0 B16R1.20196 CCc1cc(ccc1NC(=O)C(C)C)C#N 11a_100011219738_100000210198 [0,0,0,0,0,0|3,0,1]=4 1 B16R1.20196 CCc1cc(ccc1NC(=O)C(C)C)C#N 1626a_100011219738_100000210198 [0,0,0,0,0,0|3,0,1]=4 2 B16R1.20196 CCc1cc(ccc1NC(=O)C(C)C)C#N 527a_100011219738_100000210198 [0,0,0,0,0,0|3,0,1]=4 3 B16R1.20196 CNc1cc(ccc1NC(=O)C(C)C)OC 2230a_200011193534_200000210301 [0,0,0,0,0,0|4,0,0]=4 4 B16R1.20196 CNc1cc(ccc1NC(=O)C(C)C)OC 34a_200011193534_200000210301 [0,0,0,0,0,0|4,0,0]=4 5 B16R1.20196 COc1cc(ccc1NC(=O)C(C)C)C#N 11a_100000701993_100000210198 [0,0,0,0,0,0|2,0,1]=3 6 B16R1.20196 COc1cc(ccc1NC(=O)C(C)C)C#N 1626a_100000701993_100000210198 [0,0,0,0,0,0|2,0,1]=3 7 B16R1.20196 COc1cc(ccc1NC(=O)C(C)C)C#N 22a_100000701993_100000210198 [0,0,0,0,0,0|2,0,1]=3 8 B16R1.20196 COc1cc(ccc1NC(=O)C(C)C)C#N 527a_100000701993_100000210198 [0,0,0,0,0,0|2,0,1]=3 9 B16R1.20196 COc1cc(ccc1NC(=O)C(C)C)CO 22a_100000087641_100000210198 [0,0,0,0,0,0|1,0,2]=3 10 B16R1.20196 COc1cc(ccc1NC(=O)C(C)C)SC 11a_100000766855_100000210198 [0,0,0,0,0,0|3,0,0]=3 11 B16R1.20196 COc1cc(ccc1NC(=O)C(C)C)SC 22a_100000766855_100000210198 [0,0,0,0,0,0|3,0,0]=3 12 B16R1.20196 COc1cc(ccc1NC(=O)C(C)C)SC 527a_100000766855_100000210198 [0,0,0,0,0,0|3,0,0]=3 13 B16R1.20196 COc1cc(ccc1NC(=O)C(C)F)C#N 11a_100000701993_100000062450 [0,0,0,0,0,0|3,0,1]=4 14 B16R1.20196 COc1cc(ccc1NC(=O)C(C)F)C#N 1626a_100000701993_100000062450 [0,0,0,0,0,0|3,0,1]=4 15 B16R1.20196 COc1cc(ccc1NC(=O)C(C)F)C#N 22a_100000701993_100000062450 [0,0,0,0,0,0|3,0,1]=4 16 B16R1.20196 COc1cc(ccc1NC(=O)C(C)F)C#N 527a_100000701993_100000062450 [0,0,0,0,0,0|3,0,1]=4 17 B16R1.20196 COc1cc(ccc1NC(=O)C(C)F)CO 22a_100000087641_100000062450 [0,0,0,0,0,0|2,0,2]=4 18 B16R1.20196 COc1cc(ccc1NC(=O)C(C)F)SC 11a_100000766855_100000062450 [0,0,0,0,0,0|4,0,0]=4 19 B16R1.20196 COc1cc(ccc1NC(=O)C(C)F)SC 22a_100000766855_100000062450 [0,0,0,0,0,0|4,0,0]=4 20 B16R1.20196 COc1cc(ccc1NC(=O)C(C)F)SC 527a_100000766855_100000062450 [0,0,0,0,0,0|4,0,0]=4 21 B16R1.20196 COc1cc(ccc1NC(=O)N(C)C)C#N 2430a_100000701993_100102631434 [0,0,0,0,0,0|3,0,1]=4 22 B16R1.20196 COc1cc(ccc1NC(=O)N(C)C)SC 2430a_100000766855_100102631434 [0,0,0,0,0,0|4,0,0]=4 23 B16R1.20196 COc1cc(ccc1NC(=O)[C@@H](C)O)C#N 22a_100000701993_100000717761 [0,0,0,0,0,0|3,0,1]=4 24 B16R1.20196 COc1cc(ccc1NC(=O)[C@@H](C)O)CO 22a_100000087641_100000717761 [0,0,0,0,0,0|2,0,2]=4 25 B16R1.20196 COc1cc(ccc1NC(=O)[C@@H](C)O)SC 22a_100000766855_100000717761 [0,0,0,0,0,0|4,0,0]=4 26 B16R1.20196 COc1cc(ccc1NC(=O)[C@H](C)O)C#N 1626a_100000701993_217856618621 [0,0,0,0,0,0|3,0,1]=4 27 B16R1.20196 COc1cc(ccc1NC(=O)[C@H](C)O)C#N 22a_100000701993_217856618621 [0,0,0,0,0,0|3,0,1]=4 28 B16R1.20196 COc1cc(ccc1NC(=O)[C@H](C)O)CO 22a_100000087641_217856618621 [0,0,0,0,0,0|2,0,2]=4 29 B16R1.20196 COc1cc(ccc1NC(=O)[C@H](C)O)SC 22a_100000766855_217856618621 [0,0,0,0,0,0|4,0,0]=4 30 B16R1.20196 COc1ccc(c(c1)N[13CH3])NC(=O)C(C)C 2230a_200011193534_200025704644 [0,0,0,0,0,0|4,0,0]=4 31 B16R1.20196 COc1ccc(c(c1)N[13CH3])NC(=O)C(C)C 34a_200011193534_200025704644 [0,0,0,0,0,0|4,0,0]=4 32 B16R1.20196 COc1ccc(c(c1)OC)CC(=O)C(C)C 1458a_100000195418_100000210206 [0,0,0,0,0,0|3,0,0]=3 33 B16R1.20196 COc1ccc(c(c1)OC)CC(=O)N(C)C 11a_100102631434_100000195418 [0,0,0,0,0,0|4,0,0]=4 34 B16R1.20196 COc1ccc(c(c1)OC)CC(=O)N(C)C 1626a_100102631434_100000195418 [0,0,0,0,0,0|4,0,0]=4 35 B16R1.20196 COc1ccc(c(c1)OC)CC(=O)N(C)C 240690a_100102631434_100000195418 [0,0,0,0,0,0|4,0,0]=4 36 B16R1.20196 COc1ccc(c(c1)OC)CC(=O)N(C)C 527a_100102631434_100000195418 [0,0,0,0,0,0|4,0,0]=4 37 B16R1.20196 COc1ccc(c(c1)OC)NC(=O)C(C)C 11a_100000211191_100000210198 [0,0,0,0,0,0|3,0,0]=3 38 B16R1.20196 COc1ccc(c(c1)OC)NC(=O)C(C)C 1626a_100000211191_100000210198 [0,0,0,0,0,0|3,0,0]=3 39 B16R1.20196 COc1ccc(c(c1)OC)NC(=O)C(C)C 22a_100000211191_100000210198 [0,0,0,0,0,0|3,0,0]=3 40 B16R1.20196 COc1ccc(c(c1)OC)NC(=O)C(C)C 527a_100000211191_100000210198 [0,0,0,0,0,0|3,0,0]=3 41 B16R1.20196 COc1ccc(c(c1)OC)NC(=O)C(C)F 11a_100000211191_100000062450 [0,0,0,0,0,0|4,0,0]=4 42 B16R1.20196 COc1ccc(c(c1)OC)NC(=O)C(C)F 1626a_100000211191_100000062450 [0,0,0,0,0,0|4,0,0]=4 43 B16R1.20196 COc1ccc(c(c1)OC)NC(=O)C(C)F 22a_100000211191_100000062450 [0,0,0,0,0,0|4,0,0]=4 44 B16R1.20196 COc1ccc(c(c1)OC)NC(=O)C(C)F 527a_100000211191_100000062450 [0,0,0,0,0,0|4,0,0]=4 45 B16R1.20196 COc1ccc(c(c1)OC)NC(=O)N(C)C 2430a_100000211191_100102631434 [0,0,0,0,0,0|4,0,0]=4 46 B16R1.20196 COc1ccc(c(c1)OC)NC(=O)[C@@H](C)O 22a_100000211191_100000717761 [0,0,0,0,0,0|4,0,0]=4 47 B16R1.20196 COc1ccc(c(c1)OC)NC(=O)[C@H](C)O 1626a_100000211191_217856618621 [0,0,0,0,0,0|4,0,0]=4 48 B16R1.20196 COc1ccc(c(c1)OC)NC(=O)[C@H](C)O 22a_100000211191_217856618621 [0,0,0,0,0,0|4,0,0]=4 49 B15R1.1855 CC(C)C(=O)Nc1ccc(cc1O)C#N 22a_100011997735_100000210198 [1,0,0,0,0,0|2,0,1]=4 50 B15R1.1855 CC(C)C(=O)Nc1ccc(cc1O)C#N 527a_100011997735_100000210198 [1,0,0,0,0,0|2,0,1]=4 51 B15R1.1855 CCc1ccc(c(c1)C)NC(=O)C(C)C 11a_100011226020_100000210198 [1,0,0,0,0,0|2,0,1]=4 52 B15R1.1855 CCc1ccc(c(c1)C)NC(=O)C(C)C 1626a_100011226020_100000210198 [1,0,0,0,0,0|2,0,1]=4 53 B15R1.1855 CCc1ccc(c(c1)C)NC(=O)C(C)C 22a_100011226020_100000210198 [1,0,0,0,0,0|2,0,1]=4 54 B15R1.1855 CCc1ccc(c(c1)C)NC(=O)C(C)C 527a_100011226020_100000210198 [1,0,0,0,0,0|2,0,1]=4 55 B15R1.1855 CCc1ccc(c(c1)O)NC(=O)C(C)C 22a_100000124328_100000210198 [1,0,0,0,0,0|2,0,1]=4 56 B15R1.1855 CCc1ccc(c(c1)O)NC(=O)C(C)C 527a_100000124328_100000210198 [1,0,0,0,0,0|2,0,1]=4 57 B15R1.1855 CNc1ccc(c(c1)C)NC(=O)C(C)C 34a_200000187351_200000210301 [1,0,0,0,0,0|3,0,0]=4 58 B15R1.1855 CNc1ccc(c(c1)C)NC(=O)C(C)C 7a_200000187351_200000210301 [1,0,0,0,0,0|3,0,0]=4 59 B15R1.1855 COc1ccc(c(c1)C)CC(=O)C(C)C 1458a_100011996676_100000210206 [1,0,0,0,0,0|3,0,0]=4 60 B15R1.1855 COc1ccc(c(c1)C)NC(=O)C(C)C 11a_100000750285_100000210198 [1,0,0,0,0,0|3,0,0]=4 61 B15R1.1855 COc1ccc(c(c1)C)NC(=O)C(C)C 1626a_100000750285_100000210198 [1,0,0,0,0,0|3,0,0]=4 62 B15R1.1855 COc1ccc(c(c1)C)NC(=O)C(C)C 22a_100000750285_100000210198 [1,0,0,0,0,0|3,0,0]=4 63 B15R1.1855 COc1ccc(c(c1)C)NC(=O)C(C)C 527a_100000750285_100000210198 [1,0,0,0,0,0|3,0,0]=4 64 B15R1.1855 COc1ccc(c(c1)O)NC(=O)C(C)C 22a_100016989039_100000210198 [1,0,0,0,0,0|3,0,0]=4 65 B15R1.1855 COc1ccc(c(c1)O)NC(=O)C(C)C 527a_100016989039_100000210198 [1,0,0,0,0,0|3,0,0]=4 66 B15R1.1855 Cc1cc(ccc1NC(=O)C(C)C)C#N 11a_100011216260_100000210198 [1,0,0,0,0,0|2,0,1]=4 67 B15R1.1855 Cc1cc(ccc1NC(=O)C(C)C)C#N 1626a_100011216260_100000210198 [1,0,0,0,0,0|2,0,1]=4 68 B15R1.1855 Cc1cc(ccc1NC(=O)C(C)C)C#N 527a_100011216260_100000210198 [1,0,0,0,0,0|2,0,1]=4 69 B15R1.1855 Cc1cc(ccc1NC(=O)C(C)C)CO 22a_200011997030_100000210198 [1,0,0,0,0,0|1,0,2]=4 70 B15R1.1855 Cc1cc(ccc1NC(=O)C(C)C)N[13CH3] 34a_200000187351_200025704644 [1,0,0,0,0,0|3,0,0]=4 71 B15R1.1855 Cc1cc(ccc1NC(=O)C(C)C)N[13CH3] 7a_200000187351_200025704644 [1,0,0,0,0,0|3,0,0]=4 72 B15R1.1902 C=Cc1ccc(c(c1)OC)OC(C)CC 34a_100011217988_100011215416 [1,0,0,0,0,0|2,0,1]=4 73 B15R1.1902 CCC(=O)Cc1ccc(cc1OC)OC 1458a_100000195418_100000210202 [1,0,0,0,0,0|3,0,0]=4 74 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)C#N 11a_100000701993_100000210414 [1,0,0,0,0,0|2,0,1]=4 75 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)C#N 1626a_100000701993_100000210414 [1,0,0,0,0,0|2,0,1]=4 76 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)C#N 22a_100000701993_100000210414 [1,0,0,0,0,0|2,0,1]=4 77 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)C#N 527a_100000701993_100000210414 [1,0,0,0,0,0|2,0,1]=4 78 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)CO 22a_100000087641_100000210414 [1,0,0,0,0,0|1,0,2]=4 79 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)NC 34a_100015187003_200000210301 [1,0,0,0,0,0|3,0,0]=4 80 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)NC 7a_100015187003_200000210301 [1,0,0,0,0,0|3,0,0]=4 81 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)N[13CH3] 34a_100015187003_200025704644 [1,0,0,0,0,0|3,0,0]=4 82 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)N[13CH3] 7a_100015187003_200025704644 [1,0,0,0,0,0|3,0,0]=4 83 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)OC 11a_100000211191_100000210414 [1,0,0,0,0,0|3,0,0]=4 84 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)OC 1626a_100000211191_100000210414 [1,0,0,0,0,0|3,0,0]=4 85 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)OC 22a_100000211191_100000210414 [1,0,0,0,0,0|3,0,0]=4 86 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)OC 527a_100000211191_100000210414 [1,0,0,0,0,0|3,0,0]=4 87 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)SC 11a_100000766855_100000210414 [1,0,0,0,0,0|3,0,0]=4 88 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)SC 22a_100000766855_100000210414 [1,0,0,0,0,0|3,0,0]=4 89 B15R1.1902 CCC(=O)Nc1ccc(cc1OC)SC 527a_100000766855_100000210414 [1,0,0,0,0,0|3,0,0]=4 90 B15R1.1902 CCC(C)Sc1ccc(cc1OC)C=O 62a_100000758301_100010244714 [1,0,0,0,0,0|1,1,1]=4 91 B15R1.1902 CCC(C)Sc1ccc(cc1OC)C=O 62a_100010244714_100000758301 [1,0,0,0,0,0|1,1,1]=4 92 B15R1.1904 C=Cc1cc(ccc1OCC(C)C)C=O 271570a_100011290941_202495808110 [1,0,0,0,0,0|1,0,2]=4 93 B15R1.1904 C=Cc1ccc(c(c1)OC)OCC(C)C 34a_100011217988_100000210624 [1,0,0,0,0,0|1,0,1]=3 94 B15R1.1904 C=Cc1ccc(c(c1)OC)OCC(C)O 34a_100011217988_100011218427 [1,0,0,0,0,0|2,0,1]=4 95 B15R1.1904 C=Cc1ccc(c(c1)OC)OC[C@@H](C)O 34a_100011217988_100009817552 [1,0,0,0,0,0|2,0,1]=4 96 B15R1.1904 CC(C)C=Cc1ccc(cc1C#N)C=O 271570a_100016257149_100010128726 [1,0,0,0,0,0|3,0,0]=4 97 B15R1.1904 CC(C)C=Cc1ccc(cc1CO)C=O 271570a_100016257149_100015639582 [1,0,0,0,0,0|3,0,0]=4 98 B15R1.1904 CC(C)COc1ccc(cc1S[13CH3])C=O 62a_200025704644_202495808110 [1,0,0,0,0,0|0,1,1]=3 99 B15R1.1904 CC(C)COc1ccc(cc1S[13CH3])C=O 62a_202495808110_200025704644 [1,0,0,0,0,0|0,1,1]=3 100 B15R1.1904 CCc1ccc(c(c1)OC)C=CC(C)C 271570a_100016257149_200010710389 [1,0,0,0,0,0|2,0,1]=4 101 B15R1.1904 CCc1ccc(c(c1)OC)OCC(C)C 34a_100000186467_100000210624 [1,0,0,0,0,0|1,0,2]=4 102 B15R1.1904 CCc1ccc(c(c1)OC)OCC(C)C 7a_100000186467_100000210760 [1,0,0,0,0,0|1,0,2]=4 103 B15R1.1904 COc1cc(ccc1C=CC(C)C)C#N 271570a_100016257149_100012356288 [1,0,0,0,0,0|2,0,1]=4 104 B15R1.1904 COc1cc(ccc1C=CC(C)C)C=O 271570a_100016257149_100010244714 [1,0,0,0,0,0|1,0,0]=2 105 B15R1.1904 COc1cc(ccc1C=CC(C)C)CO 271570a_100016257149_100010234685 [1,0,0,0,0,0|1,0,2]=4 106 B15R1.1904 COc1cc(ccc1C=CC(C)O)C=O 271570a_200011019289_100010244714 [1,0,0,0,0,0|2,0,0]=3 107 B15R1.1904 COc1cc(ccc1OCC(C)C)C#N 34a_100000184589_100000210624 [1,0,0,0,0,0|1,0,2]=4 108 B15R1.1904 COc1cc(ccc1OCC(C)C)C#N 7a_100000184589_100000210760 [1,0,0,0,0,0|1,0,2]=4 109 B15R1.1904 COc1cc(ccc1OCC(C)C)CN 34a_100000185554_100000210624 [1,0,0,0,0,0|1,0,2]=4 110 B15R1.1904 COc1cc(ccc1SCC(C)C)C=O 62a_100000210624_100010244714 [1,0,0,0,0,0|0,1,1]=3 111 B15R1.1904 COc1cc(ccc1SCC(C)C)C=O 62a_100010244714_100000210760 [1,0,0,0,0,0|0,1,1]=3 112 B15R1.1904 COc1cc(ccc1SCC(C)O)C=O 62a_100010244714_100011218427 [1,0,0,0,0,0|1,1,1]=4 113 B15R1.1904 COc1cc(ccc1SCC(C)O)C=O 62a_100011218427_100010244714 [1,0,0,0,0,0|1,1,1]=4 114 B15R1.1904 COc1cc(ccc1SC[C@@H](C)O)C=O 62a_100009817552_100010244714 [1,0,0,0,0,0|1,1,1]=4 115 B15R1.1904 COc1cc(ccc1SC[C@@H](C)O)C=O 62a_100010244714_100009817552 [1,0,0,0,0,0|1,1,1]=4 116 B15R1.1904 COc1ccc(c(c1)OC)C=CC(C)C 271570a_100016257149_100000750026 [1,0,0,0,0,0|3,0,0]=4 117 B15R1.1904 COc1ccc(c(c1)OC)OCC(C)C 34a_100009840267_100000210624 [1,0,0,0,0,0|2,0,1]=4 118 B15R1.1904 CSc1cc(ccc1OCC(C)C)C=O 62a_200000210301_202495808110 [1,0,0,0,0,0|0,1,1]=3 119 B15R1.1904 CSc1cc(ccc1OCC(C)C)C=O 62a_202495808110_200000210301 [1,0,0,0,0,0|0,1,1]=3 120 B15R1.4059 CC(C)C(=O)Nc1ccc(cc1N[13CH3])Cl 2230a_200011193562_200025704644 [1,0,0,0,0,0|3,0,0]=4 121 B15R1.4059 CC(C)C(=O)Nc1ccc(cc1N[13CH3])Cl 34a_200011193562_200025704644 [1,0,0,0,0,0|3,0,0]=4 122 B15R1.4059 CC(C)C(=O)Nc1ccc(cc1N[13CH3])Cl 7a_200011193562_200025704644 [1,0,0,0,0,0|3,0,0]=4 123 B15R1.4059 CCc1cc(ccc1NC(=O)C(C)C)Br 11a_100000686106_100000210198 [1,0,0,0,0,0|3,0,0]=4 124 B15R1.4059 CCc1cc(ccc1NC(=O)C(C)C)Br 1626a_100000686106_100000210198 [1,0,0,0,0,0|3,0,0]=4 125 B15R1.4059 CCc1cc(ccc1NC(=O)C(C)C)Br 22a_100000686106_100000210198 [1,0,0,0,0,0|3,0,0]=4 126 B15R1.4059 CCc1cc(ccc1NC(=O)C(C)C)Br 527a_100000686106_100000210198 [1,0,0,0,0,0|3,0,0]=4 127 B15R1.4059 CCc1cc(ccc1NC(=O)C(C)C)Cl 11a_100012017146_100000210198 [1,0,0,0,0,0|3,0,0]=4 128 B15R1.4059 CCc1cc(ccc1NC(=O)C(C)C)Cl 1626a_100012017146_100000210198 [1,0,0,0,0,0|3,0,0]=4 129 B15R1.4059 CCc1cc(ccc1NC(=O)C(C)C)Cl 22a_100012017146_100000210198 [1,0,0,0,0,0|3,0,0]=4 130 B15R1.4059 CCc1cc(ccc1NC(=O)C(C)C)I 11a_100000014069_100000210198 [1,0,0,0,0,0|3,0,0]=4 131 B15R1.4059 CCc1cc(ccc1NC(=O)C(C)C)I 1626a_100000014069_100000210198 [1,0,0,0,0,0|3,0,0]=4 132 B15R1.4059 CCc1cc(ccc1NC(=O)C(C)C)I 22a_100000014069_100000210198 [1,0,0,0,0,0|3,0,0]=4 133 B15R1.4059 CCc1cc(ccc1NC(=O)C(C)C)I 527a_100000014069_100000210198 [1,0,0,0,0,0|3,0,0]=4 134 B15R1.4059 CNc1cc(ccc1NC(=O)C(C)C)C 2230a_200011203073_200000210301 [1,0,0,0,0,0|2,0,1]=4 135 B15R1.4059 CNc1cc(ccc1NC(=O)C(C)C)C 34a_200011203073_200000210301 [1,0,0,0,0,0|2,0,1]=4 136 B15R1.4059 CNc1cc(ccc1NC(=O)C(C)C)C 7a_200011203073_200000210301 [1,0,0,0,0,0|2,0,1]=4 137 B15R1.4059 CNc1cc(ccc1NC(=O)C(C)C)Cl 2230a_200011193562_200000210301 [1,0,0,0,0,0|3,0,0]=4 138 B15R1.4059 CNc1cc(ccc1NC(=O)C(C)C)Cl 34a_200011193562_200000210301 [1,0,0,0,0,0|3,0,0]=4 139 B15R1.4059 CNc1cc(ccc1NC(=O)C(C)C)Cl 7a_200011193562_200000210301 [1,0,0,0,0,0|3,0,0]=4 140 B15R1.4059 COc1cc(ccc1CC(=O)C(C)C)Br 1458a_100000210198_100012359436 [1,0,0,0,0,0|2,0,0]=3 141 B15R1.4059 COc1cc(ccc1CC(=O)C(C)C)Br 1458a_100010245118_100000210206 [1,0,0,0,0,0|2,0,0]=3 142 B15R1.4059 COc1cc(ccc1CC(=O)C(C)C)Cl 1458a_100010217541_100000210206 [1,0,0,0,0,0|2,0,0]=3 143 B15R1.4059 COc1cc(ccc1CC(=O)C(C)C)F 1458a_100000062011_100000210206 [1,0,0,0,0,0|2,0,0]=3 144 B15R1.4059 COc1cc(ccc1CC(=O)C(C)C)F 1458a_100000210198_200010171551 [1,0,0,0,0,0|2,0,0]=3 145 B15R1.4059 COc1cc(ccc1CC(=O)C(C)F)Br 1458a_100000062450_100012359436 [1,0,0,0,0,0|3,0,0]=4 146 B15R1.4059 COc1cc(ccc1CC(=O)C(C)F)F 1458a_100000062450_200010171551 [1,0,0,0,0,0|3,0,0]=4 147 B15R1.4059 COc1cc(ccc1CC(=O)N(C)C)Br 11a_100102631434_100010245118 [1,0,0,0,0,0|3,0,0]=4 148 B15R1.4059 COc1cc(ccc1CC(=O)N(C)C)Br 1626a_100102631434_100010245118 [1,0,0,0,0,0|3,0,0]=4 149 B15R1.4059 COc1cc(ccc1CC(=O)N(C)C)Br 240690a_100102631434_100010245118 [1,0,0,0,0,0|3,0,0]=4 150 B15R1.4059 COc1cc(ccc1CC(=O)N(C)C)Br 527a_100102631434_100010245118 [1,0,0,0,0,0|3,0,0]=4 151 B15R1.4059 COc1cc(ccc1CC(=O)N(C)C)Cl 11a_100102631434_100010217541 [1,0,0,0,0,0|3,0,0]=4 152 B15R1.4059 COc1cc(ccc1CC(=O)N(C)C)Cl 1626a_100102631434_100010217541 [1,0,0,0,0,0|3,0,0]=4 153 B15R1.4059 COc1cc(ccc1CC(=O)N(C)C)Cl 240690a_100102631434_100010217541 [1,0,0,0,0,0|3,0,0]=4 154 B15R1.4059 COc1cc(ccc1CC(=O)N(C)C)Cl 527a_100102631434_100010217541 [1,0,0,0,0,0|3,0,0]=4 155 B15R1.4059 COc1cc(ccc1CC(=O)N(C)C)F 11a_100102631434_100000062011 [1,0,0,0,0,0|3,0,0]=4 156 B15R1.4059 COc1cc(ccc1CC(=O)N(C)C)F 1626a_100102631434_100000062011 [1,0,0,0,0,0|3,0,0]=4 157 B15R1.4059 COc1cc(ccc1CC(=O)N(C)C)F 240690a_100102631434_100000062011 [1,0,0,0,0,0|3,0,0]=4 158 B15R1.4059 COc1cc(ccc1CC(=O)N(C)C)F 527a_100102631434_100000062011 [1,0,0,0,0,0|3,0,0]=4 159 B15R1.4059 COc1cc(ccc1CC(=O)[C@@H](C)O)Br 1458a_100000717761_100012359436 [1,0,0,0,0,0|3,0,0]=4 160 B15R1.4059 COc1cc(ccc1CC(=O)[C@@H](C)O)F 1458a_100000717761_200010171551 [1,0,0,0,0,0|3,0,0]=4 161 B15R1.4059 COc1cc(ccc1CC(=O)[C@H](C)O)Br 1458a_217856618621_100012359436 [1,0,0,0,0,0|3,0,0]=4 162 B15R1.4059 COc1cc(ccc1CC(=O)[C@H](C)O)F 1458a_217856618621_200010171551 [1,0,0,0,0,0|3,0,0]=4 163 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)Br 11a_100011279103_100000210198 [1,0,0,0,0,0|2,0,0]=3 164 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)Br 1626a_100011279103_100000210198 [1,0,0,0,0,0|2,0,0]=3 165 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)Br 22a_100011279103_100000210198 [1,0,0,0,0,0|2,0,0]=3 166 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)C 11a_100000746441_100000210198 [1,0,0,0,0,0|1,0,1]=3 167 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)C 1626a_100000746441_100000210198 [1,0,0,0,0,0|1,0,1]=3 168 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)C 22a_100000746441_100000210198 [1,0,0,0,0,0|1,0,1]=3 169 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)C 527a_100000746441_100000210198 [1,0,0,0,0,0|1,0,1]=3 170 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)Cl 11a_100000707585_100000210198 [1,0,0,0,0,0|2,0,0]=3 171 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)Cl 1626a_100000707585_100000210198 [1,0,0,0,0,0|2,0,0]=3 172 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)Cl 22a_100000707585_100000210198 [1,0,0,0,0,0|2,0,0]=3 173 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)F 11a_100000737216_100000210198 [1,0,0,0,0,0|2,0,0]=3 174 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)F 1626a_100000737216_100000210198 [1,0,0,0,0,0|2,0,0]=3 175 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)F 22a_100000737216_100000210198 [1,0,0,0,0,0|2,0,0]=3 176 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)F 527a_100000737216_100000210198 [1,0,0,0,0,0|2,0,0]=3 177 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)I 11a_100015196925_100000210198 [1,0,0,0,0,0|2,0,0]=3 178 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)I 1626a_100015196925_100000210198 [1,0,0,0,0,0|2,0,0]=3 179 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)I 22a_100015196925_100000210198 [1,0,0,0,0,0|2,0,0]=3 180 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)O 22a_100015326901_100000210198 [1,0,0,0,0,0|1,0,1]=3 181 B15R1.4059 COc1cc(ccc1NC(=O)C(C)C)O 527a_100015326901_100000210198 [1,0,0,0,0,0|1,0,1]=3 182 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)Br 11a_100011279103_100000062450 [1,0,0,0,0,0|3,0,0]=4 183 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)Br 1626a_100011279103_100000062450 [1,0,0,0,0,0|3,0,0]=4 184 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)Br 22a_100011279103_100000062450 [1,0,0,0,0,0|3,0,0]=4 185 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)C 11a_100000746441_100000062450 [1,0,0,0,0,0|2,0,1]=4 186 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)C 1626a_100000746441_100000062450 [1,0,0,0,0,0|2,0,1]=4 187 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)C 22a_100000746441_100000062450 [1,0,0,0,0,0|2,0,1]=4 188 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)C 527a_100000746441_100000062450 [1,0,0,0,0,0|2,0,1]=4 189 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)Cl 11a_100000707585_100000062450 [1,0,0,0,0,0|3,0,0]=4 190 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)Cl 1626a_100000707585_100000062450 [1,0,0,0,0,0|3,0,0]=4 191 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)Cl 22a_100000707585_100000062450 [1,0,0,0,0,0|3,0,0]=4 192 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)F 11a_100000737216_100000062450 [1,0,0,0,0,0|3,0,0]=4 193 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)F 1626a_100000737216_100000062450 [1,0,0,0,0,0|3,0,0]=4 194 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)F 22a_100000737216_100000062450 [1,0,0,0,0,0|3,0,0]=4 195 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)F 527a_100000737216_100000062450 [1,0,0,0,0,0|3,0,0]=4 196 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)I 11a_100015196925_100000062450 [1,0,0,0,0,0|3,0,0]=4 197 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)I 1626a_100015196925_100000062450 [1,0,0,0,0,0|3,0,0]=4 198 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)I 22a_100015196925_100000062450 [1,0,0,0,0,0|3,0,0]=4 199 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)O 22a_100015326901_100000062450 [1,0,0,0,0,0|2,0,1]=4 200 B15R1.4059 COc1cc(ccc1NC(=O)C(C)F)O 527a_100015326901_100000062450 [1,0,0,0,0,0|2,0,1]=4 201 B15R1.4059 COc1cc(ccc1NC(=O)N(C)C)Br 2430a_100011279103_100102631434 [1,0,0,0,0,0|3,0,0]=4 202 B15R1.4059 COc1cc(ccc1NC(=O)N(C)C)C 2430a_100000746441_100102631434 [1,0,0,0,0,0|2,0,1]=4 203 B15R1.4059 COc1cc(ccc1NC(=O)N(C)C)Cl 2430a_100000707585_100102631434 [1,0,0,0,0,0|3,0,0]=4 204 B15R1.4059 COc1cc(ccc1NC(=O)N(C)C)F 2430a_100000737216_100102631434 [1,0,0,0,0,0|3,0,0]=4 205 B15R1.4059 COc1cc(ccc1NC(=O)N(C)C)I 2430a_100015196925_100102631434 [1,0,0,0,0,0|3,0,0]=4 206 B15R1.4059 COc1cc(ccc1NC(=O)N(C)C)O 2430a_100015326901_100102631434 [1,0,0,0,0,0|2,0,1]=4 207 B15R1.4059 COc1cc(ccc1NC(=O)[C@@H](C)O)Br 22a_100011279103_100000717761 [1,0,0,0,0,0|3,0,0]=4 208 B15R1.4059 COc1cc(ccc1NC(=O)[C@@H](C)O)C 22a_100000746441_100000717761 [1,0,0,0,0,0|2,0,1]=4 209 B15R1.4059 COc1cc(ccc1NC(=O)[C@@H](C)O)Cl 22a_100000707585_100000717761 [1,0,0,0,0,0|3,0,0]=4 210 B15R1.4059 COc1cc(ccc1NC(=O)[C@@H](C)O)F 22a_100000737216_100000717761 [1,0,0,0,0,0|3,0,0]=4 211 B15R1.4059 COc1cc(ccc1NC(=O)[C@@H](C)O)I 22a_100015196925_100000717761 [1,0,0,0,0,0|3,0,0]=4 212 B15R1.4059 COc1cc(ccc1NC(=O)[C@@H](C)O)O 22a_100015326901_100000717761 [1,0,0,0,0,0|2,0,1]=4 213 B15R1.4059 COc1cc(ccc1NC(=O)[C@H](C)O)Br 1626a_100011279103_217856618621 [1,0,0,0,0,0|3,0,0]=4 214 B15R1.4059 COc1cc(ccc1NC(=O)[C@H](C)O)Br 22a_100011279103_217856618621 [1,0,0,0,0,0|3,0,0]=4 215 B15R1.4059 COc1cc(ccc1NC(=O)[C@H](C)O)C 1626a_100000746441_217856618621 [1,0,0,0,0,0|2,0,1]=4 216 B15R1.4059 COc1cc(ccc1NC(=O)[C@H](C)O)C 22a_100000746441_217856618621 [1,0,0,0,0,0|2,0,1]=4 217 B15R1.4059 COc1cc(ccc1NC(=O)[C@H](C)O)Cl 1626a_100000707585_217856618621 [1,0,0,0,0,0|3,0,0]=4 218 B15R1.4059 COc1cc(ccc1NC(=O)[C@H](C)O)Cl 22a_100000707585_217856618621 [1,0,0,0,0,0|3,0,0]=4 219 B15R1.4059 COc1cc(ccc1NC(=O)[C@H](C)O)F 1626a_100000737216_217856618621 [1,0,0,0,0,0|3,0,0]=4 220 B15R1.4059 COc1cc(ccc1NC(=O)[C@H](C)O)F 22a_100000737216_217856618621 [1,0,0,0,0,0|3,0,0]=4 221 B15R1.4059 COc1cc(ccc1NC(=O)[C@H](C)O)I 1626a_100015196925_217856618621 [1,0,0,0,0,0|3,0,0]=4 222 B15R1.4059 COc1cc(ccc1NC(=O)[C@H](C)O)I 22a_100015196925_217856618621 [1,0,0,0,0,0|3,0,0]=4 223 B15R1.4059 COc1cc(ccc1NC(=O)[C@H](C)O)O 22a_100015326901_217856618621 [1,0,0,0,0,0|2,0,1]=4 224 B15R1.4059 COc1nc(ccc1CC(=O)C(C)C)Br 1458a_100000210198_100016029037 [1,0,0,0,0,0|3,0,0]=4 225 B15R1.4059 Cc1ccc(c(c1)N[13CH3])NC(=O)C(C)C 2230a_200011203073_200025704644 [1,0,0,0,0,0|2,0,1]=4 226 B15R1.4059 Cc1ccc(c(c1)N[13CH3])NC(=O)C(C)C 34a_200011203073_200025704644 [1,0,0,0,0,0|2,0,1]=4 227 B15R1.4059 Cc1ccc(c(c1)N[13CH3])NC(=O)C(C)C 7a_200011203073_200025704644 [1,0,0,0,0,0|2,0,1]=4 228 B17R1.5265 C=C(C)C(=O)Nc1ccc(cc1OC)C(=O)N 11a_100011850419_100000185857 [0,1,0,0,0,0|1,0,2]=4 229 B17R1.5265 C=C(C)C(=O)Nc1ccc(cc1OC)C(=O)N 1626a_100011850419_100000185857 [0,1,0,0,0,0|1,0,2]=4 230 B17R1.5265 C=C(C)C(=O)Nc1ccc(cc1OC)C(=O)N 22a_100011850419_100000185857 [0,1,0,0,0,0|1,0,2]=4 231 B17R1.5265 COc1cc(ccc1CC(=O)C(C)C)[N+](=O)[O-] 1458a_100000210198_100010150584 [0,1,0,0,0,0|2,0,0]=3 232 B17R1.5265 COc1cc(ccc1CC(=O)C(C)F)[N+](=O)[O-] 1458a_100000062450_100010150584 [0,1,0,0,0,0|3,0,0]=4 233 B17R1.5265 COc1cc(ccc1CC(=O)[C@@H](C)O)[N+](=O)[O-] 1458a_100000717761_100010150584 [0,1,0,0,0,0|3,0,0]=4 234 B17R1.5265 COc1cc(ccc1CC(=O)[C@H](C)O)[N+](=O)[O-] 1458a_217856618621_100010150584 [0,1,0,0,0,0|3,0,0]=4 235 B17R1.5265 COc1cc(ccc1NC(=O)C(C)C)C(=O)N 11a_100011850419_100000210198 [0,1,0,0,0,0|1,0,0]=2 236 B17R1.5265 COc1cc(ccc1NC(=O)C(C)C)C(=O)N 1626a_100011850419_100000210198 [0,1,0,0,0,0|1,0,0]=2 237 B17R1.5265 COc1cc(ccc1NC(=O)C(C)C)C(=O)N 22a_100011850419_100000210198 [0,1,0,0,0,0|1,0,0]=2 238 B17R1.5265 COc1cc(ccc1NC(=O)C(C)C)C(=O)N 527a_100011850419_100000210198 [0,1,0,0,0,0|1,0,0]=2 239 B17R1.5265 COc1cc(ccc1NC(=O)C(C)C)N(C)C 11a_100011900498_100000210198 [0,1,0,0,0,0|3,0,0]=4 240 B17R1.5265 COc1cc(ccc1NC(=O)C(C)C)N(C)C 1626a_100011900498_100000210198 [0,1,0,0,0,0|3,0,0]=4 241 B17R1.5265 COc1cc(ccc1NC(=O)C(C)C)N(C)C 22a_100011900498_100000210198 [0,1,0,0,0,0|3,0,0]=4 242 B17R1.5265 COc1cc(ccc1NC(=O)C(C)C)N(C)C 527a_100011900498_100000210198 [0,1,0,0,0,0|3,0,0]=4 243 B17R1.5265 COc1cc(ccc1NC(=O)C(C)C)[N+](=O)[O-] 11a_100000211086_100000210198 [0,1,0,0,0,0|2,0,0]=3 244 B17R1.5265 COc1cc(ccc1NC(=O)C(C)C)[N+](=O)[O-] 1626a_100000211086_100000210198 [0,1,0,0,0,0|2,0,0]=3 245 B17R1.5265 COc1cc(ccc1NC(=O)C(C)F)C(=O)N 11a_100011850419_100000062450 [0,1,0,0,0,0|2,0,0]=3 246 B17R1.5265 COc1cc(ccc1NC(=O)C(C)F)C(=O)N 1626a_100011850419_100000062450 [0,1,0,0,0,0|2,0,0]=3 247 B17R1.5265 COc1cc(ccc1NC(=O)C(C)F)C(=O)N 22a_100011850419_100000062450 [0,1,0,0,0,0|2,0,0]=3 248 B17R1.5265 COc1cc(ccc1NC(=O)C(C)F)C(=O)N 527a_100011850419_100000062450 [0,1,0,0,0,0|2,0,0]=3 249 B17R1.5265 COc1cc(ccc1NC(=O)C(C)F)[N+](=O)[O-] 11a_100000211086_100000062450 [0,1,0,0,0,0|3,0,0]=4 250 B17R1.5265 COc1cc(ccc1NC(=O)C(C)F)[N+](=O)[O-] 1626a_100000211086_100000062450 [0,1,0,0,0,0|3,0,0]=4 251 B17R1.5265 COc1cc(ccc1NC(=O)C(F)F)C(=O)N 11a_100011850419_100000210393 [0,1,0,0,0,0|3,0,0]=4 252 B17R1.5265 COc1cc(ccc1NC(=O)C(F)F)C(=O)N 1626a_100011850419_100000210393 [0,1,0,0,0,0|3,0,0]=4 253 B17R1.5265 COc1cc(ccc1NC(=O)C(F)F)C(=O)N 22a_100011850419_100000210393 [0,1,0,0,0,0|3,0,0]=4 254 B17R1.5265 COc1cc(ccc1NC(=O)C(F)F)C(=O)N 527a_100011850419_100000210393 [0,1,0,0,0,0|3,0,0]=4 255 B17R1.5265 COc1cc(ccc1NC(=O)C(O)O)C(=O)N 22a_100011850419_100000233687 [0,1,0,0,0,0|3,0,0]=4 256 B17R1.5265 COc1cc(ccc1NC(=O)N(C)C)C(=O)N 2430a_100011850419_100102631434 [0,1,0,0,0,0|2,0,0]=3 257 B17R1.5265 COc1cc(ccc1NC(=O)N(C)C)[N+](=O)[O-] 2430a_100000211086_100102631434 [0,1,0,0,0,0|3,0,0]=4 258 B17R1.5265 COc1cc(ccc1NC(=O)[C@@H](C)O)C(=O)N 22a_100011850419_100000717761 [0,1,0,0,0,0|2,0,0]=3 259 B17R1.5265 COc1cc(ccc1NC(=O)[C@H](C)O)C(=O)N 1626a_100011850419_217856618621 [0,1,0,0,0,0|2,0,0]=3 260 B17R1.5265 COc1cc(ccc1NC(=O)[C@H](C)O)C(=O)N 22a_100011850419_217856618621 [0,1,0,0,0,0|2,0,0]=3 261 B17R1.5265 COc1cc(ccc1NC(=O)[C@H](C)O)[N+](=O)[O-] 1626a_100000211086_217856618621 [0,1,0,0,0,0|3,0,0]=4 262 B17R1.5265 COc1cc(ccc1NC(C)C(C)C)C(=O)N 27a_100000211541_100009817049 [0,1,0,0,0,0|2,0,1]=4 263 B17R1.6649 CNc1ccc(c(c1)OC)NC(=O)C(C)(C)C 2230a_100000261837_200000210301 [0,1,0,0,0,0|3,0,0]=4 264 B17R1.6649 CNc1ccc(c(c1)OC)NC(=O)C(C)(C)C 34a_100000261837_200000210301 [0,1,0,0,0,0|3,0,0]=4 265 B17R1.6649 CNc1ccc(c(c1)OC)NC(=O)C(C)(C)C 7a_100000261837_200000210301 [0,1,0,0,0,0|3,0,0]=4 266 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)C)C#N 11a_100000701993_106744555173 [0,1,0,0,0,0|2,0,1]=4 267 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)C)C#N 1626a_100000701993_106744555173 [0,1,0,0,0,0|2,0,1]=4 268 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)C)C#N 22a_100000701993_106744555173 [0,1,0,0,0,0|2,0,1]=4 269 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)C)C#N 527a_100000701993_106744555173 [0,1,0,0,0,0|2,0,1]=4 270 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)C)CO 22a_100000087641_106744555173 [0,1,0,0,0,0|1,0,2]=4 271 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)C)N[13CH3] 2230a_100000261837_200025704644 [0,1,0,0,0,0|3,0,0]=4 272 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)C)N[13CH3] 34a_100000261837_200025704644 [0,1,0,0,0,0|3,0,0]=4 273 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)C)N[13CH3] 7a_100000261837_200025704644 [0,1,0,0,0,0|3,0,0]=4 274 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)C)SC 11a_100000766855_106744555173 [0,1,0,0,0,0|3,0,0]=4 275 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)C)SC 22a_100000766855_106744555173 [0,1,0,0,0,0|3,0,0]=4 276 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)C)SC 527a_100000766855_106744555173 [0,1,0,0,0,0|3,0,0]=4 277 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)F)C#N 11a_100000701993_100000765255 [0,1,0,0,0,0|2,0,1]=4 278 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)F)C#N 1626a_100000701993_100000765255 [0,1,0,0,0,0|2,0,1]=4 279 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)F)C#N 22a_100000701993_100000765255 [0,1,0,0,0,0|2,0,1]=4 280 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)F)C#N 527a_100000701993_100000765255 [0,1,0,0,0,0|2,0,1]=4 281 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)F)CO 22a_100000087641_100000765255 [0,1,0,0,0,0|1,0,2]=4 282 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)F)SC 11a_100000766855_100000765255 [0,1,0,0,0,0|3,0,0]=4 283 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)F)SC 22a_100000766855_100000765255 [0,1,0,0,0,0|3,0,0]=4 284 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)F)SC 527a_100000766855_100000765255 [0,1,0,0,0,0|3,0,0]=4 285 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)O)C#N 22a_100000701993_100000242741 [0,1,0,0,0,0|2,0,1]=4 286 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)O)CO 22a_100000087641_100000242741 [0,1,0,0,0,0|1,0,2]=4 287 B17R1.6649 COc1cc(ccc1NC(=O)C(C)(C)O)SC 22a_100000766855_100000242741 [0,1,0,0,0,0|3,0,0]=4 288 B17R1.6649 COc1ccc(c(c1)OC)NC(=O)C(C)(C)C 11a_100000211191_106744555173 [0,1,0,0,0,0|3,0,0]=4 289 B17R1.6649 COc1ccc(c(c1)OC)NC(=O)C(C)(C)C 1626a_100000211191_106744555173 [0,1,0,0,0,0|3,0,0]=4 290 B17R1.6649 COc1ccc(c(c1)OC)NC(=O)C(C)(C)C 22a_100000211191_106744555173 [0,1,0,0,0,0|3,0,0]=4 291 B17R1.6649 COc1ccc(c(c1)OC)NC(=O)C(C)(C)C 527a_100000211191_106744555173 [0,1,0,0,0,0|3,0,0]=4 292 B17R1.6649 COc1ccc(c(c1)OC)NC(=O)C(C)(C)F 11a_100000211191_100000765255 [0,1,0,0,0,0|3,0,0]=4 293 B17R1.6649 COc1ccc(c(c1)OC)NC(=O)C(C)(C)F 1626a_100000211191_100000765255 [0,1,0,0,0,0|3,0,0]=4 294 B17R1.6649 COc1ccc(c(c1)OC)NC(=O)C(C)(C)F 22a_100000211191_100000765255 [0,1,0,0,0,0|3,0,0]=4 295 B17R1.6649 COc1ccc(c(c1)OC)NC(=O)C(C)(C)F 527a_100000211191_100000765255 [0,1,0,0,0,0|3,0,0]=4 296 B17R1.6649 COc1ccc(c(c1)OC)NC(=O)C(C)(C)O 22a_100000211191_100000242741 [0,1,0,0,0,0|3,0,0]=4 297 B17R1.18206 CNCc1ccc(c(c1)OC)OC(=O)C(C)C 207a_100102657272_100000014710 [0,1,0,0,0,0|1,0,1]=3 298 B17R1.18206 CNCc1ccc(c(c1)OC)OC(=O)C(C)C 270004a_106832991635_100000014710 [0,1,0,0,0,0|1,0,1]=3 299 B17R1.20470 COc1cc(c(c(c1)OC)NC(=O)C(C)C)Cl 11a_100000041261_100000210198 [0,1,0,0,0,0|3,0,0]=4 300 B17R1.20470 COc1cc(c(c(c1)OC)NC(=O)C(C)C)Cl 1626a_100000041261_100000210198 [0,1,0,0,0,0|3,0,0]=4 301 B17R1.20470 COc1cc(c(c(c1)OC)NC(=O)C(C)C)Cl 22a_100000041261_100000210198 [0,1,0,0,0,0|3,0,0]=4 302 B17R1.20470 COc1cc(c(c(c1)OC)NC(=O)C(C)C)Cl 527a_100000041261_100000210198 [0,1,0,0,0,0|3,0,0]=4 303 B17R1.28975 CCC(C)C(=O)Cc1ccc(cc1OC)OC 1458a_100000195418_100000758301 [0,1,0,0,0,0|3,0,0]=4 304 B17R1.28975 CCC(C)C(=O)Nc1ccc(cc1OC)C#N 11a_100000701993_100011192722 [0,1,0,0,0,0|2,0,1]=4 305 B17R1.28975 CCC(C)C(=O)Nc1ccc(cc1OC)C#N 1626a_100000701993_100011192722 [0,1,0,0,0,0|2,0,1]=4 306 B17R1.28975 CCC(C)C(=O)Nc1ccc(cc1OC)C#N 22a_100000701993_100011192722 [0,1,0,0,0,0|2,0,1]=4 307 B17R1.28975 CCC(C)C(=O)Nc1ccc(cc1OC)C#N 527a_100000701993_100011192722 [0,1,0,0,0,0|2,0,1]=4 308 B17R1.28975 CCC(C)C(=O)Nc1ccc(cc1OC)CO 22a_100000087641_100011192722 [0,1,0,0,0,0|1,0,2]=4 309 B17R1.28975 CCC(C)C(=O)Nc1ccc(cc1OC)OC 11a_100000211191_100011192722 [0,1,0,0,0,0|3,0,0]=4 310 B17R1.28975 CCC(C)C(=O)Nc1ccc(cc1OC)OC 1626a_100000211191_100011192722 [0,1,0,0,0,0|3,0,0]=4 311 B17R1.28975 CCC(C)C(=O)Nc1ccc(cc1OC)OC 22a_100000211191_100011192722 [0,1,0,0,0,0|3,0,0]=4 312 B17R1.28975 CCC(C)C(=O)Nc1ccc(cc1OC)OC 527a_100000211191_100011192722 [0,1,0,0,0,0|3,0,0]=4 313 B17R1.28975 CCC(C)C(=O)Nc1ccc(cc1OC)SC 11a_100000766855_100011192722 [0,1,0,0,0,0|3,0,0]=4 314 B17R1.28975 CCC(C)C(=O)Nc1ccc(cc1OC)SC 22a_100000766855_100011192722 [0,1,0,0,0,0|3,0,0]=4 315 B17R1.28975 CCC(C)C(=O)Nc1ccc(cc1OC)SC 527a_100000766855_100011192722 [0,1,0,0,0,0|3,0,0]=4 316 B17R1.28975 CNC(C)C(=O)Nc1ccc(cc1OC)OC 2230a_106832991635_100000735932 [0,1,0,0,0,0|3,0,0]=4 317 B17R1.28975 CNC(C)C(=O)Nc1ccc(cc1OC)OC 7a_106832991635_100000735932 [0,1,0,0,0,0|3,0,0]=4 318 B17R1.28975 COc1cc(ccc1NC(=O)C(C)OC)C#N 11a_100000701993_100000743197 [0,1,0,0,0,0|2,0,1]=4 319 B17R1.28975 COc1cc(ccc1NC(=O)C(C)OC)C#N 1626a_100000701993_100000743197 [0,1,0,0,0,0|2,0,1]=4 320 B17R1.28975 COc1cc(ccc1NC(=O)C(C)OC)C#N 22a_100000701993_100000743197 [0,1,0,0,0,0|2,0,1]=4 321 B17R1.28975 COc1cc(ccc1NC(=O)C(C)OC)C#N 527a_100000701993_100000743197 [0,1,0,0,0,0|2,0,1]=4 322 B17R1.28975 COc1cc(ccc1NC(=O)C(C)OC)CO 22a_100000087641_100000743197 [0,1,0,0,0,0|1,0,2]=4 323 B17R1.28975 COc1cc(ccc1NC(=O)C(C)OC)SC 11a_100000766855_100000743197 [0,1,0,0,0,0|3,0,0]=4 324 B17R1.28975 COc1cc(ccc1NC(=O)C(C)OC)SC 22a_100000766855_100000743197 [0,1,0,0,0,0|3,0,0]=4 325 B17R1.28975 COc1cc(ccc1NC(=O)C(C)OC)SC 527a_100000766855_100000743197 [0,1,0,0,0,0|3,0,0]=4 326 B17R1.28975 COc1cc(ccc1NC(=O)C(C)SC)C#N 11a_100000701993_100000149566 [0,1,0,0,0,0|2,0,1]=4 327 B17R1.28975 COc1cc(ccc1NC(=O)C(C)SC)C#N 1626a_100000701993_100000149566 [0,1,0,0,0,0|2,0,1]=4 328 B17R1.28975 COc1cc(ccc1NC(=O)C(C)SC)C#N 22a_100000701993_100000149566 [0,1,0,0,0,0|2,0,1]=4 329 B17R1.28975 COc1cc(ccc1NC(=O)C(C)SC)C#N 527a_100000701993_100000149566 [0,1,0,0,0,0|2,0,1]=4 330 B17R1.28975 COc1cc(ccc1NC(=O)C(C)SC)CO 22a_100000087641_100000149566 [0,1,0,0,0,0|1,0,2]=4 331 B17R1.28975 COc1cc(ccc1NC(=O)C(C)SC)SC 11a_100000766855_100000149566 [0,1,0,0,0,0|3,0,0]=4 332 B17R1.28975 COc1cc(ccc1NC(=O)C(C)SC)SC 22a_100000766855_100000149566 [0,1,0,0,0,0|3,0,0]=4 333 B17R1.28975 COc1cc(ccc1NC(=O)C(C)SC)SC 527a_100000766855_100000149566 [0,1,0,0,0,0|3,0,0]=4 334 B17R1.28975 COc1ccc(c(c1)OC)NC(=O)C(C)OC 11a_100000211191_100000743197 [0,1,0,0,0,0|3,0,0]=4 335 B17R1.28975 COc1ccc(c(c1)OC)NC(=O)C(C)OC 1626a_100000211191_100000743197 [0,1,0,0,0,0|3,0,0]=4 336 B17R1.28975 COc1ccc(c(c1)OC)NC(=O)C(C)OC 22a_100000211191_100000743197 [0,1,0,0,0,0|3,0,0]=4 337 B17R1.28975 COc1ccc(c(c1)OC)NC(=O)C(C)OC 527a_100000211191_100000743197 [0,1,0,0,0,0|3,0,0]=4 338 B17R1.28975 COc1ccc(c(c1)OC)NC(=O)C(C)SC 11a_100000211191_100000149566 [0,1,0,0,0,0|3,0,0]=4 339 B17R1.28975 COc1ccc(c(c1)OC)NC(=O)C(C)SC 1626a_100000211191_100000149566 [0,1,0,0,0,0|3,0,0]=4 340 B17R1.28975 COc1ccc(c(c1)OC)NC(=O)C(C)SC 22a_100000211191_100000149566 [0,1,0,0,0,0|3,0,0]=4 341 B17R1.28975 COc1ccc(c(c1)OC)NC(=O)C(C)SC 527a_100000211191_100000149566 [0,1,0,0,0,0|3,0,0]=4 342 B17R1.28975 COc1ccc(c(c1)OC)NC(=O)C(C)SC 62a_100000735932_200000210301 [0,1,0,0,0,0|3,0,0]=4 343 B17R1.28975 COc1ccc(c(c1)OC)NC(=O)C(C)SC 62a_200000210301_100000735932 [0,1,0,0,0,0|3,0,0]=4 344 B17R1.28975 COc1ccc(c(c1)OC)NC(=O)C(C)S[13CH3] 62a_100000735932_200025704644 [0,1,0,0,0,0|3,0,0]=4 345 B17R1.28975 COc1ccc(c(c1)OC)NC(=O)C(C)S[13CH3] 62a_200025704644_100000735932 [0,1,0,0,0,0|3,0,0]=4 346 B17R1.48248 COc1ccc(c(c1F)OC)NC(=O)C(C)C 11a_100000070076_100000210198 [0,1,0,0,0,0|3,0,0]=4 347 B17R1.48248 COc1ccc(c(c1F)OC)NC(=O)C(C)C 1626a_100000070076_100000210198 [0,1,0,0,0,0|3,0,0]=4 348 B17R1.48248 COc1ccc(c(c1F)OC)NC(=O)C(C)C 22a_100000070076_100000210198 [0,1,0,0,0,0|3,0,0]=4 349 B17R1.48248 COc1ccc(c(c1F)OC)NC(=O)C(C)C 527a_100000070076_100000210198 [0,1,0,0,0,0|3,0,0]=4 350 B17R1.164104 COc1cc(c(cc1Cl)NC(=O)C(C)C)OC 11a_100000212179_100000210198 [0,1,0,0,0,0|3,0,0]=4 351 B17R1.164104 COc1cc(c(cc1Cl)NC(=O)C(C)C)OC 1626a_100000212179_100000210198 [0,1,0,0,0,0|3,0,0]=4 352 B17R1.164104 COc1cc(c(cc1Cl)NC(=O)C(C)C)OC 22a_100000212179_100000210198 [0,1,0,0,0,0|3,0,0]=4 353 B17R1.164104 COc1cc(c(cc1Cl)NC(=O)C(C)C)OC 527a_100000212179_100000210198 [0,1,0,0,0,0|3,0,0]=4 354 B17R1.164104 COc1cc(c(cc1F)NC(=O)C(C)C)OC 11a_100000762594_100000210198 [0,1,0,0,0,0|3,0,0]=4 355 B17R1.164104 COc1cc(c(cc1F)NC(=O)C(C)C)OC 1626a_100000762594_100000210198 [0,1,0,0,0,0|3,0,0]=4 356 B17R1.164104 COc1cc(c(cc1F)NC(=O)C(C)C)OC 22a_100000762594_100000210198 [0,1,0,0,0,0|3,0,0]=4 357 B17R1.164104 COc1cc(c(cc1F)NC(=O)C(C)C)OC 527a_100000762594_100000210198 [0,1,0,0,0,0|3,0,0]=4 358 B17R1.164104 COc1cc(c(cc1NC(=O)C(C)C)F)C#N 11a_200010892158_100000210198 [0,1,0,0,0,0|2,0,1]=4 359 B17R1.164104 COc1cc(c(cc1NC(=O)C(C)C)F)C#N 1626a_200010892158_100000210198 [0,1,0,0,0,0|2,0,1]=4 360 B17R2.13257 COc1cc(ccc1NC(=O)C2CC2)C#N 11a_100000701993_100000210395 [0,0,0,1,0,0|2,0,1]=4 361 B17R2.13257 COc1cc(ccc1NC(=O)C2CC2)C#N 1626a_100000701993_100000210395 [0,0,0,1,0,0|2,0,1]=4 362 B17R2.13257 COc1cc(ccc1NC(=O)C2CC2)C#N 22a_100000701993_100000210395 [0,0,0,1,0,0|2,0,1]=4 363 B17R2.13257 COc1cc(ccc1NC(=O)C2CC2)C#N 527a_100000701993_100000210395 [0,0,0,1,0,0|2,0,1]=4 364 B17R2.13257 COc1cc(ccc1NC(=O)C2CC2)CO 22a_100000087641_100000210395 [0,0,0,1,0,0|1,0,2]=4 365 B17R2.13257 COc1cc(ccc1NC(=O)C2CC2)SC 11a_100000766855_100000210395 [0,0,0,1,0,0|3,0,0]=4 366 B17R2.13257 COc1cc(ccc1NC(=O)C2CC2)SC 22a_100000766855_100000210395 [0,0,0,1,0,0|3,0,0]=4 367 B17R2.13257 COc1cc(ccc1NC(=O)C2CC2)SC 527a_100000766855_100000210395 [0,0,0,1,0,0|3,0,0]=4 368 B17R2.13257 COc1ccc(c(c1)OC)NC(=O)C2CC2 11a_100000211191_100000210395 [0,0,0,1,0,0|3,0,0]=4 369 B17R2.13257 COc1ccc(c(c1)OC)NC(=O)C2CC2 1626a_100000211191_100000210395 [0,0,0,1,0,0|3,0,0]=4 370 B17R2.13257 COc1ccc(c(c1)OC)NC(=O)C2CC2 22a_100000211191_100000210395 [0,0,0,1,0,0|3,0,0]=4 371 B17R2.13257 COc1ccc(c(c1)OC)NC(=O)C2CC2 527a_100000211191_100000210395 [0,0,0,1,0,0|3,0,0]=4 372 B15R1.1903 COc1cc(ccc1C(=C(C)C)C)C=O 271570a_200000049429_100010244714 [0,0,0,0,1,0|1,0,1]=3 373 B15R1.1903 COc1cc(ccc1C(=O)C(C)C)C#N 1458a_100012002740_100000210206 [0,0,0,0,1,0|1,0,1]=3 374 B15R1.1903 COc1cc(ccc1C(=O)C(C)C)SC 1458a_100000211074_100000210206 [0,0,0,0,1,0|2,0,0]=3 375 B15R1.1903 COc1cc(ccc1C(=O)N(C)C)C#N 11a_100102631434_100012002740 [0,0,0,0,1,0|2,0,1]=4 376 B15R1.1903 COc1cc(ccc1C(=O)N(C)C)C#N 1626a_100102631434_100012002740 [0,0,0,0,1,0|2,0,1]=4 377 B15R1.1903 COc1cc(ccc1C(=O)N(C)C)C#N 240690a_100102631434_100012002740 [0,0,0,0,1,0|2,0,1]=4 378 B15R1.1903 COc1cc(ccc1C(=O)N(C)C)C#N 527a_100102631434_100012002740 [0,0,0,0,1,0|2,0,1]=4 379 B15R1.1903 COc1cc(ccc1C(=O)N(C)C)SC 11a_100102631434_100000211074 [0,0,0,0,1,0|3,0,0]=4 380 B15R1.1903 COc1cc(ccc1C(=O)N(C)C)SC 1626a_100102631434_100000211074 [0,0,0,0,1,0|3,0,0]=4 381 B15R1.1903 COc1cc(ccc1C(=O)N(C)C)SC 240690a_100102631434_100000211074 [0,0,0,0,1,0|3,0,0]=4 382 B15R1.1903 COc1cc(ccc1C(=O)N(C)C)SC 527a_100102631434_100000211074 [0,0,0,0,1,0|3,0,0]=4 383 B15R1.1903 COc1ccc(c(c1)OC)C(=O)C(C)C 1458a_100000210807_100000210206 [0,0,0,0,1,0|2,0,0]=3 384 B15R1.1903 COc1ccc(c(c1)OC)C(=O)N(C)C 11a_100102631434_100000210807 [0,0,0,0,1,0|3,0,0]=4 385 B15R1.1903 COc1ccc(c(c1)OC)C(=O)N(C)C 1626a_100102631434_100000210807 [0,0,0,0,1,0|3,0,0]=4 386 B15R1.1903 COc1ccc(c(c1)OC)C(=O)N(C)C 240690a_100102631434_100000210807 [0,0,0,0,1,0|3,0,0]=4 387 B15R1.1903 COc1ccc(c(c1)OC)C(=O)N(C)C 527a_100102631434_100000210807 [0,0,0,0,1,0|3,0,0]=4 388 B17R1.6644 C=Cc1ccc(c(c1)OC)OC(C)CC(C)C 34a_100011217988_100000731052 [0,0,0,0,0,1|2,0,1]=4 389 B17R1.6644 CNc1ccc(c(c1)OC)NC(=O)CC(C)C 34a_200015187610_200000210301 [0,0,0,0,0,1|3,0,0]=4 390 B17R1.6644 CNc1ccc(c(c1)OC)NC(=O)CC(C)C 7a_200015187610_200000210301 [0,0,0,0,0,1|3,0,0]=4 391 B17R1.6644 COc1cc(ccc1NC(=O)CC(C)C)C#N 11a_100000701993_100000210554 [0,0,0,0,0,1|2,0,1]=4 392 B17R1.6644 COc1cc(ccc1NC(=O)CC(C)C)C#N 1626a_100000701993_100000210554 [0,0,0,0,0,1|2,0,1]=4 393 B17R1.6644 COc1cc(ccc1NC(=O)CC(C)C)C#N 22a_100000701993_100000210554 [0,0,0,0,0,1|2,0,1]=4 394 B17R1.6644 COc1cc(ccc1NC(=O)CC(C)C)C#N 527a_100000701993_100000210554 [0,0,0,0,0,1|2,0,1]=4 395 B17R1.6644 COc1cc(ccc1NC(=O)CC(C)C)CO 22a_100000087641_100000210554 [0,0,0,0,0,1|1,0,2]=4 396 B17R1.6644 COc1cc(ccc1NC(=O)CC(C)C)N[13CH3] 34a_200015187610_200025704644 [0,0,0,0,0,1|3,0,0]=4 397 B17R1.6644 COc1cc(ccc1NC(=O)CC(C)C)N[13CH3] 7a_200015187610_200025704644 [0,0,0,0,0,1|3,0,0]=4 398 B17R1.6644 COc1cc(ccc1NC(=O)CC(C)C)SC 11a_100000766855_100000210554 [0,0,0,0,0,1|3,0,0]=4 399 B17R1.6644 COc1cc(ccc1NC(=O)CC(C)C)SC 22a_100000766855_100000210554 [0,0,0,0,0,1|3,0,0]=4 400 B17R1.6644 COc1cc(ccc1NC(=O)CC(C)C)SC 527a_100000766855_100000210554 [0,0,0,0,0,1|3,0,0]=4 401 B17R1.6644 COc1cc(ccc1NC(=O)NC(C)C)C#N 2430a_100000701993_100138425928 [0,0,0,0,0,1|2,0,1]=4 402 B17R1.6644 COc1cc(ccc1NC(=O)NC(C)C)C#N 512a_100000701993_100138425928 [0,0,0,0,0,1|2,0,1]=4 403 B17R1.6644 COc1cc(ccc1NC(=O)NC(C)C)SC 2430a_100000766855_100138425928 [0,0,0,0,0,1|3,0,0]=4 404 B17R1.6644 COc1cc(ccc1SC(C)CC(C)C)C=O 62a_100000731052_100010244714 [0,0,0,0,0,1|1,1,1]=4 405 B17R1.6644 COc1cc(ccc1SC(C)CC(C)C)C=O 62a_100010244714_100000731052 [0,0,0,0,0,1|1,1,1]=4 406 B17R1.6644 COc1ccc(c(c1)OC)CC(=O)CC(C)C 1458a_100000195418_100000210624 [0,0,0,0,0,1|3,0,0]=4 407 B17R1.6644 COc1ccc(c(c1)OC)CC(=O)NC(C)C 11a_100138425928_100000195418 [0,0,0,0,0,1|3,0,0]=4 408 B17R1.6644 COc1ccc(c(c1)OC)CC(=O)NC(C)C 1626a_100138425928_100000195418 [0,0,0,0,0,1|3,0,0]=4 409 B17R1.6644 COc1ccc(c(c1)OC)CC(=O)NC(C)C 240690a_100138425928_100000195418 [0,0,0,0,0,1|3,0,0]=4 410 B17R1.6644 COc1ccc(c(c1)OC)CC(=O)NC(C)C 527a_100138425928_100000195418 [0,0,0,0,0,1|3,0,0]=4 411 B17R1.6644 COc1ccc(c(c1)OC)NC(=O)CC(C)C 11a_100000211191_100000210554 [0,0,0,0,0,1|3,0,0]=4 412 B17R1.6644 COc1ccc(c(c1)OC)NC(=O)CC(C)C 1626a_100000211191_100000210554 [0,0,0,0,0,1|3,0,0]=4 413 B17R1.6644 COc1ccc(c(c1)OC)NC(=O)CC(C)C 22a_100000211191_100000210554 [0,0,0,0,0,1|3,0,0]=4 414 B17R1.6644 COc1ccc(c(c1)OC)NC(=O)CC(C)C 527a_100000211191_100000210554 [0,0,0,0,0,1|3,0,0]=4 415 B17R1.6644 COc1ccc(c(c1)OC)NC(=O)NC(C)C 2430a_100000211191_100138425928 [0,0,0,0,0,1|3,0,0]=4 416 B17R1.6645 C=Cc1ccc(c(c1)OC)OCC(=O)C(=O)C 34a_100011217988_100011261029 [0,0,0,0,0,1|2,0,1]=4 417 B17R1.6645 C=Cc1ccc(c(c1)OC)OCC(=O)C(C)C 34a_100011217988_100000753385 [0,0,0,0,0,1|1,0,0]=2 418 B17R1.6645 C=Cc1ccc(c(c1)OC)OCC(=O)N(C)C 34a_100011217988_100000692301 [0,0,0,0,0,1|2,0,0]=3 419 B17R1.6645 CC(C)C(=O)CSc1ccc(cc1C#N)C=O 62a_100000753385_100010128726 [0,0,0,0,0,1|2,1,0]=4 420 B17R1.6645 CC(C)C(=O)CSc1ccc(cc1CO)C=O 62a_100000753385_100015639582 [0,0,0,0,0,1|2,1,0]=4 421 B17R1.6645 CC(C)C(=O)CSc1ccc(cc1CO)C=O 62a_100015639582_100000753385 [0,0,0,0,0,1|2,1,0]=4 422 B17R1.6645 CCc1ccc(c(c1)OC)OCC(=O)C(C)C 34a_100000186467_100000753385 [0,0,0,0,0,1|1,0,1]=3 423 B17R1.6645 CCc1ccc(c(c1)OC)OCC(=O)C(C)C 7a_100000186467_100000753385 [0,0,0,0,0,1|1,0,1]=3 424 B17R1.6645 CCc1ccc(c(c1)OC)OCC(=O)N(C)C 34a_100000186467_100000692301 [0,0,0,0,0,1|2,0,1]=4 425 B17R1.6645 CCc1ccc(c(c1)OC)OCC(=O)N(C)C 7a_100000186467_100000692301 [0,0,0,0,0,1|2,0,1]=4 426 B17R1.6645 CCc1ccc(c(c1)OC)SCC(=O)C(C)C 62a_100000753385_200010710389 [0,0,0,0,0,1|1,1,1]=4 427 B17R1.6645 CCc1ccc(c(c1)OC)SCC(=O)C(C)C 62a_200010710389_100000753385 [0,0,0,0,0,1|1,1,1]=4 428 B17R1.6645 COc1cc(ccc1CCC(=O)N(C)C)C=O 271570a_200010232142_100010244714 [0,0,0,0,0,1|2,0,0]=3 429 B17R1.6645 COc1cc(ccc1NCC(=O)C(C)C)C#N 34a_100000701993_100000753385 [0,0,0,0,0,1|2,0,1]=4 430 B17R1.6645 COc1cc(ccc1NCC(=O)C(C)C)CO 2230a_100000087641_100000753385 [0,0,0,0,0,1|1,0,2]=4 431 B17R1.6645 COc1cc(ccc1NCC(=O)C(C)C)CO 34a_100000087641_100000753385 [0,0,0,0,0,1|1,0,2]=4 432 B17R1.6645 COc1cc(ccc1NCC(=O)C(C)C)SC 2230a_100000766855_100000753385 [0,0,0,0,0,1|3,0,0]=4 433 B17R1.6645 COc1cc(ccc1NCC(=O)C(C)C)SC 34a_100000766855_100000753385 [0,0,0,0,0,1|3,0,0]=4 434 B17R1.6645 COc1cc(ccc1OCC(=O)C(C)C)C#N 34a_100000184589_100000753385 [0,0,0,0,0,1|1,0,1]=3 435 B17R1.6645 COc1cc(ccc1OCC(=O)C(C)C)C#N 7a_100000184589_100000753385 [0,0,0,0,0,1|1,0,1]=3 436 B17R1.6645 COc1cc(ccc1OCC(=O)C(C)C)CN 34a_100000185554_100000753385 [0,0,0,0,0,1|1,0,1]=3 437 B17R1.6645 COc1cc(ccc1OCC(=O)N(C)C)C#N 34a_100000184589_100000692301 [0,0,0,0,0,1|2,0,1]=4 438 B17R1.6645 COc1cc(ccc1OCC(=O)N(C)C)C#N 7a_100000184589_100000692301 [0,0,0,0,0,1|2,0,1]=4 439 B17R1.6645 COc1cc(ccc1OCC(=O)N(C)C)CN 34a_100000185554_100000692301 [0,0,0,0,0,1|2,0,1]=4 440 B17R1.6645 COc1cc(ccc1SCC(=O)C(=O)C)C=O 62a_100010244714_100011261029 [0,0,0,0,0,1|1,1,1]=4 441 B17R1.6645 COc1cc(ccc1SCC(=O)C(=O)C)C=O 62a_100011261029_100010244714 [0,0,0,0,0,1|1,1,1]=4 442 B17R1.6645 COc1cc(ccc1SCC(=O)C(C)C)C#N 62a_100000753385_100012356288 [0,0,0,0,0,1|1,1,1]=4 443 B17R1.6645 COc1cc(ccc1SCC(=O)C(C)C)C=O 62a_100000753385_100010244714 [0,0,0,0,0,1|0,1,0]=2 444 B17R1.6645 COc1cc(ccc1SCC(=O)C(C)C)C=O 62a_100010244714_100000753385 [0,0,0,0,0,1|0,1,0]=2 445 B17R1.6645 COc1cc(ccc1SCC(=O)C(C)C)CO 62a_100000753385_100010234685 [0,0,0,0,0,1|0,1,2]=4 446 B17R1.6645 COc1cc(ccc1SCC(=O)C(C)C)CO 62a_100010234685_100000753385 [0,0,0,0,0,1|0,1,2]=4 447 B17R1.6645 COc1cc(ccc1SCC(=O)N(C)C)C=O 62a_100000692301_100010244714 [0,0,0,0,0,1|1,1,0]=3 448 B17R1.6645 COc1cc(ccc1SCC(=O)N(C)C)C=O 62a_100010244714_100000692301 [0,0,0,0,0,1|1,1,0]=3 449 B17R1.6645 COc1ccc(c(c1)OC)C=CC(=O)C(C)C 1458a_100000211080_100000210206 [0,0,0,0,0,1|3,0,0]=4 450 B17R1.6645 COc1ccc(c(c1)OC)CCC(=O)C(C)C 1458a_100011217809_100000210206 [0,0,0,0,0,1|3,0,0]=4 451 B17R1.6645 COc1ccc(c(c1)OC)CNC(=O)C(C)C 11a_100000737765_100000210198 [0,0,0,0,0,1|3,0,0]=4 452 B17R1.6645 COc1ccc(c(c1)OC)CNC(=O)C(C)C 1626a_100000737765_100000210198 [0,0,0,0,0,1|3,0,0]=4 453 B17R1.6645 COc1ccc(c(c1)OC)CNC(=O)C(C)C 240690a_100000737765_100000210198 [0,0,0,0,0,1|3,0,0]=4 454 B17R1.6645 COc1ccc(c(c1)OC)CNC(=O)C(C)C 527a_100000737765_100000210198 [0,0,0,0,0,1|3,0,0]=4 455 B17R1.6645 COc1ccc(c(c1)OC)NCC(=O)C(C)C 2230a_100000211191_100000753385 [0,0,0,0,0,1|3,0,0]=4 456 B17R1.6645 COc1ccc(c(c1)OC)NCC(=O)C(C)C 34a_100000211191_100000753385 [0,0,0,0,0,1|3,0,0]=4 457 B17R1.6645 COc1ccc(c(c1)OC)OCC(=O)C(C)C 34a_100009840267_100000753385 [0,0,0,0,0,1|2,0,0]=3 458 B17R1.6645 COc1ccc(c(c1)OC)OCC(=O)N(C)C 34a_100009840267_100000692301 [0,0,0,0,0,1|3,0,0]=4 459 B17R1.6645 COc1ccc(c(c1)OC)SCC(=O)C(C)C 62a_100000750026_100000753385 [0,0,0,0,0,1|2,1,0]=4 460 B17R1.6645 COc1ccc(c(c1)OC)SCC(=O)C(C)C 62a_100000753385_100000750026 [0,0,0,0,0,1|2,1,0]=4 461 B17R1.6645 COc1ccc(c(n1)OC)OCC(=O)C(C)C 34a_100000085135_100000753385 [0,0,0,0,0,1|3,0,0]=4 462 B14R1.3 C=Cc1ccc(cc1)CC(=O)C(C)C 1458a_100000210198_100000034074 [2,0,0,0,0,0|2,0,0]=4 463 B14R1.3 C=Cc1ccc(cc1)NC(=O)C(C)C 11a_100011218248_100000210198 [2,0,0,0,0,0|2,0,0]=4 464 B14R1.3 C=Cc1ccc(cc1)NC(=O)C(C)C 1626a_100011218248_100000210198 [2,0,0,0,0,0|2,0,0]=4 465 B14R1.3 C=Cc1ccc(cc1)NC(=O)C(C)C 22a_100011218248_100000210198 [2,0,0,0,0,0|2,0,0]=4 466 B14R1.3 C=Cc1ccc(cc1)NC(=O)C(C)C 271570a_100011290941_200000153573 [2,0,0,0,0,0|2,0,0]=4 467 B14R1.3 C=Cc1ccc(cc1)NC(=O)C(C)C 527a_100011218248_100000210198 [2,0,0,0,0,0|2,0,0]=4 468 B14R1.3 CC(C)C(=O)Cc1ccc(cc1)C=O 1458a_100000210198_100000075337 [2,0,0,0,0,0|1,0,0]=3 469 B14R1.3 CC(F)C(=O)Cc1ccc(cc1)C=O 1458a_100000062450_100000075337 [2,0,0,0,0,0|2,0,0]=4 470 B14R1.3 C[C@@H](O)C(=O)Cc1ccc(cc1)C=O 1458a_100000717761_100000075337 [2,0,0,0,0,0|2,0,0]=4 471 B14R1.3 C[C@H](O)C(=O)Cc1ccc(cc1)C=O 1458a_217856618621_100000075337 [2,0,0,0,0,0|2,0,0]=4 472 B14R1.103 CC(C)C=Cc1ccc(cc1F)C=O 271570a_100016257149_100000686674 [2,0,0,0,0,0|2,0,0]=4 473 B14R1.103 CC(C)C=Cc1ccc(cc1O)C=O 271570a_100016257149_100000041418 [2,0,0,0,0,0|1,0,0]=3 474 B14R1.103 CC(C)COc1ccc(cc1O)C=O 271570a_203496583355_202495808110 [2,0,0,0,0,0|0,0,1]=3 475 B14R1.103 CC(C)CSc1ccc(cc1O)C=O 62a_100000041418_100000210760 [2,0,0,0,0,0|0,1,1]=4 476 B14R1.103 CC(C)CSc1ccc(cc1O)C=O 62a_100000210624_100000041418 [2,0,0,0,0,0|0,1,1]=4 477 B14R1.103 CC(O)C=Cc1ccc(cc1O)C=O 271570a_200011019289_100000041418 [2,0,0,0,0,0|2,0,0]=4 478 B14R1.103 Cc1cc(ccc1C=CC(C)C)C=O 271570a_100016257149_100000765772 [2,0,0,0,0,0|1,0,0]=3 479 B14R1.103 Cc1cc(ccc1C=CC(C)O)C=O 271570a_200011019289_100000765772 [2,0,0,0,0,0|2,0,0]=4 480 B14R1.103 Cc1cc(ccc1SCC(C)C)C=O 62a_100000210624_100000765772 [2,0,0,0,0,0|0,1,1]=4 481 B14R1.103 Cc1cc(ccc1SCC(C)C)C=O 62a_100000765772_100000210760 [2,0,0,0,0,0|0,1,1]=4 482 B14R1.103 Cc1cc(cnc1C=CC(C)C)C=O 271570a_100016257149_100000070293 [2,0,0,0,0,0|2,0,0]=4 483 B14R1.103 Cc1cc(ncc1C=CC(C)C)C=O 271570a_100016257149_100009814806 [2,0,0,0,0,0|2,0,0]=4 484 B14R1.103 Cc1nc(ccc1C=CC(C)C)C=O 271570a_100016257149_100010238520 [2,0,0,0,0,0|2,0,0]=4 485 B14R1.6049 CC(C)C(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100000210206 [2,0,0,0,0,0|2,0,0]=4 486 B14R1.6049 CC(C)C(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000210198 [2,0,0,0,0,0|2,0,0]=4 487 B14R1.6049 CC(C)C(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000210198 [2,0,0,0,0,0|2,0,0]=4 488 B14R1.6049 CC(C)C(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000210198 [2,0,0,0,0,0|2,0,0]=4 489 B14R1.6049 CC(C)C(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000210198 [2,0,0,0,0,0|2,0,0]=4 490 B14R1.6049 CC(C)C(=O)Nc1ccc(cc1O)F 22a_100000753323_100000210198 [2,0,0,0,0,0|2,0,0]=4 491 B14R1.6049 CC(C)C(=O)Nc1ccc(cc1O)F 527a_100000753323_100000210198 [2,0,0,0,0,0|2,0,0]=4 492 B14R1.6049 CC(C)C(=O)Nc1ccc(cc1O)I 22a_100000057187_100000210198 [2,0,0,0,0,0|2,0,0]=4 493 B14R1.6049 CC(C)C(=O)Nc1ccc(cc1O)I 527a_100000057187_100000210198 [2,0,0,0,0,0|2,0,0]=4 494 B14R1.6049 CC(C)C(=O)Nc1ccc(cc1O)O 22a_100000106777_100000210198 [2,0,0,0,0,0|1,0,1]=4 495 B14R1.6049 CC(C)C(=O)Nc1ccc(cc1O)O 527a_100000106777_100000210198 [2,0,0,0,0,0|1,0,1]=4 496 B14R1.6049 Cc1cc(ccc1CC(=O)C(C)C)Br 1458a_100000210198_100000708836 [2,0,0,0,0,0|2,0,0]=4 497 B14R1.6049 Cc1cc(ccc1CC(=O)C(C)C)Br 1458a_100000697930_100000210206 [2,0,0,0,0,0|2,0,0]=4 498 B14R1.6049 Cc1cc(ccc1CC(=O)C(C)C)Cl 1458a_100000210198_100012361307 [2,0,0,0,0,0|2,0,0]=4 499 B14R1.6049 Cc1cc(ccc1CC(=O)C(C)C)F 1458a_100000210198_100000700533 [2,0,0,0,0,0|2,0,0]=4 500 B14R1.6049 Cc1cc(ccc1CC(=O)C(C)C)F 1458a_100011667441_100000210206 [2,0,0,0,0,0|2,0,0]=4 501 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)Br 11a_100000211769_100000210198 [2,0,0,0,0,0|2,0,0]=4 502 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)Br 1626a_100000211769_100000210198 [2,0,0,0,0,0|2,0,0]=4 503 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)Br 22a_100000211769_100000210198 [2,0,0,0,0,0|2,0,0]=4 504 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)Cl 11a_100000210418_100000210198 [2,0,0,0,0,0|2,0,0]=4 505 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)Cl 1626a_100000210418_100000210198 [2,0,0,0,0,0|2,0,0]=4 506 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)Cl 22a_100000210418_100000210198 [2,0,0,0,0,0|2,0,0]=4 507 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)F 11a_100000211637_100000210198 [2,0,0,0,0,0|2,0,0]=4 508 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)F 1626a_100000211637_100000210198 [2,0,0,0,0,0|2,0,0]=4 509 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)F 22a_100000211637_100000210198 [2,0,0,0,0,0|2,0,0]=4 510 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)F 527a_100000211637_100000210198 [2,0,0,0,0,0|2,0,0]=4 511 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)I 11a_100000184554_100000210198 [2,0,0,0,0,0|2,0,0]=4 512 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)I 1626a_100000184554_100000210198 [2,0,0,0,0,0|2,0,0]=4 513 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)I 22a_100000184554_100000210198 [2,0,0,0,0,0|2,0,0]=4 514 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)O 22a_100000756630_100000210198 [2,0,0,0,0,0|1,0,1]=4 515 B14R1.6049 Cc1cc(ccc1NC(=O)C(C)C)O 527a_100000756630_100000210198 [2,0,0,0,0,0|1,0,1]=4 516 B14R1.6049 Cc1ccc(c(c1)C)CC(=O)C(C)C 1458a_100000210198_100011219618 [2,0,0,0,0,0|1,0,1]=4 517 B14R1.6049 Cc1ccc(c(c1)C)CC(=O)C(C)C 1458a_100011236500_100000210206 [2,0,0,0,0,0|1,0,1]=4 518 B14R1.6049 Cc1ccc(c(c1)C)NC(=O)C(C)C 11a_100000736561_100000210198 [2,0,0,0,0,0|1,0,1]=4 519 B14R1.6049 Cc1ccc(c(c1)C)NC(=O)C(C)C 1626a_100000736561_100000210198 [2,0,0,0,0,0|1,0,1]=4 520 B14R1.6049 Cc1ccc(c(c1)C)NC(=O)C(C)C 22a_100000736561_100000210198 [2,0,0,0,0,0|1,0,1]=4 521 B14R1.6049 Cc1ccc(c(c1)C)NC(=O)C(C)C 527a_100000736561_100000210198 [2,0,0,0,0,0|1,0,1]=4 522 B14R1.6049 Cc1ccc(c(c1)O)NC(=O)C(C)C 22a_100000211527_100000210198 [2,0,0,0,0,0|1,0,1]=4 523 B14R1.6049 Cc1ccc(c(c1)O)NC(=O)C(C)C 527a_100000211527_100000210198 [2,0,0,0,0,0|1,0,1]=4 524 B14R1.101 C=Cc1ccc(c(c1)OC)NC(=O)C 271570a_100011290941_100009813048 [2,0,0,0,0,0|2,0,0]=4 525 B14R1.101 COc1cc(ccc1C=C(C)C)C=O 271570a_100102525489_100010244714 [2,0,0,0,0,0|2,0,0]=4 526 B14R1.1355 C=Cc1ccc(c(c1)OC)OCCC 34a_100011217988_100000210303 [2,0,0,0,0,0|1,0,1]=4 527 B14R1.1355 CCCCc1ccc(cc1OC)C=O 271570a_100020621405_100010244714 [2,0,0,0,0,0|1,0,1]=4 528 B14R1.1355 CCCOc1ccc(cc1SC)C=O 62a_100000173362_200000210301 [2,0,0,0,0,0|0,1,1]=4 529 B14R1.1355 CCCOc1ccc(cc1SC)C=O 62a_200000210301_100000173362 [2,0,0,0,0,0|0,1,1]=4 530 B14R1.1355 CCCOc1ccc(cc1S[13CH3])C=O 62a_100000173362_200025704644 [2,0,0,0,0,0|0,1,1]=4 531 B14R1.1355 CCCOc1ccc(cc1S[13CH3])C=O 62a_200025704644_100000173362 [2,0,0,0,0,0|0,1,1]=4 532 B14R1.1355 CCCSc1ccc(cc1OC)C=O 62a_100000210303_100010244714 [2,0,0,0,0,0|0,1,1]=4 533 B14R1.1355 CCCSc1ccc(cc1OC)C=O 62a_100010244714_100000210303 [2,0,0,0,0,0|0,1,1]=4 534 B14R1.3417 CCC(=O)Cc1ccc(cc1OC)Br 1458a_100000210414_100012359436 [2,0,0,0,0,0|2,0,0]=4 535 B14R1.3417 CCC(=O)Cc1ccc(cc1OC)Br 1458a_100010245118_100000210202 [2,0,0,0,0,0|2,0,0]=4 536 B14R1.3417 CCC(=O)Cc1ccc(cc1OC)Cl 1458a_100010217541_100000210202 [2,0,0,0,0,0|2,0,0]=4 537 B14R1.3417 CCC(=O)Cc1ccc(cc1OC)F 1458a_100000062011_100000210202 [2,0,0,0,0,0|2,0,0]=4 538 B14R1.3417 CCC(=O)Cc1ccc(cc1OC)F 1458a_100000210414_200010171551 [2,0,0,0,0,0|2,0,0]=4 539 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)Br 11a_100011279103_100000210414 [2,0,0,0,0,0|2,0,0]=4 540 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)Br 1626a_100011279103_100000210414 [2,0,0,0,0,0|2,0,0]=4 541 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)Br 22a_100011279103_100000210414 [2,0,0,0,0,0|2,0,0]=4 542 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)C 11a_100000746441_100000210414 [2,0,0,0,0,0|1,0,1]=4 543 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)C 1626a_100000746441_100000210414 [2,0,0,0,0,0|1,0,1]=4 544 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)C 22a_100000746441_100000210414 [2,0,0,0,0,0|1,0,1]=4 545 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)C 527a_100000746441_100000210414 [2,0,0,0,0,0|1,0,1]=4 546 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)Cl 11a_100000707585_100000210414 [2,0,0,0,0,0|2,0,0]=4 547 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)Cl 1626a_100000707585_100000210414 [2,0,0,0,0,0|2,0,0]=4 548 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)Cl 22a_100000707585_100000210414 [2,0,0,0,0,0|2,0,0]=4 549 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)F 11a_100000737216_100000210414 [2,0,0,0,0,0|2,0,0]=4 550 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)F 1626a_100000737216_100000210414 [2,0,0,0,0,0|2,0,0]=4 551 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)F 22a_100000737216_100000210414 [2,0,0,0,0,0|2,0,0]=4 552 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)F 527a_100000737216_100000210414 [2,0,0,0,0,0|2,0,0]=4 553 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)I 11a_100015196925_100000210414 [2,0,0,0,0,0|2,0,0]=4 554 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)I 1626a_100015196925_100000210414 [2,0,0,0,0,0|2,0,0]=4 555 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)I 22a_100015196925_100000210414 [2,0,0,0,0,0|2,0,0]=4 556 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)O 22a_100015326901_100000210414 [2,0,0,0,0,0|1,0,1]=4 557 B14R1.3417 CCC(=O)Nc1ccc(cc1OC)O 527a_100015326901_100000210414 [2,0,0,0,0,0|1,0,1]=4 558 B14R1.1600 COc1cc(ccc1C=CC(C)C)Br 271570a_100016257149_100010245111 [2,0,0,0,0,0|2,0,0]=4 559 B14R1.1600 COc1cc(ccc1C=CC(C)C)C 271570a_100016257149_100010200004 [2,0,0,0,0,0|1,0,1]=4 560 B14R1.1600 COc1cc(ccc1C=CC(C)C)Cl 271570a_100016257149_100000050115 [2,0,0,0,0,0|2,0,0]=4 561 B14R1.1600 COc1cc(ccc1C=CC(C)C)F 271570a_100016257149_100000757151 [2,0,0,0,0,0|2,0,0]=4 562 B14R1.1600 COc1cc(ccc1C=CC(C)C)N 271570a_100016257149_100000765947 [2,0,0,0,0,0|2,0,0]=4 563 B14R1.1600 COc1cc(ccc1C=CC(C)C)O 271570a_100016257149_100011827694 [2,0,0,0,0,0|1,0,1]=4 564 B14R1.1600 COc1cc(ccc1OCC(C)C)Br 34a_100000694246_100000210624 [2,0,0,0,0,0|1,0,1]=4 565 B14R1.1600 COc1cc(ccc1OCC(C)C)Br 7a_100000694246_100000210760 [2,0,0,0,0,0|1,0,1]=4 566 B14R1.1600 COc1cc(ccc1OCC(C)C)C 34a_100000186466_100000210624 [2,0,0,0,0,0|0,0,2]=4 567 B14R1.1600 COc1cc(ccc1OCC(C)C)Cl 34a_100000033002_100000210624 [2,0,0,0,0,0|1,0,1]=4 568 B14R1.1600 COc1cc(ccc1OCC(C)C)F 34a_100000036057_100000210624 [2,0,0,0,0,0|1,0,1]=4 569 B14R1.1600 COc1cc(ccc1OCC(C)C)F 7a_100000036057_100000210760 [2,0,0,0,0,0|1,0,1]=4 570 B14R1.1600 COc1cc(ccc1OCC(C)C)I 34a_100000049635_100000210624 [2,0,0,0,0,0|1,0,1]=4 571 B14R1.1600 COc1cc(ccc1OCC(C)C)N 34a_100000726020_100000210624 [2,0,0,0,0,0|1,0,1]=4 572 B14R1.3135 CC(C)C(=O)Nc1ccccc1N[13CH3] 2230a_200011193546_200025704644 [2,0,0,0,0,0|2,0,0]=4 573 B14R1.3135 CC(C)C(=O)Nc1ccccc1N[13CH3] 34a_200011193546_200025704644 [2,0,0,0,0,0|2,0,0]=4 574 B14R1.3135 CCc1ccccc1NC(=O)C(C)C 11a_100000212081_100000210198 [2,0,0,0,0,0|2,0,0]=4 575 B14R1.3135 CCc1ccccc1NC(=O)C(C)C 1626a_100000212081_100000210198 [2,0,0,0,0,0|2,0,0]=4 576 B14R1.3135 CCc1ccccc1NC(=O)C(C)C 22a_100000212081_100000210198 [2,0,0,0,0,0|2,0,0]=4 577 B14R1.3135 CCc1ccccc1NC(=O)C(C)C 527a_100000212081_100000210198 [2,0,0,0,0,0|2,0,0]=4 578 B14R1.3135 CNc1ccccc1NC(=O)C(C)C 2230a_200011193546_200000210301 [2,0,0,0,0,0|2,0,0]=4 579 B14R1.3135 CNc1ccccc1NC(=O)C(C)C 34a_200011193546_200000210301 [2,0,0,0,0,0|2,0,0]=4 580 B14R1.3135 COc1ccccc1CC(=O)C(C)C 1458a_100000210198_100000210004 [2,0,0,0,0,0|1,0,0]=3 581 B14R1.3135 COc1ccccc1CC(=O)C(C)C 1458a_100000211604_100000210206 [2,0,0,0,0,0|1,0,0]=3 582 B14R1.3135 COc1ccccc1CC(=O)C(C)F 1458a_100000062450_100000210004 [2,0,0,0,0,0|2,0,0]=4 583 B14R1.3135 COc1ccccc1CC(=O)N(C)C 11a_100102631434_100000211604 [2,0,0,0,0,0|2,0,0]=4 584 B14R1.3135 COc1ccccc1CC(=O)N(C)C 1626a_100102631434_100000211604 [2,0,0,0,0,0|2,0,0]=4 585 B14R1.3135 COc1ccccc1CC(=O)N(C)C 240690a_100102631434_100000211604 [2,0,0,0,0,0|2,0,0]=4 586 B14R1.3135 COc1ccccc1CC(=O)N(C)C 527a_100102631434_100000211604 [2,0,0,0,0,0|2,0,0]=4 587 B14R1.3135 COc1ccccc1CC(=O)[C@@H](C)O 1458a_100000717761_100000210004 [2,0,0,0,0,0|2,0,0]=4 588 B14R1.3135 COc1ccccc1CC(=O)[C@H](C)O 1458a_217856618621_100000210004 [2,0,0,0,0,0|2,0,0]=4 589 B14R1.3135 COc1ccccc1NC(=O)C(C)C 11a_100000210025_100000210198 [2,0,0,0,0,0|1,0,0]=3 590 B14R1.3135 COc1ccccc1NC(=O)C(C)C 1626a_100000210025_100000210198 [2,0,0,0,0,0|1,0,0]=3 591 B14R1.3135 COc1ccccc1NC(=O)C(C)C 22a_100000210025_100000210198 [2,0,0,0,0,0|1,0,0]=3 592 B14R1.3135 COc1ccccc1NC(=O)C(C)C 527a_100000210025_100000210198 [2,0,0,0,0,0|1,0,0]=3 593 B14R1.3135 COc1ccccc1NC(=O)C(C)F 11a_100000210025_100000062450 [2,0,0,0,0,0|2,0,0]=4 594 B14R1.3135 COc1ccccc1NC(=O)C(C)F 1626a_100000210025_100000062450 [2,0,0,0,0,0|2,0,0]=4 595 B14R1.3135 COc1ccccc1NC(=O)C(C)F 22a_100000210025_100000062450 [2,0,0,0,0,0|2,0,0]=4 596 B14R1.3135 COc1ccccc1NC(=O)C(C)F 527a_100000210025_100000062450 [2,0,0,0,0,0|2,0,0]=4 597 B14R1.3135 COc1ccccc1NC(=O)N(C)C 2430a_100000210025_100102631434 [2,0,0,0,0,0|2,0,0]=4 598 B14R1.3135 COc1ccccc1NC(=O)[C@@H](C)O 22a_100000210025_100000717761 [2,0,0,0,0,0|2,0,0]=4 599 B14R1.3135 COc1ccccc1NC(=O)[C@H](C)O 1626a_100000210025_217856618621 [2,0,0,0,0,0|2,0,0]=4 600 B14R1.3135 COc1ccccc1NC(=O)[C@H](C)O 22a_100000210025_217856618621 [2,0,0,0,0,0|2,0,0]=4 601 B14R1.3135 COc1cnccc1CC(=O)C(C)C 1458a_100000210198_100020635607 [2,0,0,0,0,0|2,0,0]=4 602 B14R1.3135 COc1ncccc1CC(=O)C(C)C 1458a_100000210198_100020631285 [2,0,0,0,0,0|2,0,0]=4 603 B14R1.3135 CSc1ccccc1CC(=O)C(C)C 1458a_100000210198_100000699184 [2,0,0,0,0,0|1,1,0]=4 604 B14R1.3135 CSc1ccccc1NC(=O)C(C)C 11a_100000211160_100000210198 [2,0,0,0,0,0|1,1,0]=4 605 B14R1.3135 CSc1ccccc1NC(=O)C(C)C 22a_100000211160_100000210198 [2,0,0,0,0,0|1,1,0]=4 606 B16R1.6701 CC(=O)c1ccc(c(c1)Br)CC(=O)C(C)C 1458a_100000210198_100010884425 [1,1,0,0,0,0|2,0,0]=4 607 B16R1.6701 CC(C)C(=O)Nc1ccc(cc1O)C(=O)N 22a_100011850428_100000210198 [1,1,0,0,0,0|1,0,0]=3 608 B16R1.6701 CC(C)C(=O)Nc1ccc(cc1O)C(=O)N 527a_100011850428_100000210198 [1,1,0,0,0,0|1,0,0]=3 609 B16R1.6701 CC(C)C(=O)Nc1ccc(cc1O)[N+](=O)[O-] 22a_100000210499_100000210198 [1,1,0,0,0,0|2,0,0]=4 610 B16R1.6701 CC(C)C(=O)Nc1ccc(cc1O)[N+](=O)[O-] 527a_100000210499_100000210198 [1,1,0,0,0,0|2,0,0]=4 611 B16R1.6701 CC(F)C(=O)Nc1ccc(cc1O)C(=O)N 22a_100011850428_100000062450 [1,1,0,0,0,0|2,0,0]=4 612 B16R1.6701 CC(F)C(=O)Nc1ccc(cc1O)C(=O)N 527a_100011850428_100000062450 [1,1,0,0,0,0|2,0,0]=4 613 B16R1.6701 C[C@@H](O)C(=O)Nc1ccc(cc1O)C(=O)N 22a_100011850428_100000717761 [1,1,0,0,0,0|2,0,0]=4 614 B16R1.6701 C[C@H](O)C(=O)Nc1ccc(cc1O)C(=O)N 22a_100011850428_217856618621 [1,1,0,0,0,0|2,0,0]=4 615 B16R1.6701 Cc1cc(ccc1CC(=O)C(C)C)[N+](=O)[O-] 1458a_100000210198_100010218038 [1,1,0,0,0,0|2,0,0]=4 616 B16R1.6701 Cc1cc(ccc1NC(=O)C(C)C)C(=O)N 11a_100000746439_100000210198 [1,1,0,0,0,0|1,0,0]=3 617 B16R1.6701 Cc1cc(ccc1NC(=O)C(C)C)C(=O)N 1626a_100000746439_100000210198 [1,1,0,0,0,0|1,0,0]=3 618 B16R1.6701 Cc1cc(ccc1NC(=O)C(C)C)C(=O)N 22a_100000746439_100000210198 [1,1,0,0,0,0|1,0,0]=3 619 B16R1.6701 Cc1cc(ccc1NC(=O)C(C)C)C(=O)N 527a_100000746439_100000210198 [1,1,0,0,0,0|1,0,0]=3 620 B16R1.6701 Cc1cc(ccc1NC(=O)C(C)C)[N+](=O)[O-] 11a_100000184110_100000210198 [1,1,0,0,0,0|2,0,0]=4 621 B16R1.6701 Cc1cc(ccc1NC(=O)C(C)F)C(=O)N 11a_100000746439_100000062450 [1,1,0,0,0,0|2,0,0]=4 622 B16R1.6701 Cc1cc(ccc1NC(=O)C(C)F)C(=O)N 1626a_100000746439_100000062450 [1,1,0,0,0,0|2,0,0]=4 623 B16R1.6701 Cc1cc(ccc1NC(=O)C(C)F)C(=O)N 22a_100000746439_100000062450 [1,1,0,0,0,0|2,0,0]=4 624 B16R1.6701 Cc1cc(ccc1NC(=O)C(C)F)C(=O)N 527a_100000746439_100000062450 [1,1,0,0,0,0|2,0,0]=4 625 B16R1.6701 Cc1cc(ccc1NC(=O)N(C)C)C(=O)N 2430a_100000746439_100102631434 [1,1,0,0,0,0|2,0,0]=4 626 B16R1.6701 Cc1cc(ccc1NC(=O)[C@@H](C)O)C(=O)N 22a_100000746439_100000717761 [1,1,0,0,0,0|2,0,0]=4 627 B16R1.6701 Cc1cc(ccc1NC(=O)[C@H](C)O)C(=O)N 1626a_100000746439_217856618621 [1,1,0,0,0,0|2,0,0]=4 628 B16R1.6701 Cc1cc(ccc1NC(=O)[C@H](C)O)C(=O)N 22a_100000746439_217856618621 [1,1,0,0,0,0|2,0,0]=4 629 B16R1.2190 C=Cc1ccc(c(c1)OC)NC(=O)NCC 271570a_100011290941_200024401162 [1,1,0,0,0,0|2,0,0]=4 630 B16R1.18493 CCC(=O)Cc1ccc(cc1OC)[N+](=O)[O-] 1458a_100000210414_100010150584 [1,1,0,0,0,0|2,0,0]=4 631 B16R1.18493 CCC(=O)Nc1ccc(cc1OC)C(=O)N 11a_100011850419_100000210414 [1,1,0,0,0,0|1,0,0]=3 632 B16R1.18493 CCC(=O)Nc1ccc(cc1OC)C(=O)N 1626a_100011850419_100000210414 [1,1,0,0,0,0|1,0,0]=3 633 B16R1.18493 CCC(=O)Nc1ccc(cc1OC)C(=O)N 22a_100011850419_100000210414 [1,1,0,0,0,0|1,0,0]=3 634 B16R1.18493 CCC(=O)Nc1ccc(cc1OC)C(=O)N 527a_100011850419_100000210414 [1,1,0,0,0,0|1,0,0]=3 635 B16R1.18493 CCC(=O)Nc1ccc(cc1OC)[N+](=O)[O-] 11a_100000211086_100000210414 [1,1,0,0,0,0|2,0,0]=4 636 B16R1.18493 CCC(=O)Nc1ccc(cc1OC)[N+](=O)[O-] 1626a_100000211086_100000210414 [1,1,0,0,0,0|2,0,0]=4 637 B16R1.18493 CCC(C)Oc1ccc(cc1OC)C(=O)C 34a_100000186468_100011215416 [1,1,0,0,0,0|1,0,1]=4 638 B16R1.18493 CCC(C)Oc1ccc(cc1OC)C(=O)C 7a_100000186468_100000758301 [1,1,0,0,0,0|1,0,1]=4 639 B16R1.18493 CNC(=O)Nc1ccc(cc1OC)C(=O)N 2430a_100011850419_100102657272 [1,1,0,0,0,0|2,0,0]=4 640 B16R1.18493 COc1cc(ccc1NC(=O)CO)C(=O)N 22a_100011850419_100000210174 [1,1,0,0,0,0|2,0,0]=4 641 B16R1.18493 COc1cc(ccc1NC(=O)CO)C(=O)N 527a_100011850419_100000210174 [1,1,0,0,0,0|2,0,0]=4 642 B16R1.5641 C=Cc1ccc(c(c1)OC)OCC(C)(C)C 34a_100011217988_100011219605 [1,1,0,0,0,0|1,0,1]=4 643 B16R1.5641 C=Cc1ccc(c(c1)OC)OCC(C)(C)F 34a_100011217988_100011997219 [1,1,0,0,0,0|1,0,1]=4 644 B16R1.5641 C=Cc1ccc(c(c1)OC)OCC(C)(C)O 34a_100011217988_100000764493 [1,1,0,0,0,0|1,0,1]=4 645 B16R1.5641 COc1cc(ccc1C=CC(C)(C)C)C=O 271570a_100102527731_100010244714 [1,1,0,0,0,0|1,0,0]=3 646 B16R1.5641 COc1cc(ccc1C=CC(C)(C)O)C=O 271570a_200016258132_100010244714 [1,1,0,0,0,0|1,0,0]=3 647 B16R1.5641 COc1cc(ccc1SCC(C)(C)C)C=O 62a_100010244714_100011219605 [1,1,0,0,0,0|0,1,1]=4 648 B16R1.5641 COc1cc(ccc1SCC(C)(C)C)C=O 62a_100011219605_100010244714 [1,1,0,0,0,0|0,1,1]=4 649 B16R1.5641 COc1cc(ccc1SCC(C)(C)F)C=O 62a_100010244714_100011997219 [1,1,0,0,0,0|0,1,1]=4 650 B16R1.5641 COc1cc(ccc1SCC(C)(C)F)C=O 62a_100011997219_100010244714 [1,1,0,0,0,0|0,1,1]=4 651 B16R1.5641 COc1cc(ccc1SCC(C)(C)O)C=O 62a_100000764493_100010244714 [1,1,0,0,0,0|0,1,1]=4 652 B16R1.5641 COc1cc(ccc1SCC(C)(C)O)C=O 62a_100010244714_100000764493 [1,1,0,0,0,0|0,1,1]=4 653 B16R1.9044 CC(C)COc1ccc(cc1SCF)C=O 62a_100015361967_202495808110 [1,1,0,0,0,0|0,1,1]=4 654 B16R1.9044 CC(C)COc1ccc(cc1SCF)C=O 62a_202495808110_100015361967 [1,1,0,0,0,0|0,1,1]=4 655 B16R1.9044 CC=Cc1cc(ccc1OCC(C)C)C=O 271570a_100016259895_202495808110 [1,1,0,0,0,0|1,0,1]=4 656 B16R1.9044 CCOc1cc(ccc1C=CC(C)C)C=O 271570a_100016257149_200010381951 [1,1,0,0,0,0|1,0,0]=3 657 B16R1.9044 CCOc1cc(ccc1C=CC(C)O)C=O 271570a_200011019289_200010381951 [1,1,0,0,0,0|2,0,0]=4 658 B16R1.9044 CCOc1cc(ccc1SCC(C)C)C=O 62a_100000210624_200010381951 [1,1,0,0,0,0|0,1,1]=4 659 B16R1.9044 CCOc1cc(ccc1SCC(C)C)C=O 62a_200010381951_100000210760 [1,1,0,0,0,0|0,1,1]=4 660 B16R1.9044 CCSc1cc(ccc1OCC(C)C)C=O 62a_100000210202_202495808110 [1,1,0,0,0,0|0,1,1]=4 661 B16R1.9044 CCSc1cc(ccc1OCC(C)C)C=O 62a_202495808110_100000210202 [1,1,0,0,0,0|0,1,1]=4 662 B16R1.13466 C=CCc1ccc(c(c1)OC)OCC(C)C 34a_100000181329_100000210624 [1,1,0,0,0,0|1,0,1]=4 663 B16R1.13466 CC=Cc1ccc(c(c1)OC)OCC(C)C 34a_100015195088_100000210624 [1,1,0,0,0,0|1,0,1]=4 664 B16R1.14579 COc1cc(cc(c1OCC(C)C)O)C=O 271570a_203496583355_100000188545 [1,1,0,0,0,0|0,0,1]=3 665 B16R1.18494 COc1cc(ccc1C=CC(C)C)C(=O)C 271570a_100016257149_100010110075 [1,1,0,0,0,0|1,0,0]=3 666 B16R1.18494 COc1cc(ccc1C=CC(C)C)C(=O)N 271570a_100016257149_100009817049 [1,1,0,0,0,0|1,0,0]=3 667 B16R1.18494 COc1cc(ccc1C=CC(C)O)C(=O)C 271570a_200011019289_100010110075 [1,1,0,0,0,0|2,0,0]=4 668 B16R1.18494 COc1cc(ccc1C=CC(C)O)C(=O)N 271570a_200011019289_100009817049 [1,1,0,0,0,0|2,0,0]=4 669 B16R1.18494 COc1cc(ccc1NCC(C)C)C(=O)N 27a_100000210953_100009817049 [1,1,0,0,0,0|1,0,1]=4 670 B16R1.18494 COc1cc(ccc1NCC(C)C)C(=O)N 34a_100011850419_100000210624 [1,1,0,0,0,0|1,0,1]=4 671 B16R1.18494 COc1cc(ccc1OCC(C)C)C(=O)C 1458a_100000182899_200000210301 [1,1,0,0,0,0|0,0,1]=3 672 B16R1.18494 COc1cc(ccc1OCC(C)C)C(=O)C 34a_100000186468_100000210624 [1,1,0,0,0,0|0,0,1]=3 673 B16R1.18494 COc1cc(ccc1OCC(C)C)C(=O)C 7a_100000186468_100000210760 [1,1,0,0,0,0|0,0,1]=3 674 B16R1.18494 COc1cc(ccc1OCC(C)C)C(=O)[13CH3] 1458a_100000182899_200025704644 [1,1,0,0,0,0|0,0,1]=3 675 B16R1.18494 COc1cc(ccc1OCC(C)C)[N+](=O)[O-] 34a_100000742293_100000210624 [1,1,0,0,0,0|1,0,1]=4 676 B16R1.18494 COc1cc(ccc1OCC(C)C)[N+](=O)[O-] 7a_100000742293_100000210760 [1,1,0,0,0,0|1,0,1]=4 677 B16R1.18494 COc1cc(ccc1OCC(C)O)C(=O)C 34a_100000186468_100011218427 [1,1,0,0,0,0|1,0,1]=4 678 B16R1.18494 COc1cc(ccc1OCC(C)O)C(=O)C 7a_100000186468_100011218427 [1,1,0,0,0,0|1,0,1]=4 679 B16R1.18494 COc1cc(ccc1OC[C@@H](C)O)C(=O)C 34a_100000186468_100009817552 [1,1,0,0,0,0|1,0,1]=4 680 B16R1.18494 COc1cc(ccc1OC[C@@H](C)O)C(=O)C 7a_100000186468_100009817552 [1,1,0,0,0,0|1,0,1]=4 681 B16R1.18494 COc1cc(ccc1SCC(C)C)C(=O)C 62a_100010110075_100000210760 [1,1,0,0,0,0|0,1,1]=4 682 B16R1.18494 COc1cc(ccc1SCC(C)C)C(=O)N 62a_100009817049_100000210760 [1,1,0,0,0,0|0,1,1]=4 683 B16R1.20052 COc1cc(c(cc1C=CC(C)C)F)C=O 271570a_100016257149_100000695681 [1,1,0,0,0,0|1,0,0]=3 684 B16R1.20052 COc1cc(c(cc1C=CC(C)C)O)C=O 271570a_100016257149_100010762608 [1,1,0,0,0,0|1,0,0]=3 685 B16R1.20052 COc1cc(c(cc1C=CC(C)O)F)C=O 271570a_200011019289_100000695681 [1,1,0,0,0,0|2,0,0]=4 686 B16R1.20052 COc1cc(c(cc1C=CC(C)O)O)C=O 271570a_200011019289_100010762608 [1,1,0,0,0,0|2,0,0]=4 687 B16R1.20052 COc1cc(c(cc1SCC(C)C)F)C=O 62a_100000210624_100000695681 [1,1,0,0,0,0|0,1,1]=4 688 B16R1.20052 COc1cc(c(cc1SCC(C)C)F)C=O 62a_100000695681_100000210760 [1,1,0,0,0,0|0,1,1]=4 689 B16R1.20052 COc1cc(c(cc1SCC(C)C)O)C=O 62a_100000210624_100010762608 [1,1,0,0,0,0|0,1,1]=4 690 B16R1.20052 COc1cc(c(cc1SCC(C)C)O)C=O 62a_100010762608_100000210760 [1,1,0,0,0,0|0,1,1]=4 691 B16R1.20139 C=C(C)c1cc(ccc1OCC(C)C)C=O 271570a_100000694244_202495808110 [1,1,0,0,0,0|1,0,1]=4 692 B16R1.20144 COc1c(ccc(c1F)C=O)C=CC(C)C 271570a_100016257149_200010981996 [1,1,0,0,0,0|1,0,0]=3 693 B16R1.20144 COc1c(ccc(c1F)C=O)C=CC(C)O 271570a_200011019289_200010981996 [1,1,0,0,0,0|2,0,0]=4 694 B16R1.20144 COc1c(ccc(c1F)C=O)SCC(C)C 62a_100000210624_200010981996 [1,1,0,0,0,0|0,1,1]=4 695 B16R1.20144 COc1c(ccc(c1F)C=O)SCC(C)C 62a_200010981996_100000210760 [1,1,0,0,0,0|0,1,1]=4 696 B16R1.20195 COc1cc(ccc1[C@@H](N)CC(C)C)C=O 271570a_100015190218_100010244714 [1,1,0,0,0,0|1,0,1]=4 697 B16R1.20197 C=Cc1ccc(c(c1)OC)OCC(C)CC 34a_100011217988_100000748023 [1,1,0,0,0,0|1,0,1]=4 698 B16R1.20197 C=Cc1ccc(c(c1)OC)OC[C@@H](C)CC 34a_100011217988_100009816398 [1,1,0,0,0,0|1,0,1]=4 699 B16R1.20197 C=Cc1ccc(c(c1)OC)OC[C@@H](C)CO 34a_100011217988_100000059175 [1,1,0,0,0,0|1,0,1]=4 700 B16R1.20197 CCC(C)CSc1ccc(cc1OC)C=O 62a_100000748023_100010244714 [1,1,0,0,0,0|0,1,1]=4 701 B16R1.20197 CCC(C)CSc1ccc(cc1OC)C=O 62a_100010244714_100000748023 [1,1,0,0,0,0|0,1,1]=4 702 B16R1.20197 CC[C@H](C)CSc1ccc(cc1OC)C=O 62a_100009816398_100010244714 [1,1,0,0,0,0|0,1,1]=4 703 B16R1.20197 CC[C@H](C)CSc1ccc(cc1OC)C=O 62a_100010244714_100009816398 [1,1,0,0,0,0|0,1,1]=4 704 B16R1.20197 COc1cc(ccc1SC[C@@H](C)CO)C=O 62a_100000059175_100010244714 [1,1,0,0,0,0|0,1,1]=4 705 B16R1.20197 COc1cc(ccc1SC[C@@H](C)CO)C=O 62a_100010244714_100000059175 [1,1,0,0,0,0|0,1,1]=4 706 B16R1.4714 COc1cc(ccc1CC(=O)C(C)(C)C)Br 1458a_106744555173_100012359436 [1,1,0,0,0,0|2,0,0]=4 707 B16R1.4714 COc1cc(ccc1CC(=O)C(C)(C)C)F 1458a_106744555173_200010171551 [1,1,0,0,0,0|2,0,0]=4 708 B16R1.4714 COc1cc(ccc1CC(=O)C(C)(C)F)Br 1458a_100000765255_100012359436 [1,1,0,0,0,0|2,0,0]=4 709 B16R1.4714 COc1cc(ccc1CC(=O)C(C)(C)F)F 1458a_100000765255_200010171551 [1,1,0,0,0,0|2,0,0]=4 710 B16R1.4714 COc1cc(ccc1CC(=O)C(C)(C)O)Br 1458a_100000242741_100012359436 [1,1,0,0,0,0|2,0,0]=4 711 B16R1.4714 COc1cc(ccc1CC(=O)C(C)(C)O)F 1458a_100000242741_200010171551 [1,1,0,0,0,0|2,0,0]=4 712 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)Br 11a_100011279103_106744555173 [1,1,0,0,0,0|2,0,0]=4 713 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)Br 1626a_100011279103_106744555173 [1,1,0,0,0,0|2,0,0]=4 714 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)Br 22a_100011279103_106744555173 [1,1,0,0,0,0|2,0,0]=4 715 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)C 11a_100000746441_106744555173 [1,1,0,0,0,0|1,0,1]=4 716 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)C 1626a_100000746441_106744555173 [1,1,0,0,0,0|1,0,1]=4 717 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)C 22a_100000746441_106744555173 [1,1,0,0,0,0|1,0,1]=4 718 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)C 527a_100000746441_106744555173 [1,1,0,0,0,0|1,0,1]=4 719 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)Cl 11a_100000707585_106744555173 [1,1,0,0,0,0|2,0,0]=4 720 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)Cl 1626a_100000707585_106744555173 [1,1,0,0,0,0|2,0,0]=4 721 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)Cl 22a_100000707585_106744555173 [1,1,0,0,0,0|2,0,0]=4 722 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)F 11a_100000737216_106744555173 [1,1,0,0,0,0|2,0,0]=4 723 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)F 1626a_100000737216_106744555173 [1,1,0,0,0,0|2,0,0]=4 724 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)F 22a_100000737216_106744555173 [1,1,0,0,0,0|2,0,0]=4 725 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)F 527a_100000737216_106744555173 [1,1,0,0,0,0|2,0,0]=4 726 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)I 11a_100015196925_106744555173 [1,1,0,0,0,0|2,0,0]=4 727 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)I 1626a_100015196925_106744555173 [1,1,0,0,0,0|2,0,0]=4 728 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)I 22a_100015196925_106744555173 [1,1,0,0,0,0|2,0,0]=4 729 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)O 22a_100015326901_106744555173 [1,1,0,0,0,0|1,0,1]=4 730 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)C)O 527a_100015326901_106744555173 [1,1,0,0,0,0|1,0,1]=4 731 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)Br 11a_100011279103_100000765255 [1,1,0,0,0,0|2,0,0]=4 732 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)Br 1626a_100011279103_100000765255 [1,1,0,0,0,0|2,0,0]=4 733 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)Br 22a_100011279103_100000765255 [1,1,0,0,0,0|2,0,0]=4 734 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)C 11a_100000746441_100000765255 [1,1,0,0,0,0|1,0,1]=4 735 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)C 1626a_100000746441_100000765255 [1,1,0,0,0,0|1,0,1]=4 736 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)C 22a_100000746441_100000765255 [1,1,0,0,0,0|1,0,1]=4 737 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)C 527a_100000746441_100000765255 [1,1,0,0,0,0|1,0,1]=4 738 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)Cl 11a_100000707585_100000765255 [1,1,0,0,0,0|2,0,0]=4 739 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)Cl 1626a_100000707585_100000765255 [1,1,0,0,0,0|2,0,0]=4 740 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)Cl 22a_100000707585_100000765255 [1,1,0,0,0,0|2,0,0]=4 741 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)F 11a_100000737216_100000765255 [1,1,0,0,0,0|2,0,0]=4 742 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)F 1626a_100000737216_100000765255 [1,1,0,0,0,0|2,0,0]=4 743 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)F 22a_100000737216_100000765255 [1,1,0,0,0,0|2,0,0]=4 744 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)F 527a_100000737216_100000765255 [1,1,0,0,0,0|2,0,0]=4 745 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)I 11a_100015196925_100000765255 [1,1,0,0,0,0|2,0,0]=4 746 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)I 1626a_100015196925_100000765255 [1,1,0,0,0,0|2,0,0]=4 747 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)I 22a_100015196925_100000765255 [1,1,0,0,0,0|2,0,0]=4 748 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)O 22a_100015326901_100000765255 [1,1,0,0,0,0|1,0,1]=4 749 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)F)O 527a_100015326901_100000765255 [1,1,0,0,0,0|1,0,1]=4 750 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)O)Br 22a_100011279103_100000242741 [1,1,0,0,0,0|2,0,0]=4 751 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)O)C 22a_100000746441_100000242741 [1,1,0,0,0,0|1,0,1]=4 752 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)O)Cl 22a_100000707585_100000242741 [1,1,0,0,0,0|2,0,0]=4 753 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)O)F 22a_100000737216_100000242741 [1,1,0,0,0,0|2,0,0]=4 754 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)O)I 22a_100015196925_100000242741 [1,1,0,0,0,0|2,0,0]=4 755 B16R1.4714 COc1cc(ccc1NC(=O)C(C)(C)O)O 22a_100015326901_100000242741 [1,1,0,0,0,0|1,0,1]=4 756 B16R1.4754 CCC(C)C(=O)Cc1ccc(cc1OC)Br 1458a_100010245118_100000758301 [1,1,0,0,0,0|2,0,0]=4 757 B16R1.4754 CCC(C)C(=O)Cc1ccc(cc1OC)Br 1458a_100011192722_100012359436 [1,1,0,0,0,0|2,0,0]=4 758 B16R1.4754 CCC(C)C(=O)Cc1ccc(cc1OC)Cl 1458a_100010217541_100000758301 [1,1,0,0,0,0|2,0,0]=4 759 B16R1.4754 CCC(C)C(=O)Cc1ccc(cc1OC)F 1458a_100000062011_100000758301 [1,1,0,0,0,0|2,0,0]=4 760 B16R1.4754 CCC(C)C(=O)Cc1ccc(cc1OC)F 1458a_100011192722_200010171551 [1,1,0,0,0,0|2,0,0]=4 761 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)Br 11a_100011279103_100011192722 [1,1,0,0,0,0|2,0,0]=4 762 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)Br 1626a_100011279103_100011192722 [1,1,0,0,0,0|2,0,0]=4 763 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)Br 22a_100011279103_100011192722 [1,1,0,0,0,0|2,0,0]=4 764 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)C 11a_100000746441_100011192722 [1,1,0,0,0,0|1,0,1]=4 765 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)C 1626a_100000746441_100011192722 [1,1,0,0,0,0|1,0,1]=4 766 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)C 22a_100000746441_100011192722 [1,1,0,0,0,0|1,0,1]=4 767 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)C 527a_100000746441_100011192722 [1,1,0,0,0,0|1,0,1]=4 768 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)Cl 11a_100000707585_100011192722 [1,1,0,0,0,0|2,0,0]=4 769 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)Cl 1626a_100000707585_100011192722 [1,1,0,0,0,0|2,0,0]=4 770 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)Cl 22a_100000707585_100011192722 [1,1,0,0,0,0|2,0,0]=4 771 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)F 11a_100000737216_100011192722 [1,1,0,0,0,0|2,0,0]=4 772 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)F 1626a_100000737216_100011192722 [1,1,0,0,0,0|2,0,0]=4 773 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)F 22a_100000737216_100011192722 [1,1,0,0,0,0|2,0,0]=4 774 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)F 527a_100000737216_100011192722 [1,1,0,0,0,0|2,0,0]=4 775 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)I 11a_100015196925_100011192722 [1,1,0,0,0,0|2,0,0]=4 776 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)I 1626a_100015196925_100011192722 [1,1,0,0,0,0|2,0,0]=4 777 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)I 22a_100015196925_100011192722 [1,1,0,0,0,0|2,0,0]=4 778 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)O 22a_100015326901_100011192722 [1,1,0,0,0,0|1,0,1]=4 779 B16R1.4754 CCC(C)C(=O)Nc1ccc(cc1OC)O 527a_100015326901_100011192722 [1,1,0,0,0,0|1,0,1]=4 780 B16R1.4754 COc1cc(ccc1CC(=O)C(C)OC)Br 1458a_100000743197_100012359436 [1,1,0,0,0,0|2,0,0]=4 781 B16R1.4754 COc1cc(ccc1CC(=O)C(C)OC)F 1458a_100000743197_200010171551 [1,1,0,0,0,0|2,0,0]=4 782 B16R1.4754 COc1cc(ccc1CC(=O)C(C)SC)Br 1458a_100000149566_100012359436 [1,1,0,0,0,0|2,0,0]=4 783 B16R1.4754 COc1cc(ccc1CC(=O)C(C)SC)F 1458a_100000149566_200010171551 [1,1,0,0,0,0|2,0,0]=4 784 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)Br 11a_100011279103_100000743197 [1,1,0,0,0,0|2,0,0]=4 785 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)Br 1626a_100011279103_100000743197 [1,1,0,0,0,0|2,0,0]=4 786 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)Br 22a_100011279103_100000743197 [1,1,0,0,0,0|2,0,0]=4 787 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)C 11a_100000746441_100000743197 [1,1,0,0,0,0|1,0,1]=4 788 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)C 1626a_100000746441_100000743197 [1,1,0,0,0,0|1,0,1]=4 789 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)C 22a_100000746441_100000743197 [1,1,0,0,0,0|1,0,1]=4 790 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)C 527a_100000746441_100000743197 [1,1,0,0,0,0|1,0,1]=4 791 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)Cl 11a_100000707585_100000743197 [1,1,0,0,0,0|2,0,0]=4 792 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)Cl 1626a_100000707585_100000743197 [1,1,0,0,0,0|2,0,0]=4 793 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)Cl 22a_100000707585_100000743197 [1,1,0,0,0,0|2,0,0]=4 794 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)F 11a_100000737216_100000743197 [1,1,0,0,0,0|2,0,0]=4 795 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)F 1626a_100000737216_100000743197 [1,1,0,0,0,0|2,0,0]=4 796 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)F 22a_100000737216_100000743197 [1,1,0,0,0,0|2,0,0]=4 797 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)F 527a_100000737216_100000743197 [1,1,0,0,0,0|2,0,0]=4 798 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)I 11a_100015196925_100000743197 [1,1,0,0,0,0|2,0,0]=4 799 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)I 1626a_100015196925_100000743197 [1,1,0,0,0,0|2,0,0]=4 800 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)I 22a_100015196925_100000743197 [1,1,0,0,0,0|2,0,0]=4 801 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)O 22a_100015326901_100000743197 [1,1,0,0,0,0|1,0,1]=4 802 B16R1.4754 COc1cc(ccc1NC(=O)C(C)OC)O 527a_100015326901_100000743197 [1,1,0,0,0,0|1,0,1]=4 803 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)Br 11a_100011279103_100000149566 [1,1,0,0,0,0|2,0,0]=4 804 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)Br 1626a_100011279103_100000149566 [1,1,0,0,0,0|2,0,0]=4 805 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)Br 22a_100011279103_100000149566 [1,1,0,0,0,0|2,0,0]=4 806 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)C 11a_100000746441_100000149566 [1,1,0,0,0,0|1,0,1]=4 807 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)C 1626a_100000746441_100000149566 [1,1,0,0,0,0|1,0,1]=4 808 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)C 22a_100000746441_100000149566 [1,1,0,0,0,0|1,0,1]=4 809 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)C 527a_100000746441_100000149566 [1,1,0,0,0,0|1,0,1]=4 810 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)Cl 11a_100000707585_100000149566 [1,1,0,0,0,0|2,0,0]=4 811 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)Cl 1626a_100000707585_100000149566 [1,1,0,0,0,0|2,0,0]=4 812 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)Cl 22a_100000707585_100000149566 [1,1,0,0,0,0|2,0,0]=4 813 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)F 11a_100000737216_100000149566 [1,1,0,0,0,0|2,0,0]=4 814 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)F 1626a_100000737216_100000149566 [1,1,0,0,0,0|2,0,0]=4 815 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)F 22a_100000737216_100000149566 [1,1,0,0,0,0|2,0,0]=4 816 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)F 527a_100000737216_100000149566 [1,1,0,0,0,0|2,0,0]=4 817 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)I 11a_100015196925_100000149566 [1,1,0,0,0,0|2,0,0]=4 818 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)I 1626a_100015196925_100000149566 [1,1,0,0,0,0|2,0,0]=4 819 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)I 22a_100015196925_100000149566 [1,1,0,0,0,0|2,0,0]=4 820 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)O 22a_100015326901_100000149566 [1,1,0,0,0,0|1,0,1]=4 821 B16R1.4754 COc1cc(ccc1NC(=O)C(C)SC)O 527a_100015326901_100000149566 [1,1,0,0,0,0|1,0,1]=4 822 B16R1.4768 COc1cc(ccc1N(C)C(=O)C(C)C)Cl 11a_100000061351_100000210198 [1,1,0,0,0,0|2,0,0]=4 823 B16R1.4768 COc1cc(ccc1N(C)C(=O)C(C)C)Cl 1626a_100000061351_100000210198 [1,1,0,0,0,0|2,0,0]=4 824 B16R1.4768 COc1cc(ccc1N(C)C(=O)C(C)C)F 11a_100020633920_100000210198 [1,1,0,0,0,0|2,0,0]=4 825 B16R1.4768 COc1cc(ccc1N(C)C(=O)C(C)C)F 1626a_100020633920_100000210198 [1,1,0,0,0,0|2,0,0]=4 826 B16R1.4768 COc1cc(ccc1N(C)C(=O)C(C)C)F 22a_100020633920_100000210198 [1,1,0,0,0,0|2,0,0]=4 827 B16R1.11625 COc1cc(cc(c1NC(=O)C(C)C)Br)Br 11a_100010253907_100000210198 [1,1,0,0,0,0|2,0,0]=4 828 B16R1.11625 COc1cc(cc(c1NC(=O)C(C)C)Br)Cl 11a_200010138668_100000210198 [1,1,0,0,0,0|2,0,0]=4 829 B16R1.11625 COc1cc(cc(c1NC(=O)C(C)C)Br)Cl 1626a_200010138668_100000210198 [1,1,0,0,0,0|2,0,0]=4 830 B16R1.11625 COc1cc(cc(c1NC(=O)C(C)C)Br)F 11a_100011004115_100000210198 [1,1,0,0,0,0|2,0,0]=4 831 B16R1.11625 COc1cc(cc(c1NC(=O)C(C)C)Br)F 1626a_100011004115_100000210198 [1,1,0,0,0,0|2,0,0]=4 832 B16R1.11625 COc1cc(cc(c1NC(=O)C(C)C)C)Br 11a_100000741850_100000210198 [1,1,0,0,0,0|2,0,0]=4 833 B16R1.11625 COc1cc(cc(c1NC(=O)C(C)C)C)Br 1626a_100000741850_100000210198 [1,1,0,0,0,0|2,0,0]=4 834 B16R1.11625 COc1cc(cc(c1NC(=O)C(C)C)C)Br 22a_100000741850_100000210198 [1,1,0,0,0,0|2,0,0]=4 835 B16R1.11625 COc1cc(cc(c1NC(=O)C(C)C)Cl)Cl 11a_100009955935_100000210198 [1,1,0,0,0,0|2,0,0]=4 836 B16R1.11625 COc1cc(cc(c1NC(=O)C(C)C)Cl)Cl 1626a_100009955935_100000210198 [1,1,0,0,0,0|2,0,0]=4 837 B16R1.11625 COc1cc(cc(c1NC(=O)C(C)C)Cl)Cl 22a_100009955935_100000210198 [1,1,0,0,0,0|2,0,0]=4 838 B16R1.12777 CCOc1cc(ccc1NC(=O)C(C)C)Br 11a_100000688918_100000210198 [1,1,0,0,0,0|2,0,0]=4 839 B16R1.12777 CCOc1cc(ccc1NC(=O)C(C)C)Br 1626a_100000688918_100000210198 [1,1,0,0,0,0|2,0,0]=4 840 B16R1.12777 CCOc1cc(ccc1NC(=O)C(C)C)Br 22a_100000688918_100000210198 [1,1,0,0,0,0|2,0,0]=4 841 B16R1.12777 CCOc1cc(ccc1NC(=O)C(C)C)C 11a_100000742043_100000210198 [1,1,0,0,0,0|1,0,1]=4 842 B16R1.12777 CCOc1cc(ccc1NC(=O)C(C)C)C 1626a_100000742043_100000210198 [1,1,0,0,0,0|1,0,1]=4 843 B16R1.12777 CCOc1cc(ccc1NC(=O)C(C)C)C 22a_100000742043_100000210198 [1,1,0,0,0,0|1,0,1]=4 844 B16R1.12777 CCOc1cc(ccc1NC(=O)C(C)C)C 527a_100000742043_100000210198 [1,1,0,0,0,0|1,0,1]=4 845 B16R1.12777 CCOc1cc(ccc1NC(=O)C(C)C)Cl 11a_100000687649_100000210198 [1,1,0,0,0,0|2,0,0]=4 846 B16R1.12777 CCOc1cc(ccc1NC(=O)C(C)C)Cl 1626a_100000687649_100000210198 [1,1,0,0,0,0|2,0,0]=4 847 B16R1.12777 CCOc1cc(ccc1NC(=O)C(C)C)Cl 22a_100000687649_100000210198 [1,1,0,0,0,0|2,0,0]=4 848 B16R1.12777 CCOc1cc(ccc1NC(=O)C(C)C)F 11a_100000741351_100000210198 [1,1,0,0,0,0|2,0,0]=4 849 B16R1.12777 CCOc1cc(ccc1NC(=O)C(C)C)F 1626a_100000741351_100000210198 [1,1,0,0,0,0|2,0,0]=4 850 B16R1.12777 CCOc1cc(ccc1NC(=O)C(C)C)F 22a_100000741351_100000210198 [1,1,0,0,0,0|2,0,0]=4 851 B16R1.20067 COc1cc(c(cc1CC(=O)C(C)C)F)F 1458a_100000210198_100009816015 [1,1,0,0,0,0|2,0,0]=4 852 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Br)Cl 11a_100010380671_100000210198 [1,1,0,0,0,0|2,0,0]=4 853 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Br)Cl 1626a_100010380671_100000210198 [1,1,0,0,0,0|2,0,0]=4 854 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Br)Cl 22a_100010380671_100000210198 [1,1,0,0,0,0|2,0,0]=4 855 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Br)F 11a_100012361397_100000210198 [1,1,0,0,0,0|2,0,0]=4 856 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Br)F 1626a_100012361397_100000210198 [1,1,0,0,0,0|2,0,0]=4 857 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Br)F 22a_100012361397_100000210198 [1,1,0,0,0,0|2,0,0]=4 858 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)C)Br 11a_100010141321_100000210198 [1,1,0,0,0,0|2,0,0]=4 859 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)C)Br 1626a_100010141321_100000210198 [1,1,0,0,0,0|2,0,0]=4 860 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)C)Br 22a_100010141321_100000210198 [1,1,0,0,0,0|2,0,0]=4 861 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)C)Cl 11a_100000211396_100000210198 [1,1,0,0,0,0|2,0,0]=4 862 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)C)Cl 1626a_100000211396_100000210198 [1,1,0,0,0,0|2,0,0]=4 863 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)C)Cl 22a_100000211396_100000210198 [1,1,0,0,0,0|2,0,0]=4 864 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Cl)Br 11a_100010212225_100000210198 [1,1,0,0,0,0|2,0,0]=4 865 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Cl)Br 1626a_100010212225_100000210198 [1,1,0,0,0,0|2,0,0]=4 866 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Cl)Br 22a_100010212225_100000210198 [1,1,0,0,0,0|2,0,0]=4 867 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Cl)C 11a_100009868623_100000210198 [1,1,0,0,0,0|1,0,1]=4 868 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Cl)C 1626a_100009868623_100000210198 [1,1,0,0,0,0|1,0,1]=4 869 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Cl)C 22a_100009868623_100000210198 [1,1,0,0,0,0|1,0,1]=4 870 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Cl)F 11a_100012186795_100000210198 [1,1,0,0,0,0|2,0,0]=4 871 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Cl)F 1626a_100012186795_100000210198 [1,1,0,0,0,0|2,0,0]=4 872 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)Cl)F 22a_100012186795_100000210198 [1,1,0,0,0,0|2,0,0]=4 873 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)F)Br 11a_100012766639_100000210198 [1,1,0,0,0,0|2,0,0]=4 874 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)F)Br 1626a_100012766639_100000210198 [1,1,0,0,0,0|2,0,0]=4 875 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)F)Br 22a_100012766639_100000210198 [1,1,0,0,0,0|2,0,0]=4 876 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)F)F 11a_100000732608_100000210198 [1,1,0,0,0,0|2,0,0]=4 877 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)F)F 1626a_100000732608_100000210198 [1,1,0,0,0,0|2,0,0]=4 878 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)F)F 22a_100000732608_100000210198 [1,1,0,0,0,0|2,0,0]=4 879 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)I)Cl 11a_100011011177_100000210198 [1,1,0,0,0,0|2,0,0]=4 880 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)I)Cl 1626a_100011011177_100000210198 [1,1,0,0,0,0|2,0,0]=4 881 B16R1.20067 COc1cc(c(cc1NC(=O)C(C)C)I)Cl 22a_100011011177_100000210198 [1,1,0,0,0,0|2,0,0]=4 882 B16R1.34514 COc1c(ccc(c1Br)F)NC(=O)C(C)C 11a_102516457224_100000210198 [1,1,0,0,0,0|2,0,0]=4 883 B16R1.34514 COc1c(ccc(c1Br)F)NC(=O)C(C)C 1626a_102516457224_100000210198 [1,1,0,0,0,0|2,0,0]=4 884 B16R1.34514 COc1c(ccc(c1Br)F)NC(=O)C(C)C 22a_102516457224_100000210198 [1,1,0,0,0,0|2,0,0]=4 885 B16R1.34514 COc1c(ccc(c1Br)F)NC(=O)C(C)C 527a_102516457224_100000210198 [1,1,0,0,0,0|2,0,0]=4 886 B16R1.34514 COc1c(ccc(c1F)Br)NC(=O)C(C)C 11a_100010734149_100000210198 [1,1,0,0,0,0|2,0,0]=4 887 B16R1.34514 COc1c(ccc(c1F)Br)NC(=O)C(C)C 1626a_100010734149_100000210198 [1,1,0,0,0,0|2,0,0]=4 888 B16R1.34514 COc1c(ccc(c1F)Br)NC(=O)C(C)C 22a_100010734149_100000210198 [1,1,0,0,0,0|2,0,0]=4 889 B16R1.34514 COc1c(ccc(c1F)Br)NC(=O)C(C)C 527a_100010734149_100000210198 [1,1,0,0,0,0|2,0,0]=4 890 B16R1.34514 COc1c(ccc(c1F)F)CC(=O)C(C)C 1458a_100015476223_100000210206 [1,1,0,0,0,0|2,0,0]=4 891 B16R1.34514 COc1c(ccc(c1F)F)NC(=O)C(C)C 11a_100011695293_100000210198 [1,1,0,0,0,0|2,0,0]=4 892 B16R1.34514 COc1c(ccc(c1F)F)NC(=O)C(C)C 1626a_100011695293_100000210198 [1,1,0,0,0,0|2,0,0]=4 893 B16R1.34514 COc1c(ccc(c1F)F)NC(=O)C(C)C 22a_100011695293_100000210198 [1,1,0,0,0,0|2,0,0]=4 894 B16R1.34514 COc1c(ccc(c1F)F)NC(=O)C(C)C 527a_100011695293_100000210198 [1,1,0,0,0,0|2,0,0]=4 895 B16R1.4747 COc1cc(ccc1C(=C(C)C)C)C(=O)C 271570a_200000049429_100010110075 [0,1,0,0,1,0|1,0,1]=4 896 B16R1.4747 COc1cc(ccc1C(=C(C)C)C)C(=O)N 271570a_200000049429_100009817049 [0,1,0,0,1,0|1,0,1]=4 897 B16R1.4747 COc1cc(ccc1C(=O)C(C)C)[N+](=O)[O-] 1458a_100000686327_100000210206 [0,1,0,0,1,0|1,0,0]=3 898 B16R1.4747 COc1cc(ccc1C(=O)N(C)C)[N+](=O)[O-] 11a_100102631434_100000686327 [0,1,0,0,1,0|2,0,0]=4 899 B16R1.4747 COc1cc(ccc1C(=O)N(C)C)[N+](=O)[O-] 1626a_100102631434_100000686327 [0,1,0,0,1,0|2,0,0]=4 900 B16R1.4747 COc1cc(ccc1C(=O)N(C)C)[N+](=O)[O-] 240690a_100102631434_100000686327 [0,1,0,0,1,0|2,0,0]=4 901 B16R1.4747 COc1cc(ccc1C(=O)N(C)C)[N+](=O)[O-] 527a_100102631434_100000686327 [0,1,0,0,1,0|2,0,0]=4 902 B16R1.4747 COc1cc(ccc1N(C)C(C)C)C(=O)N 27a_200000211004_100009817049 [0,1,0,0,1,0|2,0,0]=4 903 B16R1.14649 COc1cc(c(c(c1)OC)C(=O)C(C)C)C 1458a_100000066166_100000210206 [0,1,0,0,1,0|2,0,0]=4 904 B16R1.14649 COc1cc(c(c(c1)OC)C(=O)C(C)C)I 1458a_200015508059_100000210206 [0,1,0,0,1,0|2,0,0]=4 905 B16R1.20046 COc1cc(c(cc1Br)C(=O)C(C)C)OC 1458a_100012350677_100000210206 [0,1,0,0,1,0|2,0,0]=4 906 B16R1.20046 COc1cc(c(cc1C(=C(C)C)C)F)C=O 271570a_200000049429_100000695681 [0,1,0,0,1,0|1,0,1]=4 907 B16R1.20046 COc1cc(c(cc1C(=C(C)C)C)O)C=O 271570a_200000049429_100010762608 [0,1,0,0,1,0|1,0,1]=4 908 B16R1.20143 COc1c(ccc(c1F)C=O)C(=C(C)C)C 271570a_200000049429_200010981996 [0,1,0,0,1,0|1,0,1]=4 909 B16R1.47022 CCOc1cc(ccc1C(=C(C)C)C)C=O 271570a_200000049429_200010381951 [0,1,0,0,1,0|1,0,1]=4 910 B18R1.5449 COc1cc(ccc1CC(=O)CC(C)C)[N+](=O)[O-] 1458a_100000210554_100010150584 [0,1,0,0,0,1|2,0,0]=4 911 B18R1.5449 COc1cc(ccc1NC(=O)C=C(C)C)C(=O)N 11a_100011850419_100000211388 [0,1,0,0,0,1|1,0,1]=4 912 B18R1.5449 COc1cc(ccc1NC(=O)C=C(C)C)C(=O)N 1626a_100011850419_100000211388 [0,1,0,0,0,1|1,0,1]=4 913 B18R1.5449 COc1cc(ccc1NC(=O)C=C(C)C)C(=O)N 22a_100011850419_100000211388 [0,1,0,0,0,1|1,0,1]=4 914 B18R1.5449 COc1cc(ccc1NC(=O)CC(C)C)C(=O)N 11a_100011850419_100000210554 [0,1,0,0,0,1|1,0,0]=3 915 B18R1.5449 COc1cc(ccc1NC(=O)CC(C)C)C(=O)N 1626a_100011850419_100000210554 [0,1,0,0,0,1|1,0,0]=3 916 B18R1.5449 COc1cc(ccc1NC(=O)CC(C)C)C(=O)N 22a_100011850419_100000210554 [0,1,0,0,0,1|1,0,0]=3 917 B18R1.5449 COc1cc(ccc1NC(=O)CC(C)C)C(=O)N 527a_100011850419_100000210554 [0,1,0,0,0,1|1,0,0]=3 918 B18R1.5449 COc1cc(ccc1NC(=O)CC(C)C)[N+](=O)[O-] 11a_100000211086_100000210554 [0,1,0,0,0,1|2,0,0]=4 919 B18R1.5449 COc1cc(ccc1NC(=O)CC(C)C)[N+](=O)[O-] 1626a_100000211086_100000210554 [0,1,0,0,0,1|2,0,0]=4 920 B18R1.5449 COc1cc(ccc1NC(=O)CN(C)C)C(=O)N 11a_100011850419_100000750896 [0,1,0,0,0,1|2,0,0]=4 921 B18R1.5449 COc1cc(ccc1NC(=O)CN(C)C)C(=O)N 22a_100011850419_100000750896 [0,1,0,0,0,1|2,0,0]=4 922 B18R1.5449 COc1cc(ccc1NC(=O)CN(C)C)C(=O)N 527a_100011850419_100000750896 [0,1,0,0,0,1|2,0,0]=4 923 B18R1.5449 COc1cc(ccc1NC(=O)C[C@@H](C)O)C(=O)N 22a_100011850419_100011933948 [0,1,0,0,0,1|2,0,0]=4 924 B18R1.5449 COc1cc(ccc1NC(=O)C[S+](C)C)C(=O)N 11a_100011850419_200159257847 [0,1,0,0,0,1|2,0,0]=4 925 B18R1.5449 COc1cc(ccc1NC(=O)C[S+](C)C)C(=O)N 1626a_100011850419_200159257847 [0,1,0,0,0,1|2,0,0]=4 926 B18R1.5449 COc1cc(ccc1NC(=O)C[S+](C)C)C(=O)N 22a_100011850419_200159257847 [0,1,0,0,0,1|2,0,0]=4 927 B18R1.5449 COc1cc(ccc1NC(=O)C[S+](C)C)C(=O)N 527a_100011850419_200159257847 [0,1,0,0,0,1|2,0,0]=4 928 B18R1.5449 COc1cc(ccc1NC(=O)NC(C)C)C(=O)N 2430a_100011850419_100138425928 [0,1,0,0,0,1|1,0,0]=3 929 B18R1.5449 COc1cc(ccc1NC(=O)NC(C)C)[N+](=O)[O-] 2430a_100000211086_100138425928 [0,1,0,0,0,1|2,0,0]=4 930 B18R1.5449 COc1cc(ccc1OC(C)CC(C)C)C(=O)C 34a_100000186468_100000731052 [0,1,0,0,0,1|1,0,1]=4 931 B18R1.5449 COc1cc(ccc1OC(C)CC(C)C)C(=O)C 7a_100000186468_100000731052 [0,1,0,0,0,1|1,0,1]=4 932 B18R1.7424 C=Cc1ccc(c(c1)OC)NC(=O)OC(C)(C)C 271570a_100011290941_200009828299 [0,1,0,0,0,1|2,0,0]=4 933 B18R1.5486 CC(=O)c1ccc(c(c1)CCl)OCC(=O)C(C)C 34a_100000010293_100000753385 [0,1,0,0,0,1|2,0,0]=4 934 B18R1.5486 CC(=O)c1ccc(c(c1)CCl)OCC(=O)C(C)C 7a_100000010293_100000753385 [0,1,0,0,0,1|2,0,0]=4 935 B18R1.5486 CC(=O)c1ccc(c(c1)CO)OCC(=O)C(C)C 7a_100000025453_100000753385 [0,1,0,0,0,1|2,0,0]=4 936 B18R1.5486 COc1cc(ccc1CCC(=O)N(C)C)C(=O)C 271570a_200010232142_100010110075 [0,1,0,0,0,1|2,0,0]=4 937 B18R1.5486 COc1cc(ccc1CCC(=O)N(C)C)C(=O)N 271570a_200010232142_100009817049 [0,1,0,0,0,1|2,0,0]=4 938 B18R1.5486 COc1cc(ccc1NCC(=O)C(C)C)C(=O)N 34a_100011850419_100000753385 [0,1,0,0,0,1|1,0,0]=3 939 B18R1.5486 COc1cc(ccc1NCC(=O)C(C)C)[N+](=O)[O-] 34a_100000211086_100000753385 [0,1,0,0,0,1|2,0,0]=4 940 B18R1.5486 COc1cc(ccc1NCC(=O)N(C)C)C(=O)N 27a_100015183351_100009817049 [0,1,0,0,0,1|2,0,0]=4 941 B18R1.5486 COc1cc(ccc1NCC(=O)N(C)C)C(=O)N 34a_100011850419_100000692301 [0,1,0,0,0,1|2,0,0]=4 942 B18R1.5486 COc1cc(ccc1OCC(=O)C(=O)C)C(=O)C 34a_100000186468_100011261029 [0,1,0,0,0,1|1,0,1]=4 943 B18R1.5486 COc1cc(ccc1OCC(=O)C(C)C)C(=O)C 34a_100000186468_100000753385 [0,1,0,0,0,1|0,0,0]=2 944 B18R1.5486 COc1cc(ccc1OCC(=O)C(C)C)C(=O)C 7a_100000186468_100000753385 [0,1,0,0,0,1|0,0,0]=2 945 B18R1.5486 COc1cc(ccc1OCC(=O)C(C)C)C(C)O 34a_100000246512_100000753385 [0,1,0,0,0,1|0,0,2]=4 946 B18R1.5486 COc1cc(ccc1OCC(=O)C(C)C)C(C)O 7a_100000246512_100000753385 [0,1,0,0,0,1|0,0,2]=4 947 B18R1.5486 COc1cc(ccc1OCC(=O)C(C)C)[N+](=O)[O-] 34a_100000742293_100000753385 [0,1,0,0,0,1|1,0,0]=3 948 B18R1.5486 COc1cc(ccc1OCC(=O)C(C)C)[N+](=O)[O-] 7a_100000742293_100000753385 [0,1,0,0,0,1|1,0,0]=3 949 B18R1.5486 COc1cc(ccc1OCC(=O)N(C)C)C(=O)C 34a_100000186468_100000692301 [0,1,0,0,0,1|1,0,0]=3 950 B18R1.5486 COc1cc(ccc1OCC(=O)N(C)C)C(=O)C 7a_100000186468_100000692301 [0,1,0,0,0,1|1,0,0]=3 951 B18R1.5486 COc1cc(ccc1OCC(=O)N(C)C)[N+](=O)[O-] 34a_100000742293_100000692301 [0,1,0,0,0,1|2,0,0]=4 952 B18R1.5486 COc1cc(ccc1OCC(=O)N(C)C)[N+](=O)[O-] 7a_100000742293_100000692301 [0,1,0,0,0,1|2,0,0]=4 953 B18R1.5486 COc1cc(ccc1SCC(=O)C(C)C)C(=O)C 62a_100010110075_100000753385 [0,1,0,0,0,1|0,1,0]=3 954 B18R1.5486 COc1cc(ccc1SCC(=O)C(C)C)C(=O)N 62a_100009817049_100000753385 [0,1,0,0,0,1|0,1,0]=3 955 B18R1.5486 COc1cc(ccc1SCC(=O)N(C)C)C(=O)C 62a_100010110075_100000692301 [0,1,0,0,0,1|1,1,0]=4 956 B18R1.5486 COc1cc(ccc1SCC(=O)N(C)C)C(=O)N 62a_100009817049_100000692301 [0,1,0,0,0,1|1,1,0]=4 957 B18R1.7421 C=Cc1ccc(c(c1)OC)OCC(=O)N(C)CC 34a_100011217988_100000738999 [0,1,0,0,0,1|2,0,0]=4 958 B18R1.7421 CCN(C)C(=O)CSc1ccc(cc1OC)C=O 62a_100000738999_100010244714 [0,1,0,0,0,1|1,1,0]=4 959 B18R1.7421 CCN(C)C(=O)CSc1ccc(cc1OC)C=O 62a_100010244714_100000738999 [0,1,0,0,0,1|1,1,0]=4 960 B18R1.7421 COc1cc(ccc1SCC(=O)N(C)OC)C=O 62a_100000764215_100010244714 [0,1,0,0,0,1|1,1,0]=4 961 B18R1.7421 COc1cc(ccc1SCC(=O)N(C)OC)C=O 62a_100010244714_100000764215 [0,1,0,0,0,1|1,1,0]=4 962 B18R1.23804 C/C=C/c1ccc(c(c1)OC)OCC(=O)C(C)C 1458a_100000184084_100000210206 [0,1,0,0,0,1|1,0,0]=3 963 B18R1.23804 C/C=C/c1ccc(c(c1)OC)OCC(=O)N(C)C 11a_100102631434_100000184084 [0,1,0,0,0,1|2,0,0]=4 964 B18R1.23804 C/C=C/c1ccc(c(c1)OC)OCC(=O)N(C)C 1626a_100102631434_100000184084 [0,1,0,0,0,1|2,0,0]=4 965 B18R1.23804 C/C=C/c1ccc(c(c1)OC)OCC(=O)N(C)C 240690a_100102631434_100000184084 [0,1,0,0,0,1|2,0,0]=4 966 B18R1.23804 C/C=C/c1ccc(c(c1)OC)OCC(=O)N(C)C 527a_100102631434_100000184084 [0,1,0,0,0,1|2,0,0]=4 967 B18R1.23804 C=CCc1ccc(c(c1)OC)OCC(=O)C(C)C 1458a_100000010838_100000210206 [0,1,0,0,0,1|1,0,0]=3 968 B18R1.23804 C=CCc1ccc(c(c1)OC)OCC(=O)C(C)C 34a_100000181329_100000753385 [0,1,0,0,0,1|1,0,0]=3 969 B18R1.23804 C=CCc1ccc(c(c1)OC)OCC(=O)N(C)C 11a_100102631434_100000010838 [0,1,0,0,0,1|2,0,0]=4 970 B18R1.23804 C=CCc1ccc(c(c1)OC)OCC(=O)N(C)C 1626a_100102631434_100000010838 [0,1,0,0,0,1|2,0,0]=4 971 B18R1.23804 C=CCc1ccc(c(c1)OC)OCC(=O)N(C)C 240690a_100102631434_100000010838 [0,1,0,0,0,1|2,0,0]=4 972 B18R1.23804 C=CCc1ccc(c(c1)OC)OCC(=O)N(C)C 34a_100000181329_100000692301 [0,1,0,0,0,1|2,0,0]=4 973 B18R1.23804 C=CCc1ccc(c(c1)OC)OCC(=O)N(C)C 527a_100102631434_100000010838 [0,1,0,0,0,1|2,0,0]=4 974 B18R1.23804 CC=Cc1ccc(c(c1)OC)OCC(=O)C(C)C 34a_100015195088_100000753385 [0,1,0,0,0,1|1,0,0]=3 975 B18R1.23804 CC=Cc1ccc(c(c1)OC)OCC(=O)N(C)C 34a_100015195088_100000692301 [0,1,0,0,0,1|2,0,0]=4 976 B18R1.23804 CCCc1ccc(c(c1)OC)OCC(=O)C(C)C 34a_100000012292_100000753385 [0,1,0,0,0,1|1,0,1]=4 977 B18R1.23804 CCCc1ccc(c(c1)OC)OCC(=O)C(C)C 7a_100000012292_100000753385 [0,1,0,0,0,1|1,0,1]=4 978 B18R1.23804 COc1cc(ccc1OCC(=O)C(C)C)CC#N 34a_100000032377_100000753385 [0,1,0,0,0,1|1,0,1]=4 979 B18R1.23804 COc1cc(ccc1OCC(=O)C(C)C)CCBr 34a_100010741665_100000753385 [0,1,0,0,0,1|1,0,1]=4 980 B18R1.23804 COc1cc(ccc1OCC(=O)C(C)C)CCBr 7a_100010741665_100000753385 [0,1,0,0,0,1|1,0,1]=4 981 B18R1.23804 COc1cc(ccc1OCC(=O)C(C)C)CCN 34a_100000756042_100000753385 [0,1,0,0,0,1|1,0,1]=4 982 B18R1.23804 COc1cc(ccc1OCC(=O)C(C)C)CCO 34a_100011215244_100000753385 [0,1,0,0,0,1|0,0,2]=4 983 B18R1.27773 COc1cc(cc(c1OCC(=O)C(C)C)Br)C#N 34a_100000188612_100000753385 [0,1,0,0,0,1|1,0,1]=4 984 B18R1.27773 COc1cc(cc(c1OCC(=O)C(C)C)Br)C#N 7a_100000188612_100000753385 [0,1,0,0,0,1|1,0,1]=4 985 B18R1.27773 COc1cc(cc(c1OCC(=O)C(C)C)C)C#N 34a_200009855753_100000753385 [0,1,0,0,0,1|1,0,1]=4 986 B18R1.27773 COc1cc(cc(c1OCC(=O)C(C)C)C)C#N 7a_200009855753_100000753385 [0,1,0,0,0,1|1,0,1]=4 987 B18R1.27773 COc1cc(cc(c1OCC(=O)C(C)C)Cl)C#N 34a_100000014776_100000753385 [0,1,0,0,0,1|1,0,1]=4 988 B18R1.27773 COc1cc(cc(c1OCC(=O)C(C)C)Cl)C#N 7a_100000014776_100000753385 [0,1,0,0,0,1|1,0,1]=4 989 B18R1.27773 COc1cc(cc(c1OCC(=O)C(C)C)Cl)CO 34a_200000246286_100000753385 [0,1,0,0,0,1|0,0,2]=4 990 B18R1.27773 COc1cc(cc(c1OCC(=O)C(C)C)I)C#N 7a_100000014777_100000753385 [0,1,0,0,0,1|1,0,1]=4 991 B18R1.27773 COc1cc(cc(c1OCC(=O)C(C)C)I)CO 34a_200000022573_100000753385 [0,1,0,0,0,1|0,0,2]=4 992 B18R1.76219 C=Cc1ccc(c(c1)OC)OCC(=O)C(C)(C)C 34a_100011217988_100000229897 [0,1,0,0,0,1|1,0,0]=3 993 B18R1.76219 CCc1ccc(c(c1)OC)OCC(=O)C(C)(C)C 34a_100000186467_100000229897 [0,1,0,0,0,1|1,0,1]=4 994 B18R1.76219 CCc1ccc(c(c1)OC)OCC(=O)C(C)(C)C 7a_100000186467_100000210923 [0,1,0,0,0,1|1,0,1]=4 995 B18R1.76219 COc1cc(ccc1OCC(=O)C(C)(C)C)C#N 34a_100000184589_100000229897 [0,1,0,0,0,1|1,0,1]=4 996 B18R1.76219 COc1cc(ccc1OCC(=O)C(C)(C)C)C#N 7a_100000184589_100000210923 [0,1,0,0,0,1|1,0,1]=4 997 B18R1.76219 COc1cc(ccc1OCC(=O)C(C)(C)C)CN 34a_100000185554_100000229897 [0,1,0,0,0,1|1,0,1]=4 998 B18R1.76219 COc1cc(ccc1SCC(=O)C(C)(C)C)C=O 62a_100000210923_100010244714 [0,1,0,0,0,1|0,1,0]=3 999 B18R1.76219 COc1cc(ccc1SCC(=O)C(C)(C)C)C=O 62a_100010244714_100000210923 [0,1,0,0,0,1|0,1,0]=3 1000 B18R1.76219 COc1ccc(c(c1)OC)OCC(=O)C(C)(C)C 34a_100009840267_100000229897 [0,1,0,0,0,1|2,0,0]=4 1001 B18R1.130682 CCOc1cc(ccc1CCC(=O)N(C)C)C=O 271570a_200010232142_200010381951 [0,1,0,0,0,1|2,0,0]=4 1002 B18R1.130682 CCOc1cc(ccc1OCC(=O)C(C)C)C#N 1458a_100000188621_100000210206 [0,1,0,0,0,1|1,0,1]=4 1003 B18R1.130682 CCOc1cc(ccc1OCC(=O)C(C)C)C#N 34a_100000181481_100000753385 [0,1,0,0,0,1|1,0,1]=4 1004 B18R1.130682 CCOc1cc(ccc1OCC(=O)C(C)C)C#N 7a_100000181481_100000753385 [0,1,0,0,0,1|1,0,1]=4 1005 B18R1.130682 CCOc1cc(ccc1OCC(=O)C(C)C)CN 34a_200000751567_100000753385 [0,1,0,0,0,1|1,0,1]=4 1006 B18R1.130682 CCOc1cc(ccc1OCC(=O)C(C)C)CO 34a_200011232662_100000753385 [0,1,0,0,0,1|0,0,2]=4 1007 B18R1.130682 CCOc1cc(ccc1SCC(=O)C(C)C)C=O 62a_100000753385_200010381951 [0,1,0,0,0,1|0,1,0]=3 1008 B18R1.130682 CCOc1cc(ccc1SCC(=O)C(C)C)C=O 62a_200010381951_100000753385 [0,1,0,0,0,1|0,1,0]=3 1009 B18R1.130682 CCOc1cc(ccc1SCC(=O)N(C)C)C=O 62a_100000692301_200010381951 [0,1,0,0,0,1|1,1,0]=4 1010 B18R1.130682 CCOc1cc(ccc1SCC(=O)N(C)C)C=O 62a_200010381951_100000692301 [0,1,0,0,0,1|1,1,0]=4 1011 B18R1.290035 CCc1cc(c(cc1F)OCC(=O)C(C)C)OC 34a_100000070332_100000753385 [0,1,0,0,0,1|1,0,1]=4 1012 B18R1.290035 CCc1cc(c(cc1F)OCC(=O)C(C)C)OC 7a_100000070332_100000753385 [0,1,0,0,0,1|1,0,1]=4 1013 B18R1.290035 COc1cc(c(cc1CCC(=O)N(C)C)F)C=O 271570a_200010232142_100000695681 [0,1,0,0,0,1|2,0,0]=4 1014 B18R1.290035 COc1cc(c(cc1CCC(=O)N(C)C)O)C=O 271570a_200010232142_100010762608 [0,1,0,0,0,1|2,0,0]=4 1015 B18R1.290035 COc1cc(c(cc1SCC(=O)C(C)C)F)C=O 62a_100000695681_100000753385 [0,1,0,0,0,1|0,1,0]=3 1016 B18R1.290035 COc1cc(c(cc1SCC(=O)C(C)C)F)C=O 62a_100000753385_100000695681 [0,1,0,0,0,1|0,1,0]=3 1017 B18R1.290035 COc1cc(c(cc1SCC(=O)C(C)C)O)C=O 62a_100000753385_100010762608 [0,1,0,0,0,1|0,1,0]=3 1018 B18R1.290035 COc1cc(c(cc1SCC(=O)C(C)C)O)C=O 62a_100010762608_100000753385 [0,1,0,0,0,1|0,1,0]=3 1019 B18R1.290035 COc1cc(c(cc1SCC(=O)N(C)C)F)C=O 62a_100000692301_100000695681 [0,1,0,0,0,1|1,1,0]=4 1020 B18R1.290035 COc1cc(c(cc1SCC(=O)N(C)C)F)C=O 62a_100000695681_100000692301 [0,1,0,0,0,1|1,1,0]=4 1021 B18R1.290035 COc1cc(c(cc1SCC(=O)N(C)C)O)C=O 62a_100000692301_100010762608 [0,1,0,0,0,1|1,1,0]=4 1022 B18R1.290035 COc1cc(c(cc1SCC(=O)N(C)C)O)C=O 62a_100010762608_100000692301 [0,1,0,0,0,1|1,1,0]=4 1023 B18R1.291591 COc1c(ccc(c1F)C=O)CCC(=O)N(C)C 271570a_200010232142_200010981996 [0,1,0,0,0,1|2,0,0]=4 1024 B18R1.291591 COc1c(ccc(c1F)C=O)SCC(=O)C(C)C 62a_100000753385_200010981996 [0,1,0,0,0,1|0,1,0]=3 1025 B18R1.291591 COc1c(ccc(c1F)C=O)SCC(=O)C(C)C 62a_200010981996_100000753385 [0,1,0,0,0,1|0,1,0]=3 1026 B18R1.291591 COc1c(ccc(c1F)C=O)SCC(=O)N(C)C 62a_100000692301_200010981996 [0,1,0,0,0,1|1,1,0]=4 1027 B18R1.291591 COc1c(ccc(c1F)C=O)SCC(=O)N(C)C 62a_200010981996_100000692301 [0,1,0,0,0,1|1,1,0]=4 1028 B18R1.5448 C/C=C(\C)/C(=O)Nc1ccc(cc1OC)C(=O)N 11a_100011850419_100020587367 [0,2,0,0,0,0|1,0,1]=4 1029 B18R1.5448 C/C=C(\C)/C(=O)Nc1ccc(cc1OC)C(=O)N 1626a_100011850419_100020587367 [0,2,0,0,0,0|1,0,1]=4 1030 B18R1.5448 C/C=C(\C)/C(=O)Nc1ccc(cc1OC)C(=O)N 22a_100011850419_100020587367 [0,2,0,0,0,0|1,0,1]=4 1031 B18R1.5448 C=CC(C)C(=O)Nc1ccc(cc1OC)C(=O)N 11a_100011850419_100011216780 [0,2,0,0,0,0|1,0,1]=4 1032 B18R1.5448 C=CC(C)C(=O)Nc1ccc(cc1OC)C(=O)N 1626a_100011850419_100011216780 [0,2,0,0,0,0|1,0,1]=4 1033 B18R1.5448 C=CC(C)C(=O)Nc1ccc(cc1OC)C(=O)N 22a_100011850419_100011216780 [0,2,0,0,0,0|1,0,1]=4 1034 B18R1.5448 C=CC(C)C(=O)Nc1ccc(cc1OC)C(=O)N 527a_100011850419_100011216780 [0,2,0,0,0,0|1,0,1]=4 1035 B18R1.5448 CCC(C)C(=O)Cc1ccc(cc1OC)[N+](=O)[O-] 1458a_100011192722_100010150584 [0,2,0,0,0,0|2,0,0]=4 1036 B18R1.5448 CCC(C)C(=O)Nc1ccc(cc1OC)C(=O)N 11a_100011850419_100011192722 [0,2,0,0,0,0|1,0,0]=3 1037 B18R1.5448 CCC(C)C(=O)Nc1ccc(cc1OC)C(=O)N 1626a_100011850419_100011192722 [0,2,0,0,0,0|1,0,0]=3 1038 B18R1.5448 CCC(C)C(=O)Nc1ccc(cc1OC)C(=O)N 22a_100011850419_100011192722 [0,2,0,0,0,0|1,0,0]=3 1039 B18R1.5448 CCC(C)C(=O)Nc1ccc(cc1OC)C(=O)N 527a_100011850419_100011192722 [0,2,0,0,0,0|1,0,0]=3 1040 B18R1.5448 CCC(C)C(=O)Nc1ccc(cc1OC)[N+](=O)[O-] 11a_100000211086_100011192722 [0,2,0,0,0,0|2,0,0]=4 1041 B18R1.5448 CCC(C)C(=O)Nc1ccc(cc1OC)[N+](=O)[O-] 1626a_100000211086_100011192722 [0,2,0,0,0,0|2,0,0]=4 1042 B18R1.5448 CCC(O)C(=O)Nc1ccc(cc1OC)C(=O)N 22a_100011850419_100011196387 [0,2,0,0,0,0|2,0,0]=4 1043 B18R1.5448 CCN(C)C(=O)Nc1ccc(cc1OC)C(=O)N 2430a_100011850419_100000225621 [0,2,0,0,0,0|2,0,0]=4 1044 B18R1.5448 CNC(C)C(=O)Nc1ccc(cc1OC)[N+](=O)[O-] 2230a_106832991635_100000261241 [0,2,0,0,0,0|2,0,0]=4 1045 B18R1.5448 CNC(C)C(=O)Nc1ccc(cc1OC)[N+](=O)[O-] 7a_106832991635_100000261241 [0,2,0,0,0,0|2,0,0]=4 1046 B18R1.5448 COc1cc(ccc1CC(=O)C(C)OC)[N+](=O)[O-] 1458a_100000743197_100010150584 [0,2,0,0,0,0|2,0,0]=4 1047 B18R1.5448 COc1cc(ccc1CC(=O)C(C)SC)[N+](=O)[O-] 1458a_100000149566_100010150584 [0,2,0,0,0,0|2,0,0]=4 1048 B18R1.5448 COc1cc(ccc1NC(=O)C(C)C#N)C(=O)N 11a_100011850419_100000753662 [0,2,0,0,0,0|1,0,1]=4 1049 B18R1.5448 COc1cc(ccc1NC(=O)C(C)C#N)C(=O)N 1626a_100011850419_100000753662 [0,2,0,0,0,0|1,0,1]=4 1050 B18R1.5448 COc1cc(ccc1NC(=O)C(C)C#N)C(=O)N 22a_100011850419_100000753662 [0,2,0,0,0,0|1,0,1]=4 1051 B18R1.5448 COc1cc(ccc1NC(=O)C(C)C#N)C(=O)N 527a_100011850419_100000753662 [0,2,0,0,0,0|1,0,1]=4 1052 B18R1.5448 COc1cc(ccc1NC(=O)C(C)OC)C(=O)N 11a_100011850419_100000743197 [0,2,0,0,0,0|1,0,0]=3 1053 B18R1.5448 COc1cc(ccc1NC(=O)C(C)OC)C(=O)N 1626a_100011850419_100000743197 [0,2,0,0,0,0|1,0,0]=3 1054 B18R1.5448 COc1cc(ccc1NC(=O)C(C)OC)C(=O)N 22a_100011850419_100000743197 [0,2,0,0,0,0|1,0,0]=3 1055 B18R1.5448 COc1cc(ccc1NC(=O)C(C)OC)C(=O)N 527a_100011850419_100000743197 [0,2,0,0,0,0|1,0,0]=3 1056 B18R1.5448 COc1cc(ccc1NC(=O)C(C)OC)[N+](=O)[O-] 11a_100000211086_100000743197 [0,2,0,0,0,0|2,0,0]=4 1057 B18R1.5448 COc1cc(ccc1NC(=O)C(C)OC)[N+](=O)[O-] 1626a_100000211086_100000743197 [0,2,0,0,0,0|2,0,0]=4 1058 B18R1.5448 COc1cc(ccc1NC(=O)C(C)SC)C(=O)N 11a_100011850419_100000149566 [0,2,0,0,0,0|1,0,0]=3 1059 B18R1.5448 COc1cc(ccc1NC(=O)C(C)SC)C(=O)N 1626a_100011850419_100000149566 [0,2,0,0,0,0|1,0,0]=3 1060 B18R1.5448 COc1cc(ccc1NC(=O)C(C)SC)C(=O)N 22a_100011850419_100000149566 [0,2,0,0,0,0|1,0,0]=3 1061 B18R1.5448 COc1cc(ccc1NC(=O)C(C)SC)C(=O)N 527a_100011850419_100000149566 [0,2,0,0,0,0|1,0,0]=3 1062 B18R1.5448 COc1cc(ccc1NC(=O)C(C)SC)[N+](=O)[O-] 11a_100000211086_100000149566 [0,2,0,0,0,0|2,0,0]=4 1063 B18R1.5448 COc1cc(ccc1NC(=O)C(C)SC)[N+](=O)[O-] 1626a_100000211086_100000149566 [0,2,0,0,0,0|2,0,0]=4 1064 B18R1.5448 COc1cc(ccc1NC(=O)C(O)CO)C(=O)N 22a_100011850419_100011215603 [0,2,0,0,0,0|2,0,0]=4 1065 B18R1.5509 CNC(=O)c1ccc(c(c1)OC)NC(=O)C(C)C 11a_100011850465_100000210198 [0,2,0,0,0,0|1,0,0]=3 1066 B18R1.5509 CNC(=O)c1ccc(c(c1)OC)NC(=O)C(C)C 1626a_100011850465_100000210198 [0,2,0,0,0,0|1,0,0]=3 1067 B18R1.5509 CNC(=O)c1ccc(c(c1)OC)NC(=O)C(C)C 22a_100011850465_100000210198 [0,2,0,0,0,0|1,0,0]=3 1068 B18R1.5509 CNC(=O)c1ccc(c(c1)OC)NC(=O)C(C)C 527a_100011850465_100000210198 [0,2,0,0,0,0|1,0,0]=3 1069 B18R1.5509 CNC(=O)c1ccc(c(c1)OC)NC(=O)C(C)F 11a_100011850465_100000062450 [0,2,0,0,0,0|2,0,0]=4 1070 B18R1.5509 CNC(=O)c1ccc(c(c1)OC)NC(=O)C(C)F 1626a_100011850465_100000062450 [0,2,0,0,0,0|2,0,0]=4 1071 B18R1.5509 CNC(=O)c1ccc(c(c1)OC)NC(=O)C(C)F 22a_100011850465_100000062450 [0,2,0,0,0,0|2,0,0]=4 1072 B18R1.5509 CNC(=O)c1ccc(c(c1)OC)NC(=O)C(C)F 527a_100011850465_100000062450 [0,2,0,0,0,0|2,0,0]=4 1073 B18R1.5509 CNC(=O)c1ccc(c(c1)OC)NC(=O)N(C)C 2430a_100011850465_100102631434 [0,2,0,0,0,0|2,0,0]=4 1074 B18R1.5509 CNC(=O)c1ccc(c(c1)OC)NC(=O)[C@@H](C)O 22a_100011850465_100000717761 [0,2,0,0,0,0|2,0,0]=4 1075 B18R1.5509 CNC(=O)c1ccc(c(c1)OC)NC(=O)[C@H](C)O 1626a_100011850465_217856618621 [0,2,0,0,0,0|2,0,0]=4 1076 B18R1.5509 CNC(=O)c1ccc(c(c1)OC)NC(=O)[C@H](C)O 22a_100011850465_217856618621 [0,2,0,0,0,0|2,0,0]=4 1077 B18R1.5509 COC(=O)c1ccc(c(c1)OC)CC(=O)C(C)C 1458a_100000210198_100000765176 [0,2,0,0,0,0|1,0,0]=3 1078 B18R1.5509 COC(=O)c1ccc(c(c1)OC)CC(=O)C(C)F 1458a_100000062450_100000765176 [0,2,0,0,0,0|2,0,0]=4 1079 B18R1.5509 COC(=O)c1ccc(c(c1)OC)CC(=O)[C@@H](C)O 1458a_100000717761_100000765176 [0,2,0,0,0,0|2,0,0]=4 1080 B18R1.5509 COC(=O)c1ccc(c(c1)OC)CC(=O)[C@H](C)O 1458a_217856618621_100000765176 [0,2,0,0,0,0|2,0,0]=4 1081 B18R1.5509 COC(=O)c1ccc(c(c1)OC)NC(=O)C(C)C 188690a_100000695017_100000210198 [0,2,0,0,0,0|1,0,0]=3 1082 B18R1.5509 COC(=O)c1ccc(c(c1)OC)NC(=O)C(C)F 188690a_100000695017_100000062450 [0,2,0,0,0,0|2,0,0]=4 1083 B18R1.5509 COC(=O)c1ccc(c(c1)OC)NC(=O)[C@@H](C)O 188690a_100000695017_100000717761 [0,2,0,0,0,0|2,0,0]=4 1084 B18R1.5509 COC(=O)c1ccc(c(c1)OC)NC(=O)[C@H](C)O 188690a_100000695017_217856618621 [0,2,0,0,0,0|2,0,0]=4 1085 B18R1.5510 COc1cc(ccc1NC(=O)C(C)C)S(=O)(=O)C 11a_100011900471_100000210198 [0,2,0,0,0,0|2,0,0]=4 1086 B18R1.5510 COc1cc(ccc1NC(=O)C(C)C)S(=O)(=O)C 1626a_100011900471_100000210198 [0,2,0,0,0,0|2,0,0]=4 1087 B18R1.5580 COc1cc(ccc1NS(=O)(=O)C(C)C)C(=O)N 20a_100011850419_100000742656 [0,2,0,0,0,0|2,0,0]=4 1088 B18R1.5580 COc1cc(ccc1NS(=O)(=O)C(C)C)C(=O)N 232682a_100011850419_100000742656 [0,2,0,0,0,0|2,0,0]=4 1089 B18R1.17996 COc1cc(cc(c1NC(=O)C(C)C)C)[N+](=O)[O-] 11a_100011086007_100000210198 [0,2,0,0,0,0|2,0,0]=4 1090 B18R1.39989 COc1cc(c(cc1NC(=O)C(C)C)C)[N+](=O)[O-] 11a_100000073770_100000210198 [0,2,0,0,0,0|2,0,0]=4 1091 B18R1.39989 COc1cc(c(cc1NC(=O)C(C)C)F)[N+](=O)[O-] 11a_200010782234_100000210198 [0,2,0,0,0,0|2,0,0]=4 1092 B18R1.39989 COc1cc(c(cc1NC(=O)C(C)C)F)[N+](=O)[O-] 1626a_200010782234_100000210198 [0,2,0,0,0,0|2,0,0]=4 1093 B18R1.62765 COc1cc(ccc1CC(=O)C(C)(C)C)[N+](=O)[O-] 1458a_106744555173_100010150584 [0,2,0,0,0,0|2,0,0]=4 1094 B18R1.62765 COc1cc(ccc1CC(=O)C(C)(C)F)[N+](=O)[O-] 1458a_100000765255_100010150584 [0,2,0,0,0,0|2,0,0]=4 1095 B18R1.62765 COc1cc(ccc1CC(=O)C(C)(C)O)[N+](=O)[O-] 1458a_100000242741_100010150584 [0,2,0,0,0,0|2,0,0]=4 1096 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(C)C)C(=O)N 11a_100011850419_106744555173 [0,2,0,0,0,0|1,0,0]=3 1097 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(C)C)C(=O)N 1626a_100011850419_106744555173 [0,2,0,0,0,0|1,0,0]=3 1098 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(C)C)C(=O)N 22a_100011850419_106744555173 [0,2,0,0,0,0|1,0,0]=3 1099 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(C)C)C(=O)N 527a_100011850419_106744555173 [0,2,0,0,0,0|1,0,0]=3 1100 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(C)C)[N+](=O)[O-] 11a_100000211086_106744555173 [0,2,0,0,0,0|2,0,0]=4 1101 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(C)C)[N+](=O)[O-] 1626a_100000211086_106744555173 [0,2,0,0,0,0|2,0,0]=4 1102 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(C)F)C(=O)N 11a_100011850419_100000765255 [0,2,0,0,0,0|1,0,0]=3 1103 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(C)F)C(=O)N 1626a_100011850419_100000765255 [0,2,0,0,0,0|1,0,0]=3 1104 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(C)F)C(=O)N 22a_100011850419_100000765255 [0,2,0,0,0,0|1,0,0]=3 1105 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(C)F)C(=O)N 527a_100011850419_100000765255 [0,2,0,0,0,0|1,0,0]=3 1106 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(C)F)[N+](=O)[O-] 11a_100000211086_100000765255 [0,2,0,0,0,0|2,0,0]=4 1107 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(C)F)[N+](=O)[O-] 1626a_100000211086_100000765255 [0,2,0,0,0,0|2,0,0]=4 1108 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(C)O)C(=O)N 22a_100011850419_100000242741 [0,2,0,0,0,0|1,0,0]=3 1109 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(F)F)C(=O)N 11a_100011850419_100000042251 [0,2,0,0,0,0|2,0,0]=4 1110 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(F)F)C(=O)N 1626a_100011850419_100000042251 [0,2,0,0,0,0|2,0,0]=4 1111 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(F)F)C(=O)N 22a_100011850419_100000042251 [0,2,0,0,0,0|2,0,0]=4 1112 B18R1.62765 COc1cc(ccc1NC(=O)C(C)(F)F)C(=O)N 527a_100011850419_100000042251 [0,2,0,0,0,0|2,0,0]=4 1113 B18R1.76214 C=Cc1ccc(c(c1)OC)OC(C(=O)N)C(C)C 34a_100011217988_100000230017 [0,2,0,0,0,0|1,0,1]=4 1114 B18R1.76214 COc1cc(ccc1SC(C(=O)N)C(C)C)C=O 62a_100000230017_100010244714 [0,2,0,0,0,0|0,1,1]=4 1115 B18R1.76214 COc1cc(ccc1SC(C(=O)N)C(C)C)C=O 62a_100010244714_100000230017 [0,2,0,0,0,0|0,1,1]=4 1116 B18R1.23784 CCOc1cc(ccc1OC(=O)C(C)C)CNC 270004a_106832991635_100020646327 [0,2,0,0,0,0|1,0,1]=4 1117 B18R1.5512 COc1cc(ccc1OC(=O)C(C)C)CN(C)C 270004a_100102631434_100000014710 [0,2,0,0,0,0|1,0,1]=4 1118 B18R1.36415 CCNCc1ccc(c(c1)OC)OC(=O)C(C)C 207a_100015525214_100000014710 [0,2,0,0,0,0|1,0,1]=4 1119 B18R1.36415 CCNCc1ccc(c(c1)OC)OC(=O)C(C)C 270004a_100015525214_100000014710 [0,2,0,0,0,0|1,0,1]=4 1120 B16R2.204853 C=Cc1ccc(c(c1)OC)OCC2CC2 34a_100011217988_100000742324 [1,0,0,1,0,0|1,0,1]=4 1121 B16R2.204853 COc1cc(ccc1C#CC2CC2)C=O 271570a_200009880635_100010244714 [1,0,0,1,0,0|1,0,1]=4 1122 B16R2.204853 COc1cc(ccc1C=CC2CC2)C=O 271570a_100102526188_100010244714 [1,0,0,1,0,0|1,0,0]=3 1123 B16R2.204853 COc1cc(ccc1SCC2CC2)C=O 62a_100000756562_100010244714 [1,0,0,1,0,0|0,1,1]=4 1124 B16R2.204853 COc1cc(ccc1SCC2CC2)C=O 62a_100010244714_100000742324 [1,0,0,1,0,0|0,1,1]=4 1125 B16R2.54919 COc1cc(ccc1CC(=O)C2CC2)Br 1458a_100000210395_100012359436 [1,0,0,1,0,0|2,0,0]=4 1126 B16R2.54919 COc1cc(ccc1CC(=O)C2CC2)F 1458a_100000210395_200010171551 [1,0,0,1,0,0|2,0,0]=4 1127 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)Br 11a_100011279103_100000210395 [1,0,0,1,0,0|2,0,0]=4 1128 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)Br 1626a_100011279103_100000210395 [1,0,0,1,0,0|2,0,0]=4 1129 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)Br 22a_100011279103_100000210395 [1,0,0,1,0,0|2,0,0]=4 1130 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)C 11a_100000746441_100000210395 [1,0,0,1,0,0|1,0,1]=4 1131 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)C 1626a_100000746441_100000210395 [1,0,0,1,0,0|1,0,1]=4 1132 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)C 22a_100000746441_100000210395 [1,0,0,1,0,0|1,0,1]=4 1133 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)C 527a_100000746441_100000210395 [1,0,0,1,0,0|1,0,1]=4 1134 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)Cl 11a_100000707585_100000210395 [1,0,0,1,0,0|2,0,0]=4 1135 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)Cl 1626a_100000707585_100000210395 [1,0,0,1,0,0|2,0,0]=4 1136 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)Cl 22a_100000707585_100000210395 [1,0,0,1,0,0|2,0,0]=4 1137 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)F 11a_100000737216_100000210395 [1,0,0,1,0,0|2,0,0]=4 1138 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)F 1626a_100000737216_100000210395 [1,0,0,1,0,0|2,0,0]=4 1139 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)F 22a_100000737216_100000210395 [1,0,0,1,0,0|2,0,0]=4 1140 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)F 527a_100000737216_100000210395 [1,0,0,1,0,0|2,0,0]=4 1141 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)I 11a_100015196925_100000210395 [1,0,0,1,0,0|2,0,0]=4 1142 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)I 1626a_100015196925_100000210395 [1,0,0,1,0,0|2,0,0]=4 1143 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)I 22a_100015196925_100000210395 [1,0,0,1,0,0|2,0,0]=4 1144 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)O 22a_100015326901_100000210395 [1,0,0,1,0,0|1,0,1]=4 1145 B16R2.54919 COc1cc(ccc1NC(=O)C2CC2)O 527a_100015326901_100000210395 [1,0,0,1,0,0|1,0,1]=4 1146 B16R2.8380 C=C(c1ccc(cc1OC)C=O)C2CC2 271570a_100010895485_100010244714 [0,0,0,1,1,0|1,0,0]=3 1147 B18R2.868369 C=Cc1ccc(c(c1)OC)OCC(=O)C2CC2 34a_100011217988_100000746382 [0,0,0,1,0,1|1,0,0]=3 1148 B18R2.868369 CCc1ccc(c(c1)OC)OCC(=O)C2CC2 34a_100000186467_100000746382 [0,0,0,1,0,1|1,0,1]=4 1149 B18R2.868369 CCc1ccc(c(c1)OC)OCC(=O)C2CC2 7a_100000186467_100000746382 [0,0,0,1,0,1|1,0,1]=4 1150 B18R2.868369 COc1cc(ccc1OCC(=O)C2CC2)C#N 34a_100000184589_100000746382 [0,0,0,1,0,1|1,0,1]=4 1151 B18R2.868369 COc1cc(ccc1OCC(=O)C2CC2)C#N 7a_100000184589_100000746382 [0,0,0,1,0,1|1,0,1]=4 1152 B18R2.868369 COc1cc(ccc1OCC(=O)C2CC2)CN 34a_100000185554_100000746382 [0,0,0,1,0,1|1,0,1]=4 1153 B18R2.868369 COc1cc(ccc1SCC(=O)C2CC2)C=O 62a_100000746382_100010244714 [0,0,0,1,0,1|0,1,0]=3 1154 B18R2.868369 COc1cc(ccc1SCC(=O)C2CC2)C=O 62a_100010244714_100000746382 [0,0,0,1,0,1|0,1,0]=3 1155 B18R2.868369 COc1ccc(c(c1)OC)OCC(=O)C2CC2 34a_100009840267_100000746382 [0,0,0,1,0,1|2,0,0]=4 1156 B18R2.162181 COc1cc(ccc1CC(=O)C2CC2)[N+](=O)[O-] 1458a_100000210395_100010150584 [0,1,0,1,0,0|2,0,0]=4 1157 B18R2.162181 COc1cc(ccc1NC(=O)C2CC2)C(=O)N 11a_100011850419_100000210395 [0,1,0,1,0,0|1,0,0]=3 1158 B18R2.162181 COc1cc(ccc1NC(=O)C2CC2)C(=O)N 1626a_100011850419_100000210395 [0,1,0,1,0,0|1,0,0]=3 1159 B18R2.162181 COc1cc(ccc1NC(=O)C2CC2)C(=O)N 22a_100011850419_100000210395 [0,1,0,1,0,0|1,0,0]=3 1160 B18R2.162181 COc1cc(ccc1NC(=O)C2CC2)C(=O)N 527a_100011850419_100000210395 [0,1,0,1,0,0|1,0,0]=3 1161 B18R2.162181 COc1cc(ccc1NC(=O)C2CC2)[N+](=O)[O-] 11a_100000211086_100000210395 [0,1,0,1,0,0|2,0,0]=4 1162 B18R2.162181 COc1cc(ccc1NC(=O)C2CC2)[N+](=O)[O-] 1626a_100000211086_100000210395 [0,1,0,1,0,0|2,0,0]=4 1163 B18R2.162181 COc1cc(ccc1NC(=O)C2CO2)C(=O)N 11a_100011850419_100000701028 [0,1,0,1,0,0|2,0,0]=4 1164 B18R2.162181 COc1cc(ccc1NC(=O)C2CO2)C(=O)N 1626a_100011850419_100000701028 [0,1,0,1,0,0|2,0,0]=4 1165 B18R2.162181 COc1cc(ccc1NC(=O)C2CO2)C(=O)N 22a_100011850419_100000701028 [0,1,0,1,0,0|2,0,0]=4 1166 B18R2.162181 COc1cc(ccc1NC(=O)C2CO2)C(=O)N 527a_100011850419_100000701028 [0,1,0,1,0,0|2,0,0]=4 1167 B18R2.76795 CNCc1ccc(c(c1)OC)OC(=O)C2CC2 207a_100102657272_100000009748 [0,1,0,1,0,0|1,0,1]=4 1168 B18R2.76795 CNCc1ccc(c(c1)OC)OC(=O)C2CC2 270004a_106832991635_100000009748 [0,1,0,1,0,0|1,0,1]=4 1169 B14R1.102 CC(=C(C)c1ccc(cc1C)C=O)C 271570a_200000049429_100000765772 [1,0,0,0,1,0|1,0,1]=4 1170 B14R1.102 CC(=C(C)c1ccc(cc1O)C=O)C 271570a_200000049429_100000041418 [1,0,0,0,1,0|1,0,1]=4 1171 B14R1.102 COc1ccc(c(c1)C)C(=O)C(C)C 1458a_100000763155_100000210206 [1,0,0,0,1,0|2,0,0]=4 1172 B14R1.102 COc1ccc(c(c1)O)C(=O)C(C)C 1458a_100000212123_100000210206 [1,0,0,0,1,0|2,0,0]=4 1173 B14R1.102 CSc1ccc(c(c1)C)C(=O)C(C)C 1458a_100012278374_100000210206 [1,0,0,0,1,0|2,0,0]=4 1174 B14R1.102 Cc1cc(ccc1C(=O)C(C)C)C#N 1458a_100000691869_100000210206 [1,0,0,0,1,0|1,0,1]=4 1175 B14R1.2334 C=Cc1ccc(c(c1)OC)C(=O)OC 271570a_100011290941_100000708095 [1,0,0,0,1,0|2,0,0]=4 1176 B14R1.2334 CCC(=O)c1ccc(cc1OC)C#N 1458a_100012002740_100000210202 [1,0,0,0,1,0|1,0,1]=4 1177 B14R1.2334 CCC(=O)c1ccc(cc1OC)OC 1458a_100000210807_100000210202 [1,0,0,0,1,0|2,0,0]=4 1178 B14R1.2334 CCC(=O)c1ccc(cc1OC)OC 7a_200000067515_200000210301 [1,0,0,0,1,0|2,0,0]=4 1179 B14R1.2334 CCC(=O)c1ccc(cc1OC)SC 1458a_100000211074_100000210202 [1,0,0,0,1,0|2,0,0]=4 1180 B14R1.2334 CCC(=O)c1ccc(cc1O[13CH3])OC 7a_200000067515_200025704644 [1,0,0,0,1,0|2,0,0]=4 1181 B14R1.2334 COC(=O)c1ccc(cc1SC)C=O 62a_100010630601_200000210301 [1,0,0,0,1,0|1,1,0]=4 1182 B14R1.2334 COC(=O)c1ccc(cc1SC)C=O 62a_200000210301_100010630601 [1,0,0,0,1,0|1,1,0]=4 1183 B14R1.2334 COC(=O)c1ccc(cc1S[13CH3])C=O 62a_100010630601_200025704644 [1,0,0,0,1,0|1,1,0]=4 1184 B14R1.2334 COC(=O)c1ccc(cc1S[13CH3])C=O 62a_200025704644_100010630601 [1,0,0,0,1,0|1,1,0]=4 1185 B14R1.1592 CCc1cc(ccc1C(=O)C(C)C)Br 1458a_200012349896_100000210206 [1,0,0,0,1,0|2,0,0]=4 1186 B14R1.1592 COc1cc(ccc1C(=O)C(C)C)Br 1458a_100000748230_100000210206 [1,0,0,0,1,0|1,0,0]=3 1187 B14R1.1592 COc1cc(ccc1C(=O)C(C)C)C 1458a_100000217210_100000210206 [1,0,0,0,1,0|0,0,1]=3 1188 B14R1.1592 COc1cc(ccc1C(=O)C(C)C)Cl 1458a_100000217211_100000210206 [1,0,0,0,1,0|1,0,0]=3 1189 B14R1.1592 COc1cc(ccc1C(=O)C(C)C)F 1458a_100000239970_100000210206 [1,0,0,0,1,0|1,0,0]=3 1190 B14R1.1592 COc1cc(ccc1C(=O)C(C)C)I 1458a_100012353712_100000210206 [1,0,0,0,1,0|1,0,0]=3 1191 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)Br 11a_100102631434_100000748230 [1,0,0,0,1,0|2,0,0]=4 1192 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)Br 1626a_100102631434_100000748230 [1,0,0,0,1,0|2,0,0]=4 1193 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)Br 240690a_100102631434_100000748230 [1,0,0,0,1,0|2,0,0]=4 1194 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)Br 527a_100102631434_100000748230 [1,0,0,0,1,0|2,0,0]=4 1195 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)C 11a_100102631434_100000217210 [1,0,0,0,1,0|1,0,1]=4 1196 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)C 1626a_100102631434_100000217210 [1,0,0,0,1,0|1,0,1]=4 1197 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)C 240690a_100102631434_100000217210 [1,0,0,0,1,0|1,0,1]=4 1198 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)C 527a_100102631434_100000217210 [1,0,0,0,1,0|1,0,1]=4 1199 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)Cl 11a_100102631434_100000217211 [1,0,0,0,1,0|2,0,0]=4 1200 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)Cl 1626a_100102631434_100000217211 [1,0,0,0,1,0|2,0,0]=4 1201 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)Cl 240690a_100102631434_100000217211 [1,0,0,0,1,0|2,0,0]=4 1202 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)Cl 527a_100102631434_100000217211 [1,0,0,0,1,0|2,0,0]=4 1203 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)F 11a_100102631434_100000239970 [1,0,0,0,1,0|2,0,0]=4 1204 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)F 1626a_100102631434_100000239970 [1,0,0,0,1,0|2,0,0]=4 1205 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)F 240690a_100102631434_100000239970 [1,0,0,0,1,0|2,0,0]=4 1206 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)F 527a_100102631434_100000239970 [1,0,0,0,1,0|2,0,0]=4 1207 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)I 11a_100102631434_100012353712 [1,0,0,0,1,0|2,0,0]=4 1208 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)I 1626a_100102631434_100012353712 [1,0,0,0,1,0|2,0,0]=4 1209 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)I 240690a_100102631434_100012353712 [1,0,0,0,1,0|2,0,0]=4 1210 B14R1.1592 COc1cc(ccc1C(=O)N(C)C)I 527a_100102631434_100012353712 [1,0,0,0,1,0|2,0,0]=4 1211 B16R1.5639 CC(C)C(=O)CSc1ccc(cc1F)C=O 62a_100000686674_100000753385 [1,0,0,0,0,1|1,1,0]=4 1212 B16R1.5639 CC(C)C(=O)CSc1ccc(cc1F)C=O 62a_100000753385_100000686674 [1,0,0,0,0,1|1,1,0]=4 1213 B16R1.5639 CC(C)C(=O)CSc1ccc(cc1O)C=O 62a_100000041418_100000753385 [1,0,0,0,0,1|0,1,0]=3 1214 B16R1.5639 CC(C)C(=O)CSc1ccc(cc1O)C=O 62a_100000753385_100000041418 [1,0,0,0,0,1|0,1,0]=3 1215 B16R1.5639 CN(C)C(=O)CCc1ccc(cc1O)C=O 271570a_200010232142_100000041418 [1,0,0,0,0,1|2,0,0]=4 1216 B16R1.5639 CN(C)C(=O)CSc1ccc(cc1O)C=O 62a_100000041418_100000692301 [1,0,0,0,0,1|1,1,0]=4 1217 B16R1.5639 CN(C)C(=O)CSc1ccc(cc1O)C=O 62a_100000692301_100000041418 [1,0,0,0,0,1|1,1,0]=4 1218 B16R1.5639 COc1ccc(c(c1)C)OCC(=O)C(C)C 34a_100012002223_100000753385 [1,0,0,0,0,1|2,0,0]=4 1219 B16R1.5639 COc1ccc(c(c1)C)OCC(=O)C(C)C 7a_100012002223_100000753385 [1,0,0,0,0,1|2,0,0]=4 1220 B16R1.5639 Cc1cc(ccc1CCC(=O)N(C)C)C=O 271570a_200010232142_100000765772 [1,0,0,0,0,1|2,0,0]=4 1221 B16R1.5639 Cc1cc(ccc1OCC(=O)C(C)C)C#N 34a_100000749339_100000753385 [1,0,0,0,0,1|1,0,1]=4 1222 B16R1.5639 Cc1cc(ccc1OCC(=O)C(C)C)C#N 7a_100000749339_100000753385 [1,0,0,0,0,1|1,0,1]=4 1223 B16R1.5639 Cc1cc(ccc1OCC(=O)C(C)C)CO 34a_100000075815_100000753385 [1,0,0,0,0,1|0,0,2]=4 1224 B16R1.5639 Cc1cc(ccc1OCC(=O)C(C)C)CO 7a_100000075815_100000753385 [1,0,0,0,0,1|0,0,2]=4 1225 B16R1.5639 Cc1cc(ccc1SCC(=O)C(C)C)C=O 62a_100000753385_100000765772 [1,0,0,0,0,1|0,1,0]=3 1226 B16R1.5639 Cc1cc(ccc1SCC(=O)C(C)C)C=O 62a_100000765772_100000753385 [1,0,0,0,0,1|0,1,0]=3 1227 B16R1.5639 Cc1cc(ccc1SCC(=O)N(C)C)C=O 62a_100000692301_100000765772 [1,0,0,0,0,1|1,1,0]=4 1228 B16R1.5639 Cc1cc(ccc1SCC(=O)N(C)C)C=O 62a_100000765772_100000692301 [1,0,0,0,0,1|1,1,0]=4 1229 B16R1.5639 Cc1cc(cnc1SCC(=O)C(C)C)C=O 62a_100000070293_100000753385 [1,0,0,0,0,1|1,1,0]=4 1230 B16R1.5639 Cc1cc(cnc1SCC(=O)C(C)C)C=O 62a_100000753385_100000070293 [1,0,0,0,0,1|1,1,0]=4 1231 B16R1.5639 Cc1cc(ncc1SCC(=O)C(C)C)C=O 62a_100000753385_100009814806 [1,0,0,0,0,1|1,1,0]=4 1232 B16R1.5639 Cc1cc(ncc1SCC(=O)C(C)C)C=O 62a_100009814806_100000753385 [1,0,0,0,0,1|1,1,0]=4 1233 B16R1.5639 Cc1nc(ccc1SCC(=O)C(C)C)C=O 62a_100000753385_100010238520 [1,0,0,0,0,1|1,1,0]=4 1234 B16R1.5639 Cc1nc(ccc1SCC(=O)C(C)C)C=O 62a_100010238520_100000753385 [1,0,0,0,0,1|1,1,0]=4 1235 B16R1.1772 C=Cc1ccc(c(c1)OC)OCC=C(C)C 34a_100011217988_100000761012 [1,0,0,0,0,1|1,0,1]=4 1236 B16R1.1772 C=Cc1ccc(c(c1)OC)OCCC(C)C 34a_100011217988_100000210312 [1,0,0,0,0,1|1,0,1]=4 1237 B16R1.1772 C=Cc1ccc(c(c1)OC)OCOC(C)C 34a_100011217988_100000709892 [1,0,0,0,0,1|1,0,1]=4 1238 B16R1.1772 COc1cc(ccc1C=CCC(C)C)C=O 271570a_100016259101_100010244714 [1,0,0,0,0,1|1,0,0]=3 1239 B16R1.1772 COc1cc(ccc1OCCN(C)C)C=O 2230a_100102631434_200009815835 [1,0,0,0,0,1|1,0,1]=4 1240 B16R1.1772 COc1cc(ccc1OCCN(C)C)C=O 269982a_100102631434_200009815835 [1,0,0,0,0,1|1,0,1]=4 1241 B16R1.1772 COc1cc(ccc1SCC=C(C)C)C=O 62a_100000761012_100010244714 [1,0,0,0,0,1|0,1,1]=4 1242 B16R1.1772 COc1cc(ccc1SCC=C(C)C)C=O 62a_100010244714_100000761012 [1,0,0,0,0,1|0,1,1]=4 1243 B16R1.1772 COc1cc(ccc1SCCC(C)C)C=O 62a_100000210312_100010244714 [1,0,0,0,0,1|0,1,1]=4 1244 B16R1.1772 COc1cc(ccc1SCCC(C)C)C=O 62a_100010244714_100000210312 [1,0,0,0,0,1|0,1,1]=4 1245 B16R1.1772 COc1cc(ccc1SCOC(C)C)C=O 62a_100000709892_100010244714 [1,0,0,0,0,1|0,1,1]=4 1246 B16R1.1772 COc1cc(ccc1SCOC(C)C)C=O 62a_100010244714_100000709892 [1,0,0,0,0,1|0,1,1]=4 1247 B16R1.4713 COc1cc(ccc1CC(=O)CC(C)C)Br 1458a_100000210554_100012359436 [1,0,0,0,0,1|2,0,0]=4 1248 B16R1.4713 COc1cc(ccc1CC(=O)CC(C)C)Br 1458a_100010245118_100000210624 [1,0,0,0,0,1|2,0,0]=4 1249 B16R1.4713 COc1cc(ccc1CC(=O)CC(C)C)Cl 1458a_100010217541_100000210624 [1,0,0,0,0,1|2,0,0]=4 1250 B16R1.4713 COc1cc(ccc1CC(=O)CC(C)C)F 1458a_100000062011_100000210624 [1,0,0,0,0,1|2,0,0]=4 1251 B16R1.4713 COc1cc(ccc1CC(=O)CC(C)C)F 1458a_100000210554_200010171551 [1,0,0,0,0,1|2,0,0]=4 1252 B16R1.4713 COc1cc(ccc1CC(=O)NC(C)C)Br 11a_100138425928_100010245118 [1,0,0,0,0,1|2,0,0]=4 1253 B16R1.4713 COc1cc(ccc1CC(=O)NC(C)C)Br 1626a_100138425928_100010245118 [1,0,0,0,0,1|2,0,0]=4 1254 B16R1.4713 COc1cc(ccc1CC(=O)NC(C)C)Br 240690a_100138425928_100010245118 [1,0,0,0,0,1|2,0,0]=4 1255 B16R1.4713 COc1cc(ccc1CC(=O)NC(C)C)Br 527a_100138425928_100010245118 [1,0,0,0,0,1|2,0,0]=4 1256 B16R1.4713 COc1cc(ccc1CC(=O)NC(C)C)Cl 11a_100138425928_100010217541 [1,0,0,0,0,1|2,0,0]=4 1257 B16R1.4713 COc1cc(ccc1CC(=O)NC(C)C)Cl 1626a_100138425928_100010217541 [1,0,0,0,0,1|2,0,0]=4 1258 B16R1.4713 COc1cc(ccc1CC(=O)NC(C)C)Cl 240690a_100138425928_100010217541 [1,0,0,0,0,1|2,0,0]=4 1259 B16R1.4713 COc1cc(ccc1CC(=O)NC(C)C)Cl 527a_100138425928_100010217541 [1,0,0,0,0,1|2,0,0]=4 1260 B16R1.4713 COc1cc(ccc1CC(=O)NC(C)C)F 11a_100138425928_100000062011 [1,0,0,0,0,1|2,0,0]=4 1261 B16R1.4713 COc1cc(ccc1CC(=O)NC(C)C)F 1626a_100138425928_100000062011 [1,0,0,0,0,1|2,0,0]=4 1262 B16R1.4713 COc1cc(ccc1CC(=O)NC(C)C)F 240690a_100138425928_100000062011 [1,0,0,0,0,1|2,0,0]=4 1263 B16R1.4713 COc1cc(ccc1CC(=O)NC(C)C)F 527a_100138425928_100000062011 [1,0,0,0,0,1|2,0,0]=4 1264 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)Br 11a_100011279103_100000210554 [1,0,0,0,0,1|2,0,0]=4 1265 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)Br 1626a_100011279103_100000210554 [1,0,0,0,0,1|2,0,0]=4 1266 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)Br 22a_100011279103_100000210554 [1,0,0,0,0,1|2,0,0]=4 1267 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)C 11a_100000746441_100000210554 [1,0,0,0,0,1|1,0,1]=4 1268 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)C 1626a_100000746441_100000210554 [1,0,0,0,0,1|1,0,1]=4 1269 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)C 22a_100000746441_100000210554 [1,0,0,0,0,1|1,0,1]=4 1270 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)C 527a_100000746441_100000210554 [1,0,0,0,0,1|1,0,1]=4 1271 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)Cl 11a_100000707585_100000210554 [1,0,0,0,0,1|2,0,0]=4 1272 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)Cl 1626a_100000707585_100000210554 [1,0,0,0,0,1|2,0,0]=4 1273 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)Cl 22a_100000707585_100000210554 [1,0,0,0,0,1|2,0,0]=4 1274 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)F 11a_100000737216_100000210554 [1,0,0,0,0,1|2,0,0]=4 1275 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)F 1626a_100000737216_100000210554 [1,0,0,0,0,1|2,0,0]=4 1276 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)F 22a_100000737216_100000210554 [1,0,0,0,0,1|2,0,0]=4 1277 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)F 527a_100000737216_100000210554 [1,0,0,0,0,1|2,0,0]=4 1278 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)I 11a_100015196925_100000210554 [1,0,0,0,0,1|2,0,0]=4 1279 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)I 1626a_100015196925_100000210554 [1,0,0,0,0,1|2,0,0]=4 1280 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)I 22a_100015196925_100000210554 [1,0,0,0,0,1|2,0,0]=4 1281 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)O 22a_100015326901_100000210554 [1,0,0,0,0,1|1,0,1]=4 1282 B16R1.4713 COc1cc(ccc1NC(=O)CC(C)C)O 527a_100015326901_100000210554 [1,0,0,0,0,1|1,0,1]=4 1283 B16R1.4713 COc1cc(ccc1NC(=O)NC(C)C)Br 2430a_100011279103_100138425928 [1,0,0,0,0,1|2,0,0]=4 1284 B16R1.4713 COc1cc(ccc1NC(=O)NC(C)C)C 2430a_100000746441_100138425928 [1,0,0,0,0,1|1,0,1]=4 1285 B16R1.4713 COc1cc(ccc1NC(=O)NC(C)C)Cl 2430a_100000707585_100138425928 [1,0,0,0,0,1|2,0,0]=4 1286 B16R1.4713 COc1cc(ccc1NC(=O)NC(C)C)F 2430a_100000737216_100138425928 [1,0,0,0,0,1|2,0,0]=4 1287 B16R1.4713 COc1cc(ccc1NC(=O)NC(C)C)I 2430a_100015196925_100138425928 [1,0,0,0,0,1|2,0,0]=4 1288 B16R1.4713 COc1cc(ccc1NC(=O)NC(C)C)I 512a_100015196925_100138425928 [1,0,0,0,0,1|2,0,0]=4 1289 B16R1.4713 COc1cc(ccc1NC(=O)NC(C)C)O 2430a_100015326901_100138425928 [1,0,0,0,0,1|1,0,1]=4 1290 B16R1.19299 CCc1cc(ccc1OCC(=O)C(C)C)Br 34a_100012338938_100000753385 [1,0,0,0,0,1|2,0,0]=4 1291 B16R1.19299 CCc1cc(ccc1OCC(=O)C(C)C)Br 7a_100012338938_100000753385 [1,0,0,0,0,1|2,0,0]=4 1292 B16R1.19299 CCc1cc(ccc1OCC(=O)C(C)C)C 34a_100009844793_100000753385 [1,0,0,0,0,1|1,0,1]=4 1293 B16R1.19299 CCc1cc(ccc1OCC(=O)C(C)C)C 7a_100009844793_100000753385 [1,0,0,0,0,1|1,0,1]=4 1294 B16R1.19299 CCc1cc(ccc1OCC(=O)C(C)C)F 34a_200000035566_100000753385 [1,0,0,0,0,1|2,0,0]=4 1295 B16R1.19299 CCc1cc(ccc1OCC(=O)C(C)C)F 7a_200000035566_100000753385 [1,0,0,0,0,1|2,0,0]=4 1296 B16R1.19299 COc1cc(ccc1CCC(=O)C(C)C)Br 1458a_100000699604_100000210206 [1,0,0,0,0,1|2,0,0]=4 1297 B16R1.19299 COc1cc(ccc1CNC(=O)C(C)C)F 11a_100000062129_100000210198 [1,0,0,0,0,1|2,0,0]=4 1298 B16R1.19299 COc1cc(ccc1CNC(=O)C(C)C)F 1626a_100000062129_100000210198 [1,0,0,0,0,1|2,0,0]=4 1299 B16R1.19299 COc1cc(ccc1CNC(=O)C(C)C)F 240690a_100000062129_100000210198 [1,0,0,0,0,1|2,0,0]=4 1300 B16R1.19299 COc1cc(ccc1CNC(=O)C(C)C)F 527a_100000062129_100000210198 [1,0,0,0,0,1|2,0,0]=4 1301 B16R1.19299 COc1cc(ccc1NCC(=O)C(C)C)Br 34a_100011279103_100000753385 [1,0,0,0,0,1|2,0,0]=4 1302 B16R1.19299 COc1cc(ccc1NCC(=O)C(C)C)C 2230a_100000746441_100000753385 [1,0,0,0,0,1|1,0,1]=4 1303 B16R1.19299 COc1cc(ccc1NCC(=O)C(C)C)C 34a_100000746441_100000753385 [1,0,0,0,0,1|1,0,1]=4 1304 B16R1.19299 COc1cc(ccc1NCC(=O)C(C)C)Cl 34a_100000707585_100000753385 [1,0,0,0,0,1|2,0,0]=4 1305 B16R1.19299 COc1cc(ccc1NCC(=O)C(C)C)F 34a_100000737216_100000753385 [1,0,0,0,0,1|2,0,0]=4 1306 B16R1.19299 COc1cc(ccc1NCC(=O)C(C)C)I 34a_100015196925_100000753385 [1,0,0,0,0,1|2,0,0]=4 1307 B16R1.19299 COc1cc(ccc1NCC(=O)C(C)C)O 34a_100015326901_100000753385 [1,0,0,0,0,1|1,0,1]=4 1308 B16R1.19299 COc1cc(ccc1NNC(=O)C(C)C)Cl 22a_100103168642_100000210198 [1,0,0,0,0,1|2,0,0]=4 1309 B16R1.19299 COc1cc(ccc1OCC(=O)C(C)C)Br 34a_100000694246_100000753385 [1,0,0,0,0,1|1,0,0]=3 1310 B16R1.19299 COc1cc(ccc1OCC(=O)C(C)C)Br 7a_100000694246_100000753385 [1,0,0,0,0,1|1,0,0]=3 1311 B16R1.19299 COc1cc(ccc1OCC(=O)C(C)C)C 1458a_100000183895_100000210206 [1,0,0,0,0,1|0,0,1]=3 1312 B16R1.19299 COc1cc(ccc1OCC(=O)C(C)C)C 34a_100000186466_100000753385 [1,0,0,0,0,1|0,0,1]=3 1313 B16R1.19299 COc1cc(ccc1OCC(=O)C(C)C)Cl 34a_100000033002_100000753385 [1,0,0,0,0,1|1,0,0]=3 1314 B16R1.19299 COc1cc(ccc1OCC(=O)C(C)C)F 34a_100000036057_100000753385 [1,0,0,0,0,1|1,0,0]=3 1315 B16R1.19299 COc1cc(ccc1OCC(=O)C(C)C)F 7a_100000036057_100000753385 [1,0,0,0,0,1|1,0,0]=3 1316 B16R1.19299 COc1cc(ccc1OCC(=O)C(C)C)I 34a_100000049635_100000753385 [1,0,0,0,0,1|1,0,0]=3 1317 B16R1.19299 COc1cc(ccc1OCC(=O)C(C)C)N 34a_100000726020_100000753385 [1,0,0,0,0,1|1,0,0]=3 1318 B16R1.19299 COc1cc(ccc1OCC(=O)N(C)C)Br 34a_100000694246_100000692301 [1,0,0,0,0,1|2,0,0]=4 1319 B16R1.19299 COc1cc(ccc1OCC(=O)N(C)C)Br 7a_100000694246_100000692301 [1,0,0,0,0,1|2,0,0]=4 1320 B16R1.19299 COc1cc(ccc1OCC(=O)N(C)C)C 11a_100102631434_100000183895 [1,0,0,0,0,1|1,0,1]=4 1321 B16R1.19299 COc1cc(ccc1OCC(=O)N(C)C)C 1626a_100102631434_100000183895 [1,0,0,0,0,1|1,0,1]=4 1322 B16R1.19299 COc1cc(ccc1OCC(=O)N(C)C)C 240690a_100102631434_100000183895 [1,0,0,0,0,1|1,0,1]=4 1323 B16R1.19299 COc1cc(ccc1OCC(=O)N(C)C)C 34a_100000186466_100000692301 [1,0,0,0,0,1|1,0,1]=4 1324 B16R1.19299 COc1cc(ccc1OCC(=O)N(C)C)C 527a_100102631434_100000183895 [1,0,0,0,0,1|1,0,1]=4 1325 B16R1.19299 COc1cc(ccc1OCC(=O)N(C)C)Cl 34a_100000033002_100000692301 [1,0,0,0,0,1|2,0,0]=4 1326 B16R1.19299 COc1cc(ccc1OCC(=O)N(C)C)F 34a_100000036057_100000692301 [1,0,0,0,0,1|2,0,0]=4 1327 B16R1.19299 COc1cc(ccc1OCC(=O)N(C)C)F 7a_100000036057_100000692301 [1,0,0,0,0,1|2,0,0]=4 1328 B16R1.19299 COc1cc(ccc1OCC(=O)N(C)C)I 34a_100000049635_100000692301 [1,0,0,0,0,1|2,0,0]=4 1329 B16R1.19299 COc1cc(ccc1OCC(=O)N(C)C)N 34a_100000726020_100000692301 [1,0,0,0,0,1|2,0,0]=4 1330 B16R1.19299 COc1cc(ccc1SCC(=O)C(C)C)Br 62a_100000753385_100010245111 [1,0,0,0,0,1|1,1,0]=4 1331 B16R1.19299 COc1cc(ccc1SCC(=O)C(C)C)Br 62a_100010245111_100000753385 [1,0,0,0,0,1|1,1,0]=4 1332 B16R1.19299 COc1cc(ccc1SCC(=O)C(C)C)C 62a_100000753385_100010200004 [1,0,0,0,0,1|0,1,1]=4 1333 B16R1.19299 COc1cc(ccc1SCC(=O)C(C)C)C 62a_100010200004_100000753385 [1,0,0,0,0,1|0,1,1]=4 1334 B16R1.19299 COc1cc(ccc1SCC(=O)C(C)C)Cl 62a_100000050115_100000753385 [1,0,0,0,0,1|1,1,0]=4 1335 B16R1.19299 COc1cc(ccc1SCC(=O)C(C)C)Cl 62a_100000753385_100000050115 [1,0,0,0,0,1|1,1,0]=4 1336 B16R1.19299 COc1cc(ccc1SCC(=O)C(C)C)F 62a_100000753385_100000757151 [1,0,0,0,0,1|1,1,0]=4 1337 B16R1.19299 COc1cc(ccc1SCC(=O)C(C)C)F 62a_100000757151_100000753385 [1,0,0,0,0,1|1,1,0]=4 1338 B16R1.19299 COc1cc(ccc1SCC(=O)C(C)C)N 62a_100000753385_100000765947 [1,0,0,0,0,1|1,1,0]=4 1339 B16R1.19299 COc1cc(ccc1SCC(=O)C(C)C)N 62a_100000765947_100000753385 [1,0,0,0,0,1|1,1,0]=4 1340 B16R1.19299 COc1cc(ccc1SCC(=O)C(C)C)O 62a_100000753385_100011827694 [1,0,0,0,0,1|0,1,1]=4 1341 B16R1.19299 COc1cc(cnc1OCC(=O)C(C)C)Cl 34a_200009845368_100000753385 [1,0,0,0,0,1|2,0,0]=4 1342 B16R1.19299 COc1nc(ccc1OCC(=O)C(C)C)Br 34a_100010893133_100000753385 [1,0,0,0,0,1|2,0,0]=4 1343 B16R1.5658 COc1ccc(cc1CC(=O)C(C)C)C=O 1458a_100000210198_100000028394 [0,0,0,0,1,1|1,0,0]=3 1344 B16R1.5658 COc1ccc(cc1CC(=O)C(C)F)C=O 1458a_100000062450_100000028394 [0,0,0,0,1,1|2,0,0]=4 1345 B16R1.5658 COc1ccc(cc1CC(=O)[C@@H](C)O)C=O 1458a_100000717761_100000028394 [0,0,0,0,1,1|2,0,0]=4 1346 B16R1.5658 COc1ccc(cc1CC(=O)[C@H](C)O)C=O 1458a_217856618621_100000028394 [0,0,0,0,1,1|2,0,0]=4 1347 B18R1.292190 C=Cc1ccc(c(c1)OC)OCC(=O)NC(C)C 34a_100011217988_100000183996 [0,0,0,0,0,2|1,0,0]=3 1348 B18R1.292190 C=Cc1ccc(c(c1)OC)OCC(=O)OC(C)C 34a_100011217988_100011215430 [0,0,0,0,0,2|1,0,0]=3 1349 B18R1.292190 CCc1ccc(c(c1)OC)OCC(=O)NC(C)C 34a_100000186467_100000183996 [0,0,0,0,0,2|1,0,1]=4 1350 B18R1.292190 CCc1ccc(c(c1)OC)OCC(=O)NC(C)C 7a_100000186467_100000183996 [0,0,0,0,0,2|1,0,1]=4 1351 B18R1.292190 CCc1ccc(c(c1)OC)OCC(=O)OC(C)C 34a_100000186467_100011215430 [0,0,0,0,0,2|1,0,1]=4 1352 B18R1.292190 CCc1ccc(c(c1)OC)OCC(=O)OC(C)C 7a_100000186467_100011215430 [0,0,0,0,0,2|1,0,1]=4 1353 B18R1.292190 COc1cc(ccc1OCC(=O)NC(C)C)C#N 34a_100000184589_100000183996 [0,0,0,0,0,2|1,0,1]=4 1354 B18R1.292190 COc1cc(ccc1OCC(=O)NC(C)C)C#N 7a_100000184589_100000183996 [0,0,0,0,0,2|1,0,1]=4 1355 B18R1.292190 COc1cc(ccc1OCC(=O)NC(C)C)CN 34a_100000185554_100000183996 [0,0,0,0,0,2|1,0,1]=4 1356 B18R1.292190 COc1cc(ccc1OCC(=O)OC(C)C)C#N 34a_100000184589_100011215430 [0,0,0,0,0,2|1,0,1]=4 1357 B18R1.292190 COc1cc(ccc1OCC(=O)OC(C)C)C#N 7a_100000184589_100011215430 [0,0,0,0,0,2|1,0,1]=4 1358 B18R1.292190 COc1cc(ccc1OCC(=O)OC(C)C)CN 34a_100000185554_100011215430 [0,0,0,0,0,2|1,0,1]=4 1359 B18R1.292190 COc1cc(ccc1SCC(=O)NC(C)C)C=O 62a_100000183996_100010244714 [0,0,0,0,0,2|0,1,0]=3 1360 B18R1.292190 COc1cc(ccc1SCC(=O)NC(C)C)C=O 62a_100010244714_100000183996 [0,0,0,0,0,2|0,1,0]=3 1361 B18R1.292190 COc1cc(ccc1SCC(=O)OC(C)C)C=O 62a_100010244714_100011215430 [0,0,0,0,0,2|0,1,0]=3 1362 B18R1.292190 COc1cc(ccc1SCC(=O)OC(C)C)C=O 62a_100011215430_100010244714 [0,0,0,0,0,2|0,1,0]=3 1363 B18R1.292190 COc1ccc(c(c1)OC)OCC(=O)NC(C)C 34a_100009840267_100000183996 [0,0,0,0,0,2|2,0,0]=4 1364 B18R1.292190 COc1ccc(c(c1)OC)OCC(=O)OC(C)C 34a_100009840267_100011215430 [0,0,0,0,0,2|2,0,0]=4 1365 B18R1.40191 C=C(C)C(=O)CCOc1ccc(cc1OC)C=O 1458a_100000185857_200009815835 [0,0,0,0,0,2|0,0,2]=4 1366 B18R1.40191 CC(C)C(=O)OCSc1ccc(cc1C#N)C=O 62a_100000139345_100010128726 [0,0,0,0,0,2|2,0,0]=4 1367 B18R1.40191 CC(C)C(=O)OCSc1ccc(cc1CO)C=O 62a_100000139345_100015639582 [0,0,0,0,0,2|2,0,0]=4 1368 B18R1.40191 CC(C)C(=O)OCSc1ccc(cc1CO)C=O 62a_100015639582_100000139345 [0,0,0,0,0,2|2,0,0]=4 1369 B18R1.40191 CCc1ccc(c(c1)OC)SCOC(=O)C(C)C 62a_100000139345_200010710389 [0,0,0,0,0,2|1,0,1]=4 1370 B18R1.40191 CCc1ccc(c(c1)OC)SCOC(=O)C(C)C 62a_200010710389_100000139345 [0,0,0,0,0,2|1,0,1]=4 1371 B18R1.40191 COc1cc(ccc1COCC(=O)C(C)C)C#N 34a_100000102359_100000753385 [0,0,0,0,0,2|1,0,1]=4 1372 B18R1.40191 COc1cc(ccc1COCC(=O)C(C)C)C#N 7a_100000102359_100000753385 [0,0,0,0,0,2|1,0,1]=4 1373 B18R1.40191 COc1cc(ccc1OCCC(=O)C(C)C)C=O 1458a_100000210198_200009815835 [0,0,0,0,0,2|0,0,0]=2 1374 B18R1.40191 COc1cc(ccc1OCCC(=O)C(C)F)C=O 1458a_100000062450_200009815835 [0,0,0,0,0,2|1,0,0]=3 1375 B18R1.40191 COc1cc(ccc1OCCC(=O)C(O)O)C=O 1458a_100000233687_200009815835 [0,0,0,0,0,2|2,0,0]=4 1376 B18R1.40191 COc1cc(ccc1OCCC(=O)[C@@H](C)O)C=O 1458a_100000717761_200009815835 [0,0,0,0,0,2|1,0,0]=3 1377 B18R1.40191 COc1cc(ccc1OCCC(=O)[C@H](C)O)C=O 1458a_217856618621_200009815835 [0,0,0,0,0,2|1,0,0]=3 1378 B18R1.40191 COc1cc(ccc1OCCN(C)C(C)C)C=O 269982a_200000211004_200009815835 [0,0,0,0,0,2|2,0,0]=4 1379 B18R1.40191 COc1cc(ccc1SCCC(=O)N(C)C)C=O 62a_100000737620_100010244714 [0,0,0,0,0,2|1,1,0]=4 1380 B18R1.40191 COc1cc(ccc1SCCC(=O)N(C)C)C=O 62a_100010244714_100000737620 [0,0,0,0,0,2|1,1,0]=4 1381 B18R1.40191 COc1cc(ccc1SCOC(=O)C(C)C)C#N 62a_100000139345_100012356288 [0,0,0,0,0,2|1,0,1]=4 1382 B18R1.40191 COc1cc(ccc1SCOC(=O)C(C)C)C=O 62a_100000139345_100010244714 [0,0,0,0,0,2|0,0,0]=2 1383 B18R1.40191 COc1cc(ccc1SCOC(=O)C(C)C)C=O 62a_100010244714_100000139345 [0,0,0,0,0,2|0,0,0]=2 1384 B18R1.40191 COc1cc(ccc1SCOC(=O)C(C)C)CO 62a_100000139345_100010234685 [0,0,0,0,0,2|0,0,2]=4 1385 B18R1.40191 COc1cc(ccc1SCOC(=O)C(C)C)CO 62a_100010234685_100000139345 [0,0,0,0,0,2|0,0,2]=4 1386 B18R1.40191 COc1ccc(c(c1)OC)COCC(=O)C(C)C 34a_100011218031_100000753385 [0,0,0,0,0,2|2,0,0]=4 1387 B18R1.40191 COc1ccc(c(c1)OC)COCC(=O)C(C)C 7a_100011218031_100000753385 [0,0,0,0,0,2|2,0,0]=4 1388 B18R1.40191 COc1ccc(c(c1)OC)SCOC(=O)C(C)C 62a_100000139345_100000750026 [0,0,0,0,0,2|2,0,0]=4 1389 B18R1.40191 COc1ccc(c(c1)OC)SCOC(=O)C(C)C 62a_100000750026_100000139345 [0,0,0,0,0,2|2,0,0]=4