 B20R2.237947 Cc1cccc(c1C(=O)CCc2ccc(cc2)Br)Br 1458a_100000701904_100011740612 [1,0,0,0,0,0|3,0,0]=4 147 B20R2.237947 Cc1cccc(c1C(=O)CCc2ccc(cc2)Br)Cl 1458a_100000692601_100011740612 [1,0,0,0,0,0|3,0,0]=4 148 B20R2.237947 Cc1cccc(c1C(=O)CCc2ccc(cc2)Br)I 1458a_100000688020_100011740612 [1,0,0,0,0,0|3,0,0]=4 149 B20R2.237947 Cc1cccc(c1C(=O)CCc2ccc(cc2)Cl)Br 1458a_100000701904_100011713675 [1,0,0,0,0,0|3,0,0]=4 150 B20R2.237947 Cc1cccc(c1C(=O)CCc2ccc(cc2)Cl)Cl 1458a_100000692601_100011713675 [1,0,0,0,0,0|3,0,0]=4 151 B20R2.237947 Cc1cccc(c1C(=O)CCc2ccc(cc2)Cl)I 1458a_100000688020_100011713675 [1,0,0,0,0,0|3,0,0]=4 152 B20R2.237947 O=C(CCc1ccc(cc1)Br)c2c(cccc2Br)Br 1458a_100000690891_100011740612 [1,0,0,0,0,0|3,0,0]=4 153 B20R2.237947 O=C(CCc1ccc(cc1)Br)c2c(cccc2Br)Cl 1458a_100011253703_100011740612 [1,0,0,0,0,0|3,0,0]=4 154 B20R2.237947 O=C(CCc1ccc(cc1)Br)c2c(cccc2Br)F 1458a_100000752694_100011740612 [1,0,0,0,0,0|3,0,0]=4 155 B20R2.237947 O=C(CCc1ccc(cc1)Br)c2c(cccc2Cl)Cl 1458a_100000210656_100011740612 [1,0,0,0,0,0|3,0,0]=4 156 B20R2.237947 O=C(CCc1ccc(cc1)Br)c2c(cccc2Cl)F 1458a_100000210369_100011740612 [1,0,0,0,0,0|3,0,0]=4 157 B20R2.237947 O=C(CCc1ccc(cc1)Br)c2c(cccc2I)Br 1458a_100010232521_100011740612 [1,0,0,0,0,0|3,0,0]=4 158 B20R2.237947 O=C(CCc1ccc(cc1)Br)c2c(cccc2I)Cl 1458a_100000702859_100011740612 [1,0,0,0,0,0|3,0,0]=4 159 B20R2.237947 O=C(CCc1ccc(cc1)Br)c2c(cccc2I)F 1458a_100000023732_100011740612 [1,0,0,0,0,0|3,0,0]=4 160 B20R2.237947 O=C(CCc1ccc(cc1)Cl)c2c(cccc2Br)Br 1458a_100000690891_100011713675 [1,0,0,0,0,0|3,0,0]=4 161 B20R2.237947 O=C(CCc1ccc(cc1)Cl)c2c(cccc2Br)Cl 1458a_100011253703_100011713675 [1,0,0,0,0,0|3,0,0]=4 162 B20R2.237947 O=C(CCc1ccc(cc1)Cl)c2c(cccc2Br)F 1458a_100000752694_100011713675 [1,0,0,0,0,0|3,0,0]=4 163 B20R2.237947 O=C(CCc1ccc(cc1)Cl)c2c(cccc2Cl)Cl 1458a_100000210656_100011713675 [1,0,0,0,0,0|3,0,0]=4 164 B20R2.237947 O=C(CCc1ccc(cc1)Cl)c2c(cccc2I)Br 1458a_100010232521_100011713675 [1,0,0,0,0,0|3,0,0]=4 165 B20R2.237947 O=C(CCc1ccc(cc1)Cl)c2c(cccc2I)Cl 1458a_100000702859_100011713675 [1,0,0,0,0,0|3,0,0]=4 166 B20R2.237947 O=C(CCc1ccc(cc1)F)c2c(cccc2Br)Br 1458a_100000690891_100011217392 [1,0,0,0,0,0|3,0,0]=4 167 B20R2.237947 O=C(CCc1ccc(cc1)F)c2c(cccc2Br)Cl 1458a_100011253703_100011217392 [1,0,0,0,0,0|3,0,0]=4 168 B20R2.237947 O=C(CCc1ccc(cc1)F)c2c(cccc2I)Br 1458a_100010232521_100011217392 [1,0,0,0,0,0|3,0,0]=4 169 B22R2.13540 COc1cc(cc(c1C(=O)CCc2ccc(cc2)Br)F)Br 1458a_100010734140_100011740612 [0,1,0,0,0,0|3,0,0]=4 170 B22R2.13540 COc1cc(cc(c1C(=O)CCc2ccc(cc2)Cl)F)Br 1458a_100010734140_100011713675 [0,1,0,0,0,0|3,0,0]=4 171 B22R2.177013 C=Cc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100000142037 [0,1,0,0,0,0|3,0,0]=4 172 B22R2.177013 COc1ccc(cc1)CCC(=O)c2c(cc(cc2Br)Br)Br 1458a_100011217931_100000184700 [0,1,0,0,0,0|3,0,0]=4 173 B22R2.177013 COc1ccc(cc1)CCC(=O)c2c(cc(cc2Br)Br)F 1458a_100009813784_100000184700 [0,1,0,0,0,0|3,0,0]=4 174 B22R2.177013 COc1ccc(cc1)CCC(=O)c2c(cc(cc2Br)Cl)F 1458a_100010244364_100000184700 [0,1,0,0,0,0|3,0,0]=4 175 B22R2.177013 COc1ccc(cc1)CCC(=O)c2c(cc(cc2Br)F)Br 1458a_200015320377_100000184700 [0,1,0,0,0,0|3,0,0]=4 176 B22R2.177013 COc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)Br)C 1458a_100000698028_100000184700 [0,1,0,0,0,0|3,0,0]=4 177 B22R2.177013 COc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)Br)Cl 1458a_100012360385_100000184700 [0,1,0,0,0,0|3,0,0]=4 178 B22R2.177013 COc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)Br)F 1458a_100010078411_100000184700 [0,1,0,0,0,0|3,0,0]=4 179 B22R2.177013 COc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)C)Cl 1458a_100009989429_100000184700 [0,1,0,0,0,0|3,0,0]=4 180 B22R2.177013 COc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)Cl)Cl 1458a_100011215713_100000184700 [0,1,0,0,0,0|3,0,0]=4 181 B22R2.177013 COc1ccc(cc1)CCC(=O)c2c(cc(cc2Cl)I)Cl 1458a_100010740244_100000184700 [0,1,0,0,0,0|3,0,0]=4 182 B22R2.177013 COc1ccc(cc1)CCC(=O)c2c(cc(cc2I)C)I 1458a_200010371430_100000184700 [0,1,0,0,0,0|3,0,0]=4 183 B22R2.177013 O=C(NCc1ccc(cc1)CO)c2c(cc(cc2O)O)O 527a_100015189231_100000040092 [0,1,0,0,0,0|1,0,0]=2 184 B22R2.524511 O=C(CCc1ccc(cc1)O)c2c(cc(c(c2Br)O)Br)Br 1458a_100009813419_100009816426 [0,1,0,0,0,0|3,0,0]=4 185 B22R2.524511 O=C(CCc1ccc(cc1)O)c2c(cc(c(c2I)I)I)I 1458a_100102586059_100009816426 [0,1,0,0,0,0|3,0,0]=4 186 B22R2.524511 O=C(CCc1ccc(cc1)O)c2c(cc(c(c2I)O)I)I 1458a_200000042944_100009816426 [0,1,0,0,0,0|3,0,0]=4 187 B22R2.4081717 Cc1cc(c(c(c1)O)C(=O)CCc2ccc(cc2Br)Cl)C 1458a_100011255216_200012945151 [0,1,0,0,0,0|3,0,0]=4 188 B22R2.4081717 Cc1cc(c(c(c1)O)C(=O)CCc2ccc(cc2Cl)Cl)C 1458a_100011255216_200012161198 [0,1,0,0,0,0|3,0,0]=4 189 B22R2.4081717 Cc1cc(cc(c1C(=O)CCc2ccc(cc2Br)Cl)C)O 1458a_100000066486_200012945151 [0,1,0,0,0,0|3,0,0]=4 190 B22R2.4081717 Cc1cc(cc(c1C(=O)CCc2ccc(cc2Cl)Cl)C)O 1458a_100000066486_200012161198 [0,1,0,0,0,0|3,0,0]=4 191 B22R2.4081717 O=C(CCc1ccc(cc1Br)Cl)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_200012945151 [0,1,0,0,0,0|3,0,0]=4 192 B22R2.4081717 O=C(CCc1ccc(cc1Br)Cl)c2c(cc(cc2F)Br)O 1458a_200015963038_200012945151 [0,1,0,0,0,0|3,0,0]=4 193 B22R2.4081717 O=C(CCc1ccc(cc1Cl)Cl)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_200012161198 [0,1,0,0,0,0|3,0,0]=4 194 B22R2.4081717 O=C(CCc1ccc(cc1Cl)Cl)c2c(cc(cc2F)Br)O 1458a_200015963038_200012161198 [0,1,0,0,0,0|3,0,0]=4 195 B22R2.4081717 O=C(NCc1ccc(cc1Cl)O)c2c(cc(cc2O)O)O 527a_200161156549_100000040092 [0,1,0,0,0,0|1,0,0]=2 196 B22R2.8237677 Cc1cc(c(c(c1)I)C(=O)CCc2ccc(c(c2)O)O)I 1458a_200010371430_200010393615 [0,1,0,0,0,0|3,0,0]=4 197 B22R2.8237677 Cc1cc(c(c(c1)O)C(=O)CCc2ccc(c(c2)Cl)Cl)C 1458a_100011255216_100011713676 [0,1,0,0,0,0|3,0,0]=4 198 B22R2.8237677 Cc1cc(cc(c1C(=O)CCc2ccc(c(c2)Cl)Cl)C)O 1458a_100000066486_100011713676 [0,1,0,0,0,0|3,0,0]=4 199 B22R2.8237677 O=C(CCc1ccc(c(c1)Cl)Cl)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100011713676 [0,1,0,0,0,0|3,0,0]=4 200 B22R2.8237677 O=C(CCc1ccc(c(c1)Cl)Cl)c2c(cc(cc2F)Br)O 1458a_200015963038_100011713676 [0,1,0,0,0,0|3,0,0]=4 201 B22R2.8237677 O=C(CCc1ccc(c(c1)Cl)F)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100012361305 [0,1,0,0,0,0|3,0,0]=4 202 B22R2.8237677 O=C(CCc1ccc(c(c1)O)O)c2c(cc(cc2Br)Br)Br 1458a_100011217931_200010393615 [0,1,0,0,0,0|3,0,0]=4 203 B22R2.8237677 O=C(NCc1ccc(c(c1)F)O)c2c(cc(cc2O)O)O 527a_100000758358_100000040092 [0,1,0,0,0,0|1,0,0]=2 204 B22R2.8237677 O=C(NCc1ccc(c(c1)O)Cl)c2c(cc(cc2O)O)O 527a_100020636435_100000040092 [0,1,0,0,0,0|2,0,0]=3 205 B22R2.8237677 O=C(NCc1ccc(c(c1)O)F)c2c(cc(cc2O)O)O 527a_100160469508_100000040092 [0,1,0,0,0,0|2,0,0]=3 206 B22R2.8242512 Cc1cc(c(c(c1)I)C(=O)NCCc2ccc(cc2)O)I 240690a_100000743037_200010371430 [0,0,0,0,0,1|3,0,0]=4 207 B22R2.8242512 Cc1cc(c(c(c1)I)C(=O)NCCc2ccc(cc2)O)I 527a_100000743037_200010371430 [0,0,0,0,0,1|3,0,0]=4 208 B22R2.8242512 O=C(CCCc1ccc(cc1)Br)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100011713682 [0,0,0,0,0,1|3,0,0]=4 209 B22R2.8242512 O=C(CCCc1ccc(cc1)Br)c2c(cc(cc2F)Br)O 1458a_200015963038_100011713682 [0,0,0,0,0,1|3,0,0]=4 210 B22R2.8242512 O=C(CCCc1ccc(cc1)Cl)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100000759440 [0,0,0,0,0,1|3,0,0]=4 211 B22R2.8242512 O=C(CCCc1ccc(cc1)Cl)c2c(cc(cc2F)Br)O 1458a_200015963038_100000759440 [0,0,0,0,0,1|3,0,0]=4 212 B22R2.8242512 O=C(CCCc1ccc(cc1)F)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_200011713563 [0,0,0,0,0,1|3,0,0]=4 213 B22R2.8242512 O=C(CCOc1ccc(cc1)Br)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100000183278 [0,0,0,0,0,1|3,0,0]=4 214 B22R2.8242512 O=C(CCOc1ccc(cc1)Cl)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100000184122 [0,0,0,0,0,1|3,0,0]=4 215 B22R2.8242512 O=C(NCCc1ccc(cc1)O)c2c(cc(cc2O)O)O 527a_100000743037_100000040092 [0,0,0,0,0,1|0,0,0]=1 216 B22R2.8264761 O=C(CCc1ccc(cc1)Br)Nc2c(cc(cc2Br)Cl)O 527a_100015696055_100000217147 [0,0,0,0,0,1|3,0,0]=4 217 B22R2.8264761 O=C(CCc1ccc(cc1)Br)Nc2c(cc(cc2Br)O)Br 527a_200010887395_100000217147 [0,0,0,0,0,1|3,0,0]=4 218 B22R2.8264761 O=C(CCc1ccc(cc1)Cl)Nc2c(cc(cc2Br)Cl)O 527a_100015696055_100000235379 [0,0,0,0,0,1|3,0,0]=4 219 B22R2.8264761 O=C(CCc1ccc(cc1)Cl)Nc2c(cc(cc2Br)O)Br 527a_200010887395_100000235379 [0,0,0,0,0,1|3,0,0]=4 220 B22R2.8264761 O=C(CCc1ccc(cc1)I)Nc2c(cc(cc2Br)O)Br 527a_200010887395_100011217499 [0,0,0,0,0,1|3,0,0]=4 221 B22R2.8264761 O=C(CCc1ccc(cc1)O)Cc2c(cc(cc2Cl)Cl)Cl 1458a_100000742835_100012339996 [0,0,0,0,0,1|3,0,0]=4 222 B19R2.4531 O=C(CCc1ccccc1)c2ccc(cc2Br)Br 1458a_100000762965_100000765856 [2,0,0,0,0,0|2,0,0]=4 223 B19R2.11870 O=C(CCc1ccc(cc1)Br)c2ccc(cc2)Br 1458a_100000185839_100011740612 [2,0,0,0,0,0|2,0,0]=4 224 B19R2.12083 O=C(CCc1ccc(cc1)Br)c2ccccc2Br 1458a_100000188424_100011740612 [2,0,0,0,0,0|2,0,0]=4 225 B19R2.61554 O=C(CCc1ccccc1)c2c(cccc2Br)Br 1458a_100000690891_100000765856 [2,0,0,0,0,0|2,0,0]=4 226 B21R2.3861 COc1ccc(c(c1)Br)C(=O)CCc2ccc(cc2)Br 1458a_100000748873_100011740612 [1,1,0,0,0,0|2,0,0]=4 227 B21R2.6385 COc1ccc(cc1)CCC(=O)c2ccc(cc2Br)Br 1458a_100000762965_100000184700 [1,1,0,0,0,0|2,0,0]=4 228 B21R2.19474 O=C(CCc1ccc(cc1)O)c2ccc(c(c2Cl)Br)Cl 1458a_100010208263_100009816426 [1,1,0,0,0,0|2,0,0]=4 229 B21R2.19474 O=C(CCc1ccc(cc1)O)c2ccc(c(c2Cl)Cl)Br 1458a_200012347731_100009816426 [1,1,0,0,0,0|2,0,0]=4 230 B21R2.43005 COc1cc(ccc1C(=O)CCc2ccc(cc2)Br)Br 1458a_100000748230_100011740612 [1,1,0,0,0,0|2,0,0]=4 231 B21R2.108767 O=C(CCc1ccc(cc1Br)Cl)c2ccc(cc2Br)O 1458a_100012344906_200012945151 [1,1,0,0,0,0|2,0,0]=4 232 B21R2.108767 O=C(CCc1ccc(cc1Br)Cl)c2ccc(cc2Cl)O 1458a_100000702456_200012945151 [1,1,0,0,0,0|2,0,0]=4 233 B21R2.108767 O=C(CCc1ccc(cc1Br)Cl)c2ccc(cc2O)Br 1458a_100000744433_200012945151 [1,1,0,0,0,0|2,0,0]=4 234 B21R2.108767 O=C(CCc1ccc(cc1Br)Cl)c2ccc(cc2O)Cl 1458a_100000188622_200012945151 [1,1,0,0,0,0|2,0,0]=4 235 B21R2.108767 O=C(CCc1ccc(cc1Br)Cl)c2ccc(cc2O)I 1458a_100000091984_200012945151 [1,1,0,0,0,0|2,0,0]=4 236 B21R2.108767 O=C(CCc1ccc(cc1Cl)Cl)c2ccc(cc2Br)O 1458a_100012344906_200012161198 [1,1,0,0,0,0|2,0,0]=4 237 B21R2.108767 O=C(CCc1ccc(cc1Cl)Cl)c2ccc(cc2Cl)O 1458a_100000702456_200012161198 [1,1,0,0,0,0|2,0,0]=4 238 B21R2.108767 O=C(CCc1ccc(cc1Cl)Cl)c2ccc(cc2O)Br 1458a_100000744433_200012161198 [1,1,0,0,0,0|2,0,0]=4 239 B21R2.108767 O=C(CCc1ccc(cc1Cl)Cl)c2ccc(cc2O)Cl 1458a_100000188622_200012161198 [1,1,0,0,0,0|2,0,0]=4 240 B21R2.108767 O=C(CCc1ccc(cc1Cl)Cl)c2ccc(cc2O)I 1458a_100000091984_200012161198 [1,1,0,0,0,0|2,0,0]=4 241 B21R2.108767 O=C(CNc1ccc(cc1O)O)c2ccc(cc2O)O 34a_100000106777_100009814262 [1,1,0,0,0,0|1,0,0]=3 242 B21R2.784816 Cc1cc(c(cc1Br)C(=O)CCc2ccc(cc2)Br)O 1458a_100010233826_100011740612 [1,1,0,0,0,0|2,0,0]=4 243 B21R2.784816 O=C(CCc1ccc(cc1)Br)c2cc(c(cc2O)Cl)Br 1458a_200009814723_100011740612 [1,1,0,0,0,0|2,0,0]=4 244 B21R2.784816 O=C(CCc1ccc(cc1)Cl)c2cc(c(cc2O)Cl)Br 1458a_200009814723_100011713675 [1,1,0,0,0,0|2,0,0]=4 245 B21R2.784816 O=C(CCc1ccc(cc1)O)c2cc(c(cc2Cl)Br)Cl 1458a_100000246132_100009816426 [1,1,0,0,0,0|2,0,0]=4 246 B21R2.784816 O=C(CCc1ccc(cc1)O)c2cc(c(cc2Cl)Cl)Cl 1458a_100011934218_100009816426 [1,1,0,0,0,0|2,0,0]=4 247 B21R2.4619134 O=C(CCc1ccc(c(c1)Cl)Cl)c2ccc(cc2Br)O 1458a_100012344906_100011713676 [1,1,0,0,0,0|2,0,0]=4 248 B21R2.4619134 O=C(CCc1ccc(c(c1)Cl)Cl)c2ccc(cc2Cl)O 1458a_100000702456_100011713676 [1,1,0,0,0,0|2,0,0]=4 249 B21R2.4619134 O=C(CCc1ccc(c(c1)Cl)Cl)c2ccc(cc2O)Br 1458a_100000744433_100011713676 [1,1,0,0,0,0|2,0,0]=4 250 B21R2.4619134 O=C(CCc1ccc(c(c1)Cl)Cl)c2ccc(cc2O)Cl 1458a_100000188622_100011713676 [1,1,0,0,0,0|2,0,0]=4 251 B21R2.4619134 O=C(CCc1ccc(c(c1)Cl)Cl)c2ccc(cc2O)I 1458a_100000091984_100011713676 [1,1,0,0,0,0|2,0,0]=4 252 B21R2.4619134 O=C(CNc1ccc(c(c1)O)O)c2ccc(cc2O)O 34a_100102946323_100009814262 [1,1,0,0,0,0|1,0,0]=3 253 B21R2.29924 CC(CC(=O)c1c(cc(cc1Cl)O)Cl)c2ccccc2 1458a_100010423397_100000756946 [1,1,0,0,0,0|2,0,0]=4 254 B21R2.3275295 O=C(CCc1ccccc1Br)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100012161201 [1,1,0,0,0,0|2,0,0]=4 255 B21R2.3275295 O=C(CCc1ccccc1Cl)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100011713703 [1,1,0,0,0,0|2,0,0]=4 256 B21R2.3275295 O=C(NCc1ccccc1O)c2c(cc(cc2O)O)O 527a_100000185550_100000040092 [1,1,0,0,0,0|1,0,0]=3 257 B21R2.4586690 O=C(CCc1cccc(c1)Br)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100011740638 [1,1,0,0,0,0|2,0,0]=4 258 B21R2.4586690 O=C(CCc1cccc(c1)Cl)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100011713710 [1,1,0,0,0,0|2,0,0]=4 259 B21R2.4586690 O=C(NCc1cccc(=O)[nH]1)c2c(cc(cc2O)O)O 527a_100000696482_100000040092 [1,1,0,0,0,0|2,0,0]=4 260 B21R2.4586690 O=C(NCc1cccc(c1)O)c2c(cc(cc2O)O)O 527a_100000743036_100000040092 [1,1,0,0,0,0|1,0,0]=3 261 B21R2.4586690 O=C(NCc1ccnc(c1)O)c2c(cc(cc2O)O)O 527a_100000748557_100000040092 [1,1,0,0,0,0|2,0,0]=4 262 B21R2.126982 COc1ccc(cc1)CCC(=O)c2c(cccc2Br)Br 1458a_100000690891_100000184700 [1,1,0,0,0,0|2,0,0]=4 263 B21R2.362230 O=C(CCc1ccc(cc1)Br)c2c(ccc(c2O)Cl)Cl 1458a_100011255222_100011740612 [1,1,0,0,0,0|2,0,0]=4 264 B21R2.362230 O=C(CCc1ccc(cc1)Cl)c2c(ccc(c2O)Cl)Cl 1458a_100011255222_100011713675 [1,1,0,0,0,0|2,0,0]=4 265 B21R2.362230 O=C(CCc1ccc(cc1)O)c2c(ccc(c2Cl)Br)Cl 1458a_100012350121_100009816426 [1,1,0,0,0,0|2,0,0]=4 266 B21R2.362230 O=C(CCc1ccc(cc1)O)c2c(ccc(c2Cl)Cl)Cl 1458a_100000182695_100009816426 [1,1,0,0,0,0|2,0,0]=4 267 B21R2.459857 COc1cccc(c1C(=O)CCc2ccc(cc2)Br)Br 1458a_100011593405_100011740612 [1,1,0,0,0,0|2,0,0]=4 268 B21R2.3284841 O=C(CCc1ccc(cc1Br)Cl)c2c(cccc2Br)O 1458a_100011935254_200012945151 [1,1,0,0,0,0|2,0,0]=4 269 B21R2.3284841 O=C(CCc1ccc(cc1Br)Cl)c2c(cccc2Cl)O 1458a_100000745519_200012945151 [1,1,0,0,0,0|2,0,0]=4 270 B21R2.3284841 O=C(CCc1ccc(cc1Cl)Cl)c2c(cccc2Br)O 1458a_100011935254_200012161198 [1,1,0,0,0,0|2,0,0]=4 271 B21R2.3284841 O=C(CCc1ccc(cc1Cl)Cl)c2c(cccc2Cl)O 1458a_100000745519_200012161198 [1,1,0,0,0,0|2,0,0]=4 272 B21R2.3544594 O=C(CCc1ccc(c(c1)Cl)Cl)c2c(cccc2Br)O 1458a_100011935254_100011713676 [1,1,0,0,0,0|2,0,0]=4 273 B21R2.3544594 O=C(CCc1ccc(c(c1)Cl)Cl)c2c(cccc2Cl)O 1458a_100000745519_100011713676 [1,1,0,0,0,0|2,0,0]=4 274 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]=4 275 B21R2.361242 Cc1cc(ccc1O)NC(=O)c2c(cc(cc2O)O)O 527a_100011218179_100000040092 [0,1,0,0,1,0|1,0,0]=3 276 B21R2.361242 Cc1ccc(cc1O)NC(=O)c2c(cc(cc2O)O)O 527a_100000759471_100000040092 [0,1,0,0,1,0|2,0,0]=4 277 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]=3 278 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]=3 279 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]=4 280 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]=3 281 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]=4 282 B21R2.4623548 Cc1cc(ccc1NC(=O)c2c(cc(cc2O)O)O)O 527a_100000756630_100000040092 [0,1,0,0,1,0|1,0,0]=3 283 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]=4 284 B21R2.4623548 O=C(Nc1ccc(cc1Br)O)c2c(cc(cc2O)O)O 527a_100012001276_100000040092 [0,1,0,0,1,0|1,0,0]=3 285 B21R2.4623548 O=C(Nc1ccc(cc1Cl)O)c2c(cc(cc2O)O)O 527a_100011215599_100000040092 [0,1,0,0,1,0|1,0,0]=3 286 B21R2.4623548 O=C(Nc1ccc(cc1F)O)c2c(cc(cc2O)O)O 527a_100000759473_100000040092 [0,1,0,0,1,0|1,0,0]=3 287 B21R2.4623548 O=C(Nc1ccc(cc1I)O)c2c(cc(cc2O)O)O 527a_100010084370_100000040092 [0,1,0,0,1,0|1,0,0]=3 288 B21R2.4623548 O=C(Nc1ccc(cc1O)Br)c2c(cc(cc2O)O)O 527a_100000739049_100000040092 [0,1,0,0,1,0|2,0,0]=4 289 B21R2.4623548 O=C(Nc1ccc(cc1O)Cl)c2c(cc(cc2O)O)O 527a_100000185728_100000040092 [0,1,0,0,1,0|2,0,0]=4 290 B21R2.4623548 O=C(Nc1ccc(cc1O)F)c2c(cc(cc2O)O)O 527a_100000753323_100000040092 [0,1,0,0,1,0|2,0,0]=4 291 B21R2.4623548 O=C(Nc1ccc(cc1O)I)c2c(cc(cc2O)O)O 527a_100000057187_100000040092 [0,1,0,0,1,0|2,0,0]=4 292 B21R2.4623548 O=C(Nc1ccc(cc1O)O)c2c(cc(cc2O)O)O 527a_100000106777_100000040092 [0,1,0,0,1,0|1,0,0]=3 293 B23R2.11785464 CC(CNC(=O)c1c(cc(cc1O)O)O)c2ccc(cc2)O 527a_200015188644_100000040092 [0,1,0,0,0,1|0,0,0]=2 294 B23R2.11785464 Cc1ccc(cc1)C(O)CNC(=O)c2c(cc(cc2O)O)O 527a_200020610344_100000040092 [0,1,0,0,0,1|1,0,0]=3 295 B23R2.11785464 O=C(NCC(O)c1ccc(cc1)Br)c2c(cc(cc2O)O)O 527a_100020626992_100000040092 [0,1,0,0,0,1|1,0,0]=3 296 B23R2.11785464 O=C(NCC(O)c1ccc(cc1)Cl)c2c(cc(cc2O)O)O 527a_100000736658_100000040092 [0,1,0,0,0,1|1,0,0]=3 297 B23R2.11813968 Cc1cc(c(c(c1)O)C(=O)NCCc2ccc(c(c2)O)O)O 527a_100000210387_100000036929 [0,1,0,0,0,1|1,0,0]=3 298 B23R2.11813968 O=C(NCCc1ccc(c(c1)O)O)c2c(cc(cc2O)O)O 527a_100000210387_100000040092 [0,1,0,0,0,1|0,0,0]=2 299 B23R2.11853957 CC(Cc1ccc(cc1)O)NC(=O)c2c(cc(cc2O)O)O 527a_100102634573_100000040092 [0,1,0,0,0,1|0,0,0]=2 300 B23R2.3017046 CC(O)c1ccc(cc1)CNC(=O)c2c(cc(cc2O)O)O 527a_200000048501_100000040092 [0,2,0,0,0,0|1,0,0]=3 301 B23R2.3017046 NC(=O)c1ccc(cc1)CNC(=O)c2c(cc(cc2O)O)O 527a_100000185037_100000040092 [0,2,0,0,0,0|1,0,1]=4 302 B23R2.22678440 COc1ccc(cc1O)CNC(=O)c2c(cc(cc2O)O)O 527a_100000740000_100000040092 [0,2,0,0,0,0|1,0,0]=3 303 B23R2.8970276 CCC(NC(=O)c1c(cc(cc1O)O)O)c2ccc(cc2)O 527a_100015187210_100000040092 [0,2,0,0,0,0|1,0,0]=3 304 B23R2.8970276 Cc1ccc(cc1)[C@H](CO)NC(=O)c2c(cc(cc2O)O)O 527a_100009818840_100000040092 [0,2,0,0,0,0|2,0,0]=4 305 B23R2.8970276 O=C(NC(CO)c1ccc(cc1)Br)c2c(cc(cc2O)O)O 527a_100000734186_100000040092 [0,2,0,0,0,0|2,0,0]=4 306 B23R2.8970276 O=C(NC(CO)c1ccc(cc1)F)c2c(cc(cc2O)O)O 527a_100000705410_100000040092 [0,2,0,0,0,0|2,0,0]=4 307 B23R2.8970276 O=C(N[C@H](CO)c1ccc(cc1)Cl)c2c(cc(cc2O)O)O 527a_100009818818_100000040092 [0,2,0,0,0,0|2,0,0]=4 308 B23R2.3384767 COc1cc(ccc1O)CNC(=O)c2c(cc(cc2O)O)O 527a_100000185554_100000040092 [0,2,0,0,0,0|1,0,0]=3 309 B19R2.228954 O=C(NCc1ccc[nH]1)c2c(cc(cc2O)O)O 527a_100000764082_100000040092 [1,0,0,0,1,0|2,0,0]=4 310 B21R2.97356 O=C(NCc1ccc(cc1)O)Nc2ccc(cc2O)O 2430a_100000106777_100000185549 [1,0,0,0,0,1|1,0,0]=3 311 B21R2.97356 O=C(NCc1ccc(cn1)O)Nc2ccc(cc2O)O 2430a_100000106777_100020605196 [1,0,0,0,0,1|2,0,0]=4 312 B21R2.97356 O=C(NCc1ccc(nc1)O)Nc2ccc(cc2O)O 2430a_100000106777_100000757128 [1,0,0,0,0,1|2,0,0]=4 313 B21R2.358849 O=C(CCCc1ccc(cc1)Br)c2ccc(cc2Br)O 1458a_100012344906_100011713682 [1,0,0,0,0,1|2,0,0]=4 314 B21R2.358849 O=C(CCCc1ccc(cc1)Br)c2ccc(cc2Cl)O 1458a_100000702456_100011713682 [1,0,0,0,0,1|2,0,0]=4 315 B21R2.358849 O=C(CCCc1ccc(cc1)Br)c2ccc(cc2O)Br 1458a_100000744433_100011713682 [1,0,0,0,0,1|2,0,0]=4 316 B21R2.358849 O=C(CCCc1ccc(cc1)Br)c2ccc(cc2O)Cl 1458a_100000188622_100011713682 [1,0,0,0,0,1|2,0,0]=4 317 B21R2.358849 O=C(CCCc1ccc(cc1)Cl)c2ccc(cc2Br)O 1458a_100012344906_100000759440 [1,0,0,0,0,1|2,0,0]=4 318 B21R2.358849 O=C(CCCc1ccc(cc1)Cl)c2ccc(cc2O)Br 1458a_100000744433_100000759440 [1,0,0,0,0,1|2,0,0]=4 319 B21R2.30165 O=C(CCSc1ccccc1)c2c(cc(cc2Cl)O)Cl 1458a_100010423397_100000246102 [1,0,0,0,0,1|2,0,0]=4 320 B21R2.772581 O=C(CCCc1ccc(cc1)Br)c2c(cccc2Br)O 1458a_100011935254_100011713682 [1,0,0,0,0,1|2,0,0]=4 321 B21R2.772581 O=C(CCCc1ccc(cc1)Br)c2c(cccc2Cl)O 1458a_100000745519_100011713682 [1,0,0,0,0,1|2,0,0]=4 322 B21R2.772581 O=C(CCCc1ccc(cc1)Cl)c2c(cccc2Br)O 1458a_100011935254_100000759440 [1,0,0,0,0,1|2,0,0]=4