0 B16R2.192589 COc1cc2nc([nH]c(=O)c2cc1O)C 271570a_203496583355_100160996886 [1,0,0,0,0,0|3,0,0]=4 1 B16R2.192589 COc1cc2oc(=O)cc(c2cc1Cl)C 7a_100000010825_200000210301 [1,0,0,0,0,0|3,0,0]=4 2 B16R2.192589 Cc1cc(=O)oc2c1cc(c(c2)O[13CH3])Cl 7a_100000010825_200025704644 [1,0,0,0,0,0|3,0,0]=4 3 B16R1.20117 C=C(C)CC(=O)c1ccc(c(c1C)C)OC 1458a_200000082569_100000748629 [0,0,1,0,0,0|2,0,1]=4 4 B16R1.20117 C=C(C)CC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100000748629 [0,0,1,0,0,0|2,0,1]=4 5 B16R1.20117 COc1ccc(c(c1C)C)C(=O)CC(C)O 1458a_200000082569_100011218427 [0,0,1,0,0,0|1,0,2]=4 6 B16R1.20117 COc1ccc(c(c1O)O)C(=O)CC(C)O 1458a_100000045701_100011218427 [0,0,1,0,0,0|1,0,2]=4 7 B15R1.717 COc1cc(c(c(c1)C=C(C)C)C=O)O 271570a_100102525489_100010762613 [1,0,1,0,0,0|1,0,1]=4 8 B15R1.1854 C=C(C)CC(=O)c1ccc(cc1O)OC 1458a_100000212123_100000748629 [1,0,1,0,0,0|1,0,1]=4 9 B15R1.1854 COc1ccc(c(c1)O)C(=O)CC(C)O 1458a_100000212123_100011218427 [1,0,1,0,0,0|0,0,2]=4 10 B15R1.1876 COc1ccc(c(c1C)C)C=CC(C)O 271570a_200011019289_100000049725 [1,0,1,0,0,0|1,0,1]=4 11 B15R1.3776 C=C(C)CC(=O)c1ccc(c(c1)C)OC 1458a_100011202886_100000748629 [1,0,1,0,0,0|1,0,1]=4 12 B15R1.3776 COc1ccc(cc1C)C(=O)CC(C)O 1458a_100011202886_100011218427 [1,0,1,0,0,0|0,0,2]=4 13 B15R1.8407 C=C(C)CC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_100000748629 [1,0,1,0,0,0|1,0,1]=4 14 B15R1.8407 Cc1ccc(c(c1C)O)C(=O)CC(C)O 1458a_100000742916_100011218427 [1,0,1,0,0,0|0,0,2]=4 15 B15R2.2708 COc1cc(c2ccc(=O)oc2c1)C 34a_100000029242_200000210301 [2,0,0,0,0,0|2,0,0]=4 16 B15R2.2708 COc1cc(c2ccc(=O)oc2c1)C 7a_100000029242_200000210301 [2,0,0,0,0,0|2,0,0]=4 17 B15R2.2708 Cc1cc(cc2c1ccc(=O)o2)O[13CH3] 34a_100000029242_200025704644 [2,0,0,0,0,0|2,0,0]=4 18 B15R2.2708 Cc1cc(cc2c1ccc(=O)o2)O[13CH3] 7a_100000029242_200025704644 [2,0,0,0,0,0|2,0,0]=4 19 B15R2.83901 COc1cc(c2c(c1)OCCC2=O)O 271570a_203496583355_200010284272 [2,0,0,0,0,0|0,0,2]=4 20 B15R2.89396 COc1ccc2c(cc(=O)oc2c1)C 34a_100000181958_200000210301 [2,0,0,0,0,0|2,0,0]=4 21 B15R2.89396 COc1ccc2c(cc(=O)oc2c1)C 7a_100000181958_200000210301 [2,0,0,0,0,0|2,0,0]=4 22 B15R2.89396 COc1ccc2c(cc(nc2c1)C)O 271570a_203496583355_100000044451 [2,0,0,0,0,0|1,0,1]=4 23 B15R2.89396 Cc1cc(=O)oc2c1ccc(c2)O[13CH3] 34a_100000181958_200025704644 [2,0,0,0,0,0|2,0,0]=4 24 B15R2.89396 Cc1cc(=O)oc2c1ccc(c2)O[13CH3] 7a_100000181958_200025704644 [2,0,0,0,0,0|2,0,0]=4 25 B17R2.139606 CCc1cc2c(cc(=O)oc2cc1OC)C 7a_100000008134_200000210301 [1,1,0,0,0,0|2,0,0]=4 26 B17R2.139606 CCc1cc2c(cc(=O)oc2cc1O[13CH3])C 7a_100000008134_200025704644 [1,1,0,0,0,0|2,0,0]=4 27 B17R1.28893 COc1ccc(c(c1C)C)C(=O)CC=C(C)C 1458a_200000082569_100000761012 [0,0,1,0,0,1|2,0,0]=4 28 B17R1.28893 COc1ccc(c(c1O)O)C(=O)CC=C(C)C 1458a_100000045701_100000761012 [0,0,1,0,0,1|2,0,0]=4 29 B17R1.48230 COc1ccc(c(c1C)C)NC(=O)C=C(C)C 11a_100025755787_100000211388 [0,0,1,0,0,1|2,0,0]=4 30 B17R1.48230 COc1ccc(c(c1C)C)NC(=O)C=C(C)C 1626a_100025755787_100000211388 [0,0,1,0,0,1|2,0,0]=4 31 B17R1.48230 COc1ccc(c(c1C)C)NC(=O)C=C(C)C 22a_100025755787_100000211388 [0,0,1,0,0,1|2,0,0]=4 32 B17R1.48230 COc1ccc(c(c1C)C)NC(=O)C=C(C)Cl 11a_100025755787_200042562850 [0,0,1,0,0,1|2,0,0]=4 33 B17R1.48230 COc1ccc(c(c1C)C)NC(=O)C=C(C)Cl 1626a_100025755787_200042562850 [0,0,1,0,0,1|2,0,0]=4 34 B17R1.48230 COc1ccc(c(c1C)C)NC(=O)C=C(C)Cl 22a_100025755787_200042562850 [0,0,1,0,0,1|2,0,0]=4 35 B17R1.48230 COc1ccc(c(c1C)C)NC(=O)C=C(C)I 11a_100025755787_100025716642 [0,0,1,0,0,1|2,0,0]=4 36 B17R1.48230 COc1ccc(c(c1C)C)NC(=O)C=C(C)I 1626a_100025755787_100025716642 [0,0,1,0,0,1|2,0,0]=4 37 B14R1.5317 CC=Cc1cc(cc(c1C=O)O)OC 271570a_100016259895_100010762613 [2,0,1,0,0,0|1,0,0]=4 38 B14R1.103 COc1ccc(c(c1)O)C=CC(C)O 271570a_200011019289_100000719091 [2,0,1,0,0,0|0,0,1]=4 39 B14R1.3653 COc1ccc(cc1C)C=CC(=O)C 1458a_100116352456_200000210301 [2,0,1,0,0,0|0,0,1]=4 40 B14R1.3653 COc1ccc(cc1C)C=CC(=O)[13CH3] 1458a_100116352456_200025704644 [2,0,1,0,0,0|0,0,1]=4 41 B14R1.3653 COc1ccc(cc1C)C=CC(C)O 271570a_200011019289_100011219705 [2,0,1,0,0,0|0,0,1]=4 42 B14R2.134 COc1ccc2ccc(=O)oc2c1 34a_100000185914_200000210301 [3,0,0,0,0,0|1,0,0]=4 43 B14R2.134 COc1ccc2ccc(=O)oc2c1 7a_100000185914_200000210301 [3,0,0,0,0,0|1,0,0]=4 44 B14R2.134 COc1ccc2ccc(cc2c1)C 34a_100000091598_200000210301 [3,0,0,0,0,0|1,0,0]=4 45 B14R2.134 COc1ccc2ccc(cc2c1)C 7a_100000091598_200000210301 [3,0,0,0,0,0|1,0,0]=4 46 B14R2.134 COc1ccc2ccc(nc2c1)C 34a_100009867695_200000210301 [3,0,0,0,0,0|1,0,0]=4 47 B14R2.134 COc1ccc2ccc(nc2c1)C 7a_100009867695_200000210301 [3,0,0,0,0,0|1,0,0]=4 48 B14R2.134 Cc1ccc2ccc(cc2c1)O[13CH3] 34a_100000091598_200025704644 [3,0,0,0,0,0|1,0,0]=4 49 B14R2.134 Cc1ccc2ccc(cc2c1)O[13CH3] 7a_100000091598_200025704644 [3,0,0,0,0,0|1,0,0]=4 50 B14R2.134 Cc1ccc2ccc(cc2n1)O[13CH3] 34a_100009867695_200025704644 [3,0,0,0,0,0|1,0,0]=4 51 B14R2.134 Cc1ccc2ccc(cc2n1)O[13CH3] 7a_100009867695_200025704644 [3,0,0,0,0,0|1,0,0]=4 52 B14R2.134 [13CH3]Oc1ccc2ccc(=O)oc2c1 34a_100000185914_200025704644 [3,0,0,0,0,0|1,0,0]=4 53 B14R2.134 [13CH3]Oc1ccc2ccc(=O)oc2c1 7a_100000185914_200025704644 [3,0,0,0,0,0|1,0,0]=4 54 B14R2.1128 COc1cc2ccccc2cc1C 34a_100000091601_200000210301 [3,0,0,0,0,0|1,0,0]=4 55 B14R2.1128 COc1cc2ccccc2cc1C 7a_100000091601_200000210301 [3,0,0,0,0,0|1,0,0]=4 56 B14R2.1128 Cc1cc2ccccc2cc1O[13CH3] 34a_100000091601_200025704644 [3,0,0,0,0,0|1,0,0]=4 57 B14R2.1128 Cc1cc2ccccc2cc1O[13CH3] 7a_100000091601_200025704644 [3,0,0,0,0,0|1,0,0]=4 58 B14R2.1019 COc1cc(c2ccccc2c1)O 271570a_203496583355_100010152498 [3,0,0,0,0,0|1,0,0]=4 59 B14R2.1019 COc1cc(c2cccnc2c1)O 271570a_203496583355_100010248855 [3,0,0,0,0,0|1,0,0]=4 60 B14R2.1801 COc1ccc2c(=O)ccoc2c1 34a_200000065989_200000210301 [3,0,0,0,0,0|0,0,0]=3 61 B14R2.1801 COc1ccc2c(=O)ccoc2c1 7a_200000065989_200000210301 [3,0,0,0,0,0|0,0,0]=3 62 B14R2.1801 CSc1ccc2c(=O)ccoc2c1 62a_200000210301_100010062221 [3,0,0,0,0,0|0,1,0]=4 63 B14R2.1801 [13CH3]Oc1ccc2c(=O)ccoc2c1 34a_200000065989_200025704644 [3,0,0,0,0,0|0,0,0]=3 64 B14R2.1801 [13CH3]Oc1ccc2c(=O)ccoc2c1 7a_200000065989_200025704644 [3,0,0,0,0,0|0,0,0]=3 65 B14R2.1801 [13CH3]Sc1ccc2c(=O)ccoc2c1 62a_200025704644_100010062221 [3,0,0,0,0,0|0,1,0]=4 66 B16R1.14558 COc1cc(c(c(c1C)OC)C(=O)C)OC 34a_200009990423_200000210301 [1,1,1,0,0,0|0,0,1]=4 67 B16R1.14558 COc1cc(c(c(c1C)OC)C(=O)C)OC 7a_200009990423_200000210301 [1,1,1,0,0,0|0,0,1]=4 68 B16R1.14558 COc1cc(c(c(c1C)O[13CH3])C(=O)C)OC 34a_200009990423_200025704644 [1,1,1,0,0,0|0,0,1]=4 69 B16R1.14558 COc1cc(c(c(c1C)O[13CH3])C(=O)C)OC 7a_200009990423_200025704644 [1,1,1,0,0,0|0,0,1]=4 70 B16R1.20144 COc1ccc(c(c1C)OC)C=CC(C)O 271570a_200011019289_100010234078 [1,1,1,0,0,0|0,0,1]=4 71 B16R1.1816 C/C=C/CC(=O)c1ccc(c(c1C)C)OC 1458a_200000082569_100102629194 [1,1,1,0,0,0|1,0,0]=4 72 B16R1.1816 C/C=C/CC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100102629194 [1,1,1,0,0,0|1,0,0]=4 73 B16R1.1816 CC=CCC(=O)c1ccc(c(c1C)C)OC 1458a_200000082569_100000070051 [1,1,1,0,0,0|1,0,0]=4 74 B16R1.1816 CC=CCC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100000070051 [1,1,1,0,0,0|1,0,0]=4 75 B16R1.1874 C/C=C/CC(=O)c1cc(c(cc1C)OC)C 1458a_100011996352_100102629194 [1,1,1,0,0,0|1,0,0]=4 76 B16R1.1874 C/C=C/CC(=O)c1cc(c(cc1O)OC)Br 1458a_100009816734_100102629194 [1,1,1,0,0,0|1,0,0]=4 77 B16R1.1874 CC=CCC(=O)c1cc(c(cc1C)OC)C 1458a_100011996352_100000070051 [1,1,1,0,0,0|1,0,0]=4 78 B16R1.1874 CC=CCC(=O)c1cc(c(cc1O)OC)Br 1458a_100009816734_100000070051 [1,1,1,0,0,0|1,0,0]=4 79 B16R2.1461 COc1cc2ccc(=O)oc2cc1OC 7a_100000032626_200000210301 [2,1,0,0,0,0|1,0,0]=4 80 B16R2.1461 COc1cc2ccc(=O)oc2cc1O[13CH3] 7a_100000032626_200025704644 [2,1,0,0,0,0|1,0,0]=4 81 B16R2.37486 COc1cc2ccccc2c(c1OC)O 271570a_203496583355_200010176109 [2,1,0,0,0,0|1,0,0]=4 82 B14R1.564 C=C(C)c1cc(cc(c1C=O)F)OC 271570a_100000694244_200021118581 [1,0,1,0,1,0|1,0,0]=4 83 B14R1.564 C=C(C)c1cc(cc(c1C=O)O)OC 271570a_100000694244_100010762613 [1,0,1,0,1,0|0,0,0]=3 84 B14R1.2288 C=C(C)c1cc(c(cc1C=O)O)OC 271570a_100000694244_100000183646 [1,0,1,0,1,0|1,0,0]=4 85 B16R1.801 C=C(C)CSc1cc(cc(c1C=O)O)OC 62a_100000748629_100010762613 [1,0,1,0,0,1|0,1,0]=4 86 B16R1.5638 COc1ccc(c(c1)O)C(=O)CC=C(C)C 1458a_100000212123_100000761012 [1,0,1,0,0,1|1,0,0]=4 87 B16R1.20164 COc1ccc(c(c1)O)NC(=O)C=C(C)C 22a_100016989039_100000211388 [1,0,1,0,0,1|1,0,0]=4 88 B16R1.20164 COc1ccc(c(c1)O)NC(=O)C=C(C)Cl 22a_100016989039_200042562850 [1,0,1,0,0,1|1,0,0]=4 89 B16R1.4286 COc1ccc(cc1C)CC(=O)C=C(C)C 1458a_100000211388_200011290836 [1,0,1,0,0,1|1,0,0]=4 90 B16R1.4286 COc1ccc(cc1C)CC(=O)C=C(C)Cl 1458a_200042562850_200011290836 [1,0,1,0,0,1|1,0,0]=4 91 B16R1.4286 COc1ccc(cc1C)CC(=O)C=C(C)I 1458a_100025716642_200011290836 [1,0,1,0,0,1|1,0,0]=4 92 B16R1.4286 COc1ccc(cc1C)NC(=O)C=C(C)C 11a_100000743268_100000211388 [1,0,1,0,0,1|1,0,0]=4 93 B16R1.4286 COc1ccc(cc1C)NC(=O)C=C(C)C 1626a_100000743268_100000211388 [1,0,1,0,0,1|1,0,0]=4 94 B16R1.4286 COc1ccc(cc1C)NC(=O)C=C(C)C 22a_100000743268_100000211388 [1,0,1,0,0,1|1,0,0]=4 95 B16R1.4286 COc1ccc(cc1C)NC(=O)C=C(C)Cl 11a_100000743268_200042562850 [1,0,1,0,0,1|1,0,0]=4 96 B16R1.4286 COc1ccc(cc1C)NC(=O)C=C(C)Cl 1626a_100000743268_200042562850 [1,0,1,0,0,1|1,0,0]=4 97 B16R1.4286 COc1ccc(cc1C)NC(=O)C=C(C)Cl 22a_100000743268_200042562850 [1,0,1,0,0,1|1,0,0]=4 98 B16R1.4286 COc1ccc(cc1C)NC(=O)C=C(C)I 11a_100000743268_100025716642 [1,0,1,0,0,1|1,0,0]=4 99 B16R1.4286 COc1ccc(cc1C)NC(=O)C=C(C)I 1626a_100000743268_100025716642 [1,0,1,0,0,1|1,0,0]=4 100 B16R1.4296 COc1ccc(cc1C)C(=O)CC=C(C)C 1458a_100011202886_100000761012 [1,0,1,0,0,1|1,0,0]=4 101 B16R1.11387 CC(=CCC(=O)c1ccc(c(c1O)C)C)C 1458a_100000742916_100000761012 [1,0,1,0,0,1|1,0,0]=4 102 B16R1.2195 CC=CC(=O)Nc1ccc(c(c1C)C)OC 11a_100025755787_100000210699 [1,0,1,0,0,1|1,0,0]=4 103 B16R1.2195 CC=CC(=O)Nc1ccc(c(c1C)C)OC 1626a_100025755787_100000210699 [1,0,1,0,0,1|1,0,0]=4 104 B16R1.2195 CC=CC(=O)Nc1ccc(c(c1C)C)OC 22a_100025755787_100000210699 [1,0,1,0,0,1|1,0,0]=4 105 B16R1.2224 CC=CC(=O)Nc1cc(c(cc1Br)OC)C 11a_200010584344_100000210699 [1,0,1,0,0,1|1,0,0]=4 106 B16R1.2224 CC=CC(=O)Nc1cc(c(cc1Br)OC)C 1626a_200010584344_100000210699 [1,0,1,0,0,1|1,0,0]=4