0 B23R3.39735021 COc1ccc(cc1O)c2cc(c3ccc(cc3n2)N)C 271570a_100010199686_100000103534 [1,0,0,0,0,0|3,0,0]=4 1 B23R3.39741685 COc1ccc(cc1O)c2ccc3c(cc(=O)oc3c2)O 271570a_100010199686_100010062223 [1,0,0,0,0,0|2,0,1]=4 2 B23R2.3162624 CCc1ccc(cc1O)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000089006_100009814262 [0,0,1,0,0,0|1,0,2]=4 3 B23R2.3162624 COc1ccc(cc1Br)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000187947_100009814262 [0,0,1,0,0,0|1,0,2]=4 4 B23R2.3162624 COc1ccc(cc1Br)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000212172_100000185116 [0,0,1,0,0,0|1,0,2]=4 5 B23R2.3162624 COc1ccc(cc1C)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100011202886_100009814262 [0,0,1,0,0,0|1,0,2]=4 6 B23R2.3162624 COc1ccc(cc1Cl)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000188346_100009814262 [0,0,1,0,0,0|1,0,2]=4 7 B23R2.3162624 COc1ccc(cc1Cl)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000212172_100000198526 [0,0,1,0,0,0|1,0,2]=4 8 B23R2.3162624 COc1ccc(cc1F)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000186160_100009814262 [0,0,1,0,0,0|1,0,2]=4 9 B23R2.3162624 COc1ccc(cc1F)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000212172_100000195436 [0,0,1,0,0,0|1,0,2]=4 10 B23R2.3162624 COc1ccc(cc1I)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000188716_100009814262 [0,0,1,0,0,0|1,0,2]=4 11 B23R2.3162624 COc1ccc(cc1O)C(=O)CC(=O)c2ccc(cc2O)F 1458a_100000766810_100009817053 [0,0,1,0,0,0|1,0,2]=4 12 B23R2.3162624 COc1ccc(cc1O)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000766810_100009814262 [0,0,1,0,0,0|0,0,2]=3 13 B23R2.22678440 COc1ccc(cc1Br)CNC(=O)c2c(cc(cc2O)O)O 527a_100159240714_100000040092 [0,0,1,0,0,0|2,0,1]=4 14 B23R2.22678440 COc1ccc(cc1C)CNC(=O)c2c(cc(cc2O)O)O 527a_100102679029_100000040092 [0,0,1,0,0,0|2,0,1]=4 15 B23R2.22678440 COc1ccc(cc1Cl)CNC(=O)c2c(cc(cc2O)O)O 527a_100000008799_100000040092 [0,0,1,0,0,0|2,0,1]=4 16 B23R2.22678440 COc1ccc(cc1F)CNC(=O)c2c(cc(cc2O)O)O 527a_100000737316_100000040092 [0,0,1,0,0,0|2,0,1]=4 17 B23R2.22678440 COc1ccc(cc1O)CNC(=O)c2c(cc(cc2O)C)O 527a_100000740000_100000036929 [0,0,1,0,0,0|2,0,1]=4 18 B22R2.7219 COc1ccc(cc1)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000184203_100009814262 [1,0,1,0,0,0|0,0,2]=4 19 B22R2.7219 COc1ccc(cc1)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000212172_100000212054 [1,0,1,0,0,0|0,0,2]=4 20 B22R2.79744 COc1ccc(cc1O)C(=O)CC(=O)c2ccc(cc2)O 1458a_100000766810_100009814261 [1,0,1,0,0,0|0,0,2]=4 21 B22R2.2778766 COc1ccc(cc1O)C(=O)CC(=O)c2ccccc2O 1458a_100000766810_100000188908 [1,0,1,0,0,0|0,0,2]=4 22 B22R2.3175459 COc1ccc(cc1O)NCC(=O)c2ccc(cc2O)O 34a_100000211920_100009814262 [1,0,1,0,0,0|1,0,1]=4 23 B22R2.3175459 COc1ccc(cc1O)SCC(=O)c2ccc(cc2O)O 62a_100009814262_100009816560 [1,0,1,0,0,0|1,0,1]=4 24 B22R2.6164244 Cc1ccc(cc1O)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000233767_100009814262 [1,0,1,0,0,0|0,0,2]=4 25 B22R2.6164244 O=C(CC(=O)c1ccc(cc1O)O)c2ccc(c(c2)O)O 1458a_100000212155_100009814262 [1,0,1,0,0,0|0,0,2]=4 26 B22R2.6164244 O=C(CC(=O)c1ccc(cc1O)O)c2ccc(c(c2)O)O 1458a_100000212172_100000183813 [1,0,1,0,0,0|0,0,2]=4 27 B22R2.177013 COc1ccc(cc1)CNC(=O)c2c(cc(cc2O)O)O 527a_100000185587_100000040092 [1,0,1,0,0,0|1,0,1]=4 28 B22R2.14490867 COc1ccc(cc1O)CNC(=O)c2c(cccc2O)O 527a_100000740000_100000755285 [1,0,1,0,0,0|1,0,1]=4 29 B22R3.3096840 COc1ccc(cc1C)c2ccc3ccc(cc3c2)O 271570a_100011217508_100009816537 [2,0,0,0,0,0|2,0,0]=4 30 B22R3.3096840 COc1ccc(cc1C)c2ccc3ccc(cc3n2)O 271570a_100011217508_100000079174 [2,0,0,0,0,0|2,0,0]=4 31 B22R3.3096840 COc1ccc(cc1Cl)c2ccc3ccc(cc3c2)O 271570a_100011219321_100009816537 [2,0,0,0,0,0|2,0,0]=4 32 B22R3.3096840 COc1ccc(cc1Cl)c2ccc3ccc(cc3n2)O 271570a_100011219321_100000079174 [2,0,0,0,0,0|2,0,0]=4 33 B22R3.3096840 COc1ccc(cc1F)c2ccc3ccc(cc3c2)O 271570a_100000185479_100009816537 [2,0,0,0,0,0|2,0,0]=4 34 B22R3.3096840 COc1ccc(cc1F)c2ccc3ccc(cc3n2)O 271570a_100000185479_100000079174 [2,0,0,0,0,0|2,0,0]=4 35 B22R3.3096840 COc1ccc(cc1N)c2ccc3ccc(cc3c2)O 271570a_100010083021_100009816537 [2,0,0,0,0,0|2,0,0]=4 36 B22R3.3096840 COc1ccc(cc1N)c2ccc3ccc(cc3n2)O 271570a_100010083021_100000079174 [2,0,0,0,0,0|2,0,0]=4 37 B22R3.3096840 COc1ccc(cc1O)c2ccc3ccc(cc3c2)N 271570a_100010199686_100010090036 [2,0,0,0,0,0|2,0,0]=4 38 B22R3.3096840 COc1ccc(cc1O)c2ccc3ccc(cc3c2)O 271570a_100010199686_100009816537 [2,0,0,0,0,0|1,0,0]=3 39 B22R3.3096840 COc1ccc(cc1O)c2ccc3ccc(cc3n2)O 271570a_100010199686_100000079174 [2,0,0,0,0,0|1,0,0]=3 40 B22R3.3096840 COc1ccc(cc1O)c2ccc3ccc(nc3c2)O 271570a_100010199686_100000690401 [2,0,0,0,0,0|2,0,0]=4 41 B22R3.3096840 COc1ccc(cc1O)c2ccc3ccc(nc3n2)O 271570a_100010199686_200010218124 [2,0,0,0,0,0|2,0,0]=4 42 B22R3.3096840 COc1ccc(cc1O)c2ccc3cnc(cc3c2)O 271570a_100010199686_100009817130 [2,0,0,0,0,0|2,0,0]=4 43 B22R3.3096840 COc1ccc(cc1O)c2ccc3ncc(cc3c2)O 271570a_100010199686_100000703654 [2,0,0,0,0,0|2,0,0]=4 44 B22R3.3096840 COc1ccc(cc1O)c2cnc3ccc(cc3c2)O 271570a_100010199686_100010137430 [2,0,0,0,0,0|2,0,0]=4 45 B22R3.3096840 COc1ccc(cc1O)c2cnc3ccc(cc3n2)O 271570a_100010199686_200020640061 [2,0,0,0,0,0|2,0,0]=4 46 B22R3.3097244 COc1ccc(cc1C)c2cc(=O)c3ccccc3[nH]2 271570a_100011217508_100000090176 [2,0,0,0,0,0|2,0,0]=4 47 B22R3.3097244 COc1ccc(cc1Cl)c2cc(=O)c3ccccc3[nH]2 271570a_100011219321_100000090176 [2,0,0,0,0,0|2,0,0]=4 48 B22R3.3097244 COc1ccc(cc1F)c2cc(=O)c3ccccc3[nH]2 271570a_100000185479_100000090176 [2,0,0,0,0,0|2,0,0]=4 49 B22R3.3097244 COc1ccc(cc1N)c2cc(=O)c3ccccc3[nH]2 271570a_100010083021_100000090176 [2,0,0,0,0,0|2,0,0]=4 50 B22R3.3097244 COc1ccc(cc1O)c2cc(=O)c3ccccc3[nH]2 271570a_100010199686_100000090176 [2,0,0,0,0,0|1,0,0]=3 51 B22R3.3097244 COc1ccc(cc1O)c2cc(=O)n3ccccc3n2 271570a_100010199686_100000707704 [2,0,0,0,0,0|2,0,0]=4 52 B22R3.3097244 COc1ccc(cc1O)c2cc(c3ccccc3c2)N 271570a_100010199686_100010171453 [2,0,0,0,0,0|2,0,0]=4 53 B22R3.3097244 COc1ccc(cc1O)c2cc(c3ccccc3c2)O 271570a_100010199686_100010089979 [2,0,0,0,0,0|1,0,1]=4 54 B22R3.3097244 COc1ccc(cc1O)c2cc(c3ccccc3n2)C 271570a_100010199686_100012354972 [2,0,0,0,0,0|2,0,0]=4 55 B22R3.3097244 COc1ccc(cc1O)c2cc(c3ccccc3n2)N 271570a_100010199686_100010197925 [2,0,0,0,0,0|2,0,0]=4 56 B22R3.3097934 COc1ccc(cc1C)c2ccc3c(cccc3c2)O 271570a_100011217508_100010202202 [2,0,0,0,0,0|2,0,0]=4 57 B22R3.3097934 COc1ccc(cc1Cl)c2ccc3c(cccc3c2)O 271570a_100011219321_100010202202 [2,0,0,0,0,0|2,0,0]=4 58 B22R3.3097934 COc1ccc(cc1F)c2ccc3c(cccc3c2)O 271570a_100000185479_100010202202 [2,0,0,0,0,0|2,0,0]=4 59 B22R3.3097934 COc1ccc(cc1N)c2ccc3c(cccc3c2)O 271570a_100010083021_100010202202 [2,0,0,0,0,0|2,0,0]=4 60 B22R3.3097934 COc1ccc(cc1O)c2ccc3c(cccc3c2)N 271570a_100010199686_100010090037 [2,0,0,0,0,0|2,0,0]=4 61 B22R3.3097934 COc1ccc(cc1O)c2ccc3c(cccc3c2)O 271570a_100010199686_100010202202 [2,0,0,0,0,0|1,0,0]=3 62 B22R3.3097934 COc1ccc(cc1O)c2ccc3c(ccnc3c2)O 271570a_100010199686_100000756855 [2,0,0,0,0,0|2,0,0]=4 63 B22R3.3097934 COc1ccc(cc1O)c2ccc3c(nccc3c2)O 271570a_100010199686_100000760485 [2,0,0,0,0,0|2,0,0]=4 64 B24R2.3632651 COc1ccc(cc1OC)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000211223_100009814262 [0,1,1,0,0,0|0,0,2]=4 65 B24R2.3632651 COc1ccc(cc1OC)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000212172_100000184214 [0,1,1,0,0,0|0,0,2]=4 66 B24R2.20548981 COc1cc(c(cc1O)C(=O)CC(=O)c2ccc(cc2O)O)Br 1458a_100010074811_100009814262 [0,1,1,0,0,0|0,0,2]=4 67 B24R2.20677972 COc1ccc(c(c1O)O)C(=O)CC(=O)c2ccc(cc2O)O 1458a_100000045701_100009814262 [0,1,1,0,0,0|0,0,2]=4 68 B24R2.44951844 COc1c(cc(cc1Br)C(=O)CC(=O)c2ccc(cc2O)O)O 1458a_100010760816_100009814262 [0,1,1,0,0,0|0,0,2]=4 69 B24R2.44951844 COc1c(cc(cc1O)C(=O)CC(=O)c2ccc(cc2O)O)O 1458a_100000073573_100009814262 [0,1,1,0,0,0|0,0,2]=4 70 B24R2.26348860 COc1ccc(cc1O)CN(C)C(=O)c2c(cc(cc2O)O)O 527a_100000188468_100000040092 [0,1,1,0,0,0|1,0,1]=4 71 B24R2.145758130 COc1ccc(cc1OC)CNC(=O)c2c(cc(cc2O)O)O 527a_100000185555_100000040092 [0,1,1,0,0,0|1,0,1]=4 72 B24R3.373307477 COc1ccc2c(cc(nc2c1)c3ccc(c(c3)O)OC)C 271570a_100010199686_100000010170 [1,1,0,0,0,0|2,0,0]=4 73 B24R3.26723300 O=C(CC(=O)c1ccc(cc1O)O)c2ccc3c(c2)OCO3 1458a_100000210863_100009814262 [0,0,1,1,0,0|0,0,2]=4 74 B24R3.26723300 O=C(CC(=O)c1ccc(cc1O)O)c2ccc3c(c2)OCO3 1458a_100000212172_100000181162 [0,0,1,1,0,0|0,0,2]=4 75 B24R3.4937911 O=C(NCc1ccc2c(c1)OCO2)c3c(cc(cc3O)O)O 527a_100000210006_100000040092 [0,0,1,1,0,0|1,0,1]=4 76 B22R2.2778269 COc1ccc(cc1Br)NC(=O)c2c(cc(cc2O)O)O 527a_100000187427_100000040092 [0,0,1,0,1,0|2,0,0]=4 77 B22R2.2778269 COc1ccc(cc1C)NC(=O)c2c(cc(cc2O)O)O 527a_100000743268_100000040092 [0,0,1,0,1,0|2,0,0]=4 78 B22R2.2778269 COc1ccc(cc1Cl)NC(=O)c2c(cc(cc2O)O)O 527a_100000211044_100000040092 [0,0,1,0,1,0|2,0,0]=4 79 B22R2.2778269 COc1ccc(cc1F)NC(=O)c2c(cc(cc2O)O)O 527a_100000740183_100000040092 [0,0,1,0,1,0|2,0,0]=4 80 B22R2.2778269 COc1ccc(cc1I)NC(=O)c2c(cc(cc2O)O)O 527a_100011356947_100000040092 [0,0,1,0,1,0|2,0,0]=4 81 B22R2.2778269 COc1ccc(cc1O)NC(=O)c2c(cc(cc2O)C)O 527a_100000211920_100000036929 [0,0,1,0,1,0|2,0,0]=4 82 B24R2.3634774 COc1ccc(cc1O)CC(=O)CC(=O)c2ccc(cc2O)O 1458a_100000049095_100009814262 [0,0,1,0,0,1|0,0,2]=4 83 B24R2.26352407 COc1ccc(cc1O)C=CC(=O)Nc2c(cc(cc2C)O)C 22a_100011934200_100000184920 [0,0,1,0,0,1|2,0,0]=4 84 B24R2.26352407 COc1ccc(cc1O)C=CC(=O)Nc2c(cc(cc2Cl)C)O 22a_100015906060_100000184920 [0,0,1,0,0,1|2,0,0]=4 85 B24R2.26352407 COc1ccc(cc1O)C=CC(=O)Nc2c(cc(cc2F)Br)O 22a_100015475841_100000184920 [0,0,1,0,0,1|2,0,0]=4 86 B24R2.26352407 COc1ccc(cc1O)C=CC(=O)Nc2c(cc(cc2F)Cl)O 22a_100010883250_100000184920 [0,0,1,0,0,1|2,0,0]=4 87 B24R2.26352407 COc1ccc(cc1O)C=CC(=O)Nc2c(cc(cc2F)F)O 22a_100011217947_100000184920 [0,0,1,0,0,1|2,0,0]=4 88 B24R2.26352407 COc1ccc(cc1O)C=CC(=O)Nc2c(cc(cc2O)Br)C 22a_100010371313_100000184920 [0,0,1,0,0,1|2,0,0]=4