0 B15R1.1873 CCc1ccc(c(c1)C(=O)C(C)C)OC 34a_100011659499_200000210301 [0,0,0,0,0,0|2,0,2]=4 1 B15R1.1873 CCc1ccc(c(c1)C(=O)C(C)C)OC 7a_100011659499_200000210301 [0,0,0,0,0,0|2,0,2]=4 2 B15R1.1873 CCc1ccc(c(c1)C(=O)C(C)C)O[13CH3] 34a_100011659499_200025704644 [0,0,0,0,0,0|2,0,2]=4 3 B15R1.1873 CCc1ccc(c(c1)C(=O)C(C)C)O[13CH3] 7a_100011659499_200025704644 [0,0,0,0,0,0|2,0,2]=4 4 B15R1.1873 COc1ccc(c(c1)C(=C(C)C)C)OC 271570a_200000049429_100011215452 [0,0,0,0,0,0|2,0,2]=4 5 B15R1.1873 COc1ccc(c(c1)C(=O)C(C)C)OC 1458a_100000185243_100000210206 [0,0,0,0,0,0|1,0,2]=3 6 B15R1.1873 COc1ccc(c(c1)C(=O)N(C)C)OC 11a_100102631434_100000185243 [0,0,0,0,0,0|2,0,2]=4 7 B15R1.1873 COc1ccc(c(c1)C(=O)N(C)C)OC 1626a_100102631434_100000185243 [0,0,0,0,0,0|2,0,2]=4 8 B15R1.1873 COc1ccc(c(c1)C(=O)N(C)C)OC 240690a_100102631434_100000185243 [0,0,0,0,0,0|2,0,2]=4 9 B15R1.1873 COc1ccc(c(c1)C(=O)N(C)C)OC 527a_100102631434_100000185243 [0,0,0,0,0,0|2,0,2]=4 10 B15R1.1873 COc1ccc(c(c1)N(C)C(=O)C)OC 11a_100000221073_100015343762 [0,0,0,0,0,0|3,0,1]=4 11 B15R1.1873 COc1ccc(c(c1)N(C)C(=O)C)OC 1626a_100000221073_100015343762 [0,0,0,0,0,0|3,0,1]=4 12 B15R1.1873 COc1ccc(c(c1)N(C)C(=O)C)OC 22a_100000221073_100000070787 [0,0,0,0,0,0|3,0,1]=4 13 B15R1.1873 COc1ccc(c(c1)N(C)C(=O)C)OC 527a_100000221073_100103153847 [0,0,0,0,0,0|3,0,1]=4 14 B15R1.1873 COc1ccc(c(c1)N(C)C(C)C)OC 2230a_100000221073_100000210206 [0,0,0,0,0,0|3,0,0]=3 15 B15R1.1873 COc1ccc(c(c1)N(C)C(C)C)OC 269982a_100000221073_100000210206 [0,0,0,0,0,0|3,0,0]=3 16 B15R1.1873 COc1ccc(c(c1)N(C)C(C)C)OC 34a_100000221073_100000210206 [0,0,0,0,0,0|3,0,0]=3 17 B14R1.1867 COc1ccc(cc1C(=O)C(C)C)C 1458a_100000204667_100000210206 [1,0,0,0,0,0|1,0,2]=4 18 B14R1.1867 COc1ccc(cc1C(=O)C(C)C)O 1458a_200000100057_100000210206 [1,0,0,0,0,0|1,0,2]=4 19 B14R1.1867 COc1ccc(cc1C(O)C(Cl)Cl)C 7a_206835378202_200000210301 [1,0,0,0,0,0|2,0,0]=3 20 B14R1.1867 Cc1ccc(c(c1)C(O)C(Cl)Cl)O[13CH3] 7a_206835378202_200025704644 [1,0,0,0,0,0|2,0,0]=3 21 B14R1.2315 CCC(=O)c1cc(ccc1OC)OC 1458a_100000185243_100000210202 [1,0,0,0,0,0|0,0,2]=3 22 B14R1.2315 CCN(C)c1cc(ccc1OC)OC 2230a_100000221073_100000210202 [1,0,0,0,0,0|2,0,0]=3 23 B14R1.2315 CCN(C)c1cc(ccc1OC)OC 269982a_100000221073_100000204670 [1,0,0,0,0,0|2,0,0]=3 24 B14R1.2315 CCN(C)c1cc(ccc1OC)OC 34a_100000221073_100000210202 [1,0,0,0,0,0|2,0,0]=3 25 B14R1.2315 CCc1ccc(c(c1)C(C)NC)OC 269862a_106832991636_200000080740 [1,0,0,0,0,0|3,0,0]=4 26 B14R1.2315 CNC(=O)c1cc(ccc1OC)OC 11a_106832991635_100000185243 [1,0,0,0,0,0|1,0,2]=4 27 B14R1.2315 CNC(=O)c1cc(ccc1OC)OC 1626a_100102657272_100000185243 [1,0,0,0,0,0|1,0,2]=4 28 B14R1.2315 CNC(=O)c1cc(ccc1OC)OC 240690a_100102657272_100000185243 [1,0,0,0,0,0|1,0,2]=4 29 B14R1.2315 CNC(=O)c1cc(ccc1OC)OC 527a_100102657272_100000185243 [1,0,0,0,0,0|1,0,2]=4 30 B14R1.2315 CNC(C)c1cc(ccc1OC)OC 2230a_100000203798_200000210301 [1,0,0,0,0,0|2,0,0]=3 31 B14R1.2315 CNC(C)c1cc(ccc1OC)OC 269862a_106832991636_100000211297 [1,0,0,0,0,0|2,0,0]=3 32 B14R1.2315 COC(=O)c1cc(ccc1OC)OC 34a_100000151008_200000210301 [1,0,0,0,0,0|1,0,2]=4 33 B14R1.2315 COC(=O)c1cc(ccc1OC)OC 7a_100000151008_200000210301 [1,0,0,0,0,0|1,0,2]=4 34 B14R1.2315 COC(=O)c1cc(ccc1O[13CH3])OC 34a_100000151008_200025704644 [1,0,0,0,0,0|1,0,2]=4 35 B14R1.2315 COC(=O)c1cc(ccc1O[13CH3])OC 7a_100000151008_200025704644 [1,0,0,0,0,0|1,0,2]=4 36 B14R1.2315 COc1ccc(c(c1)C(=O)CCl)OC 7a_100010402061_200000210301 [1,0,0,0,0,0|1,0,2]=4 37 B14R1.2315 COc1ccc(c(c1)C(=O)CCl)O[13CH3] 7a_100010402061_200025704644 [1,0,0,0,0,0|1,0,2]=4 38 B14R1.2315 COc1ccc(c(c1)C(=O)CF)OC 1458a_100000185243_100015361967 [1,0,0,0,0,0|1,0,2]=4 39 B14R1.2315 COc1ccc(c(c1)C(C)N[13CH3])OC 2230a_100000203798_200025704644 [1,0,0,0,0,0|2,0,0]=3 40 B14R1.2315 COc1ccc(c(c1)C(C)OC)OC 34a_100000246477_200000210301 [1,0,0,0,0,0|2,0,0]=3 41 B14R1.2315 COc1ccc(c(c1)C(C)OC)OC 7a_100000246477_200000210301 [1,0,0,0,0,0|2,0,0]=3 42 B14R1.2315 COc1ccc(c(c1)C(C)O[13CH3])OC 34a_100000246477_200025704644 [1,0,0,0,0,0|2,0,0]=3 43 B14R1.2315 COc1ccc(c(c1)C(C)O[13CH3])OC 7a_100000246477_200025704644 [1,0,0,0,0,0|2,0,0]=3 44 B14R1.2315 COc1ccc(c(c1)N(C)CF)OC 269982a_100000221073_100015361967 [1,0,0,0,0,0|3,0,0]=4 45 B14R1.2315 COc1ccc(c(c1)N(C)CF)OC 34a_100000221073_100015361967 [1,0,0,0,0,0|3,0,0]=4 46 B14R1.2340 COc1ccc(c(c1)C(=O)C(C)C)C 1458a_100011399813_100000210206 [1,0,0,0,0,0|1,0,2]=4 47 B14R1.2340 COc1ccc(c(c1)C(=O)C(C)C)O 1458a_100000211986_100000210206 [1,0,0,0,0,0|1,0,2]=4 48 B14R1.3723 CCc1ccc(c(c1)CN(C)C)OC 270004a_100102631434_200000117280 [1,0,0,0,0,0|3,0,0]=4 49 B14R1.3723 CCc1ccc(c(c1)NC(C)C)OC 2230a_100012035449_100000210206 [1,0,0,0,0,0|3,0,0]=4 50 B14R1.3723 CCc1ccc(c(c1)NC(C)C)OC 34a_100012035449_100000210206 [1,0,0,0,0,0|3,0,0]=4 51 B14R1.3723 CCc1ccc(c(c1)OC(C)C)OC 34a_100009844796_100000210206 [1,0,0,0,0,0|3,0,0]=4 52 B14R1.3723 CCc1ccc(c(c1)OC(C)C)OC 7a_100009844796_100000210206 [1,0,0,0,0,0|3,0,0]=4 53 B14R1.3723 CCc1ccc(c(c1)SC(C)C)OC 62a_100000210206_100010062400 [1,0,0,0,0,0|3,0,0]=4 54 B14R1.3723 CCc1ccc(c(c1)SC(C)C)OC 62a_100010062400_100000210206 [1,0,0,0,0,0|3,0,0]=4 55 B14R1.3723 CNc1ccc(c(c1)SC(C)C)OC 62a_100000210206_114948341033 [1,0,0,0,0,0|3,0,0]=4 56 B14R1.3723 CNc1ccc(c(c1)SC(C)C)OC 62a_114948341033_100000210206 [1,0,0,0,0,0|3,0,0]=4 57 B14R1.3723 COc1ccc(c(c1)C=C(C)C)OC 271570a_100102525489_100011215452 [1,0,0,0,0,0|1,0,2]=4 58 B14R1.3723 COc1ccc(c(c1)CC(=O)C)OC 1458a_100000070787_100000205131 [1,0,0,0,0,0|1,0,1]=3 59 B14R1.3723 COc1ccc(c(c1)CC(=O)C)OC 1458a_100000212042_200000210301 [1,0,0,0,0,0|1,0,1]=3 60 B14R1.3723 COc1ccc(c(c1)CC(=O)C)OC 34a_200000075431_200000210301 [1,0,0,0,0,0|1,0,1]=3 61 B14R1.3723 COc1ccc(c(c1)CC(=O)C)OC 7a_200000075431_200000210301 [1,0,0,0,0,0|1,0,1]=3 62 B14R1.3723 COc1ccc(c(c1)CC(=O)C)O[13CH3] 34a_200000075431_200025704644 [1,0,0,0,0,0|1,0,1]=3 63 B14R1.3723 COc1ccc(c(c1)CC(=O)C)O[13CH3] 7a_200000075431_200025704644 [1,0,0,0,0,0|1,0,1]=3 64 B14R1.3723 COc1ccc(c(c1)CC(=O)[13CH3])OC 1458a_100000212042_200025704644 [1,0,0,0,0,0|1,0,1]=3 65 B14R1.3723 COc1ccc(c(c1)CN(C)C)OC 269982a_100102631434_100011233847 [1,0,0,0,0,0|2,0,0]=3 66 B14R1.3723 COc1ccc(c(c1)CN(C)C)OC 270004a_100102631434_100000170336 [1,0,0,0,0,0|2,0,0]=3 67 B14R1.3723 COc1ccc(c(c1)CN(C)C)SC 62a_100000727244_200000210301 [1,0,0,0,0,0|2,1,0]=4 68 B14R1.3723 COc1ccc(c(c1)CN(C)C)SC 62a_200000210301_100000727244 [1,0,0,0,0,0|2,1,0]=4 69 B14R1.3723 COc1ccc(c(c1)CN(C)C)S[13CH3] 62a_100000727244_200025704644 [1,0,0,0,0,0|2,1,0]=4 70 B14R1.3723 COc1ccc(c(c1)CN(C)C)S[13CH3] 62a_200025704644_100000727244 [1,0,0,0,0,0|2,1,0]=4 71 B14R1.3723 COc1ccc(c(c1)NC(=O)C)OC 11a_100000184736_100015343762 [1,0,0,0,0,0|2,0,1]=4 72 B14R1.3723 COc1ccc(c(c1)NC(=O)C)OC 1626a_100000184736_100015343762 [1,0,0,0,0,0|2,0,1]=4 73 B14R1.3723 COc1ccc(c(c1)NC(=O)C)OC 22a_100000184736_100000070787 [1,0,0,0,0,0|2,0,1]=4 74 B14R1.3723 COc1ccc(c(c1)NC(C)C)OC 2230a_100000184736_100000210206 [1,0,0,0,0,0|2,0,0]=3 75 B14R1.3723 COc1ccc(c(c1)NC(C)C)OC 34a_100000184736_100000210206 [1,0,0,0,0,0|2,0,0]=3 76 B14R1.3723 COc1ccc(c(c1)OC(C)C)OC 34a_100000074795_100000210206 [1,0,0,0,0,0|2,0,0]=3 77 B14R1.3723 COc1ccc(c(c1)SC(C)C)OC 62a_100000210206_100011215452 [1,0,0,0,0,0|2,0,0]=3 78 B14R1.3723 COc1ccc(c(c1)SC(C)C)OC 62a_100011215452_100000210206 [1,0,0,0,0,0|2,0,0]=3 79 B14R1.3723 COc1ccc(cc1CC(=O)C)SC 62a_200011493461_200000210301 [1,0,0,0,0,0|1,1,1]=4 80 B14R1.3723 COc1ccc(cc1CC(=O)C)S[13CH3] 62a_200011493461_200025704644 [1,0,0,0,0,0|1,1,1]=4 81 B14R1.3723 COc1ccc(cc1OC(C)C)SC 62a_200000210301_200010232110 [1,0,0,0,0,0|2,1,0]=4 82 B14R1.3723 COc1ccc(cc1OC(C)C)SC 62a_200010232110_200000210301 [1,0,0,0,0,0|2,1,0]=4 83 B14R1.3723 COc1ccc(cc1OC(C)C)S[13CH3] 62a_200010232110_200025704644 [1,0,0,0,0,0|2,1,0]=4 84 B14R1.3723 COc1ccc(cc1OC(C)C)S[13CH3] 62a_200025704644_200010232110 [1,0,0,0,0,0|2,1,0]=4 85 B16R1.20148 C#CC(C)C(=O)c1cc(ccc1OC)OC 1458a_100000185243_200000035995 [0,1,0,0,0,0|1,0,2]=4 86 B16R1.20148 C#CC(C)N(C)c1cc(ccc1OC)OC 34a_100000221073_200000035995 [0,1,0,0,0,0|3,0,0]=4 87 B16R1.20148 C=CC(C)N(C)c1cc(ccc1OC)OC 269982a_100000221073_100011215867 [0,1,0,0,0,0|3,0,0]=4 88 B16R1.20148 CCC(C)C(=O)c1cc(ccc1OC)OC 1458a_100000185243_100000758301 [0,1,0,0,0,0|1,0,2]=4 89 B16R1.20148 CCC(C)N(C)c1cc(ccc1OC)OC 2230a_100000221073_100000758301 [0,1,0,0,0,0|3,0,0]=4 90 B16R1.20148 CCC(C)N(C)c1cc(ccc1OC)OC 269982a_100000221073_100000758301 [0,1,0,0,0,0|3,0,0]=4 91 B16R1.20148 CCC(C)N(C)c1cc(ccc1OC)OC 34a_100000221073_100011215416 [0,1,0,0,0,0|3,0,0]=4 92 B16R1.20148 COc1ccc(c(c1)C(=O)C(C)C#N)OC 1458a_100000185243_100000703298 [0,1,0,0,0,0|0,0,3]=4 93 B16R1.20148 COc1ccc(c(c1)N(C)C(C)C#N)OC 2230a_100000221073_100000184139 [0,1,0,0,0,0|2,0,1]=4 94 B16R1.20148 COc1ccc(c(c1)N(C)C(C)C#N)OC 269982a_100000221073_100000703298 [0,1,0,0,0,0|2,0,1]=4 95 B16R1.20148 COc1ccc(c(c1)N(C)C(C)CO)OC 2230a_100000221073_100012180447 [0,1,0,0,0,0|3,0,0]=4 96 B16R1.20148 COc1ccc(c(c1)N(C)C(C)CO)OC 34a_100000221073_100012180447 [0,1,0,0,0,0|3,0,0]=4 97 B16R1.20148 COc1ccc(c(c1)N(C)C(C)OC)OC 269982a_100000221073_100009879195 [0,1,0,0,0,0|3,0,0]=4 98 B16R1.20148 COc1ccc(c(c1)N(C)[C@H](C)CO)OC 269982a_100000221073_100016084084 [0,1,0,0,0,0|3,0,0]=4 99 B16R1.88028 COc1ccc(c(c1)N(C)C(C)(C)C)OC 269982a_100000221073_100000210625 [0,1,0,0,0,0|3,0,0]=4 100 B16R1.88028 COc1ccc(c(c1)N(C)C(C)(C)C)OC 34a_100000221073_100000210625 [0,1,0,0,0,0|3,0,0]=4 101 B16R2.204774 C=C(c1cc(ccc1OC)OC)C2CC2 271570a_100010895485_100011215452 [0,0,0,1,0,0|2,0,1]=4 102 B16R2.204774 COc1ccc(c(c1)N(C)C2CC2)OC 269982a_100000221073_100000211595 [0,0,0,1,0,0|3,0,0]=4 103 B16R2.204774 COc1ccc(c(c1)N(C)C2CC2)OC 34a_100000221073_100000211595 [0,0,0,1,0,0|3,0,0]=4 104 B16R1.5658 COc1ccc(c(c1)CC(=O)C(C)C)OC 1458a_100000210198_100000205131 [0,0,0,0,0,1|1,0,2]=4 105 B16R1.5658 COc1ccc(c(c1)CC(=O)C(C)C)OC 1458a_100000212042_100000210206 [0,0,0,0,0,1|1,0,2]=4 106 B16R1.5658 COc1ccc(c(c1)CC(=O)C(C)F)OC 1458a_100000062450_100000205131 [0,0,0,0,0,1|1,0,2]=4 107 B16R1.5658 COc1ccc(c(c1)CC(=O)[C@@H](C)O)OC 1458a_100000717761_100000205131 [0,0,0,0,0,1|1,0,2]=4 108 B16R1.5658 COc1ccc(c(c1)CC(=O)[C@H](C)O)OC 1458a_217856618621_100000205131 [0,0,0,0,0,1|1,0,2]=4 109 B16R1.5658 COc1ccc(c(c1)CN(C)C(C)C)OC 269982a_200000211004_100011233847 [0,0,0,0,0,1|3,0,0]=4 110 B16R1.5658 COc1ccc(c(c1)CN(C)C(C)C)OC 270004a_200000211004_100000170336 [0,0,0,0,0,1|3,0,0]=4 111 B16R1.5658 COc1ccc(c(c1)NC(=O)C(C)C)OC 11a_100000184736_100000210198 [0,0,0,0,0,1|1,0,2]=4 112 B16R1.5658 COc1ccc(c(c1)NC(=O)C(C)C)OC 1626a_100000184736_100000210198 [0,0,0,0,0,1|1,0,2]=4 113 B16R1.5658 COc1ccc(c(c1)NC(=O)C(C)C)OC 22a_100000184736_100000210198 [0,0,0,0,0,1|1,0,2]=4 114 B16R1.5658 COc1ccc(c(c1)NC(=O)C(C)F)OC 11a_100000184736_100000062450 [0,0,0,0,0,1|1,0,2]=4 115 B16R1.5658 COc1ccc(c(c1)NC(=O)C(C)F)OC 1626a_100000184736_100000062450 [0,0,0,0,0,1|1,0,2]=4 116 B16R1.5658 COc1ccc(c(c1)NC(=O)C(C)F)OC 22a_100000184736_100000062450 [0,0,0,0,0,1|1,0,2]=4 117 B16R1.5658 COc1ccc(c(c1)NC(=O)[C@@H](C)O)OC 22a_100000184736_100000717761 [0,0,0,0,0,1|1,0,2]=4 118 B16R1.5658 COc1ccc(c(c1)NC(=O)[C@H](C)O)OC 1626a_100000184736_217856618621 [0,0,0,0,0,1|1,0,2]=4 119 B16R1.5658 COc1ccc(c(c1)NC(=O)[C@H](C)O)OC 22a_100000184736_217856618621 [0,0,0,0,0,1|1,0,2]=4 120 B16R1.5658 COc1ccc(c(c1)NC(C)C(=O)C)OC 2230a_100000184736_100009814033 [0,0,0,0,0,1|2,0,1]=4 121 B16R1.5658 COc1ccc(c(c1)NC(C)C(=O)N)OC 2230a_100000184736_100000702099 [0,0,0,0,0,1|2,0,1]=4 122 B16R1.5658 COc1ccc(c(c1)NC(C)C(=O)N)OC 34a_100000184736_100000702099 [0,0,0,0,0,1|2,0,1]=4 123 B16R1.5658 COc1ccc(c(c1)NC(F)C(=O)N)OC 2230a_100000184736_100009813875 [0,0,0,0,0,1|2,0,1]=4 124 B16R1.5658 COc1ccc(c(c1)NC(F)C(=O)N)OC 34a_100000184736_100009813875 [0,0,0,0,0,1|2,0,1]=4 125 B16R1.5658 COc1ccc(c(c1)OC(C)C(=O)N)OC 34a_100000074795_100000702099 [0,0,0,0,0,1|2,0,1]=4 126 B16R1.5658 COc1ccc(c(c1)OC(F)C(=O)N)OC 34a_100000074795_100009813875 [0,0,0,0,0,1|2,0,1]=4 127 B16R1.5658 COc1ccc(c(c1)SC(C)C(=O)C)OC 62a_100009814033_100011215452 [0,0,0,0,0,1|2,0,1]=4 128 B16R1.5658 COc1ccc(c(c1)SC(C)C(=O)C)OC 62a_100011215452_100009814033 [0,0,0,0,0,1|2,0,1]=4 129 B16R1.5658 COc1ccc(c(c1)SC(C)C(=O)N)OC 62a_100000702099_100011215452 [0,0,0,0,0,1|2,0,1]=4 130 B16R1.5658 COc1ccc(c(c1)SC(C)C(=O)N)OC 62a_100011215452_100000702099 [0,0,0,0,0,1|2,0,1]=4 131 B16R1.5658 COc1ccc(c(c1)SC(F)C(=O)N)OC 62a_100009813875_100011215452 [0,0,0,0,0,1|2,0,1]=4 132 B16R1.5658 COc1ccc(c(c1)SC(F)C(=O)N)OC 62a_100011215452_100009813875 [0,0,0,0,0,1|2,0,1]=4 133 B16R1.20229 CCc1ccc(c(c1)[C@@H](N)CC(C)C)OC 271570a_100015190218_100010062400 [0,0,0,0,0,1|3,0,0]=4 134 B16R1.20229 CNc1ccc(c(c1)[C@@H](N)CC(C)C)OC 271570a_100015190218_114948341033 [0,0,0,0,0,1|3,0,0]=4 135 B16R1.20229 COc1ccc(c(c1)C(=O)CC(C)C)OC 1458a_100000185243_100000210624 [0,0,0,0,0,1|1,0,2]=4 136 B16R1.20229 COc1ccc(c(c1)C(=O)CC(C)O)OC 1458a_100000185243_100011218427 [0,0,0,0,0,1|1,0,2]=4 137 B16R1.20229 COc1ccc(c(c1)C(=O)NC(C)C)OC 11a_100138425928_100000185243 [0,0,0,0,0,1|1,0,2]=4 138 B16R1.20229 COc1ccc(c(c1)C(=O)NC(C)C)OC 1626a_100138425928_100000185243 [0,0,0,0,0,1|1,0,2]=4 139 B16R1.20229 COc1ccc(c(c1)C(=O)NC(C)C)OC 240690a_100138425928_100000185243 [0,0,0,0,0,1|1,0,2]=4 140 B16R1.20229 COc1ccc(c(c1)C(=O)NC(C)C)OC 527a_100138425928_100000185243 [0,0,0,0,0,1|1,0,2]=4 141 B16R1.20229 COc1ccc(c(c1)C(C)NC(=O)C)OC 11a_100000203798_100015343762 [0,0,0,0,0,1|2,0,1]=4 142 B16R1.20229 COc1ccc(c(c1)C(C)NC(=O)C)OC 1626a_100000203798_100015343762 [0,0,0,0,0,1|2,0,1]=4 143 B16R1.20229 COc1ccc(c(c1)C(C)NC(=O)C)OC 240690a_100000203798_100015343762 [0,0,0,0,0,1|2,0,1]=4 144 B16R1.20229 COc1ccc(c(c1)C(C)NC(=O)C)OC 527a_100000203798_100103153847 [0,0,0,0,0,1|2,0,1]=4 145 B16R1.20229 COc1ccc(c(c1)C(C)NC(C)C)OC 2230a_100000203798_100000210206 [0,0,0,0,0,1|2,0,0]=3 146 B16R1.20229 COc1ccc(c(c1)C(C)OC(C)C)OC 34a_100000246477_100000210206 [0,0,0,0,0,1|2,0,0]=3 147 B16R1.20229 COc1ccc(c(c1)C(C)OC(C)C)OC 7a_100000246477_100000210206 [0,0,0,0,0,1|2,0,0]=3 148 B16R1.20229 COc1ccc(c(c1)N(C)CC(C)C)OC 2230a_100000221073_100000210760 [0,0,0,0,0,1|3,0,0]=4 149 B16R1.20229 COc1ccc(c(c1)N(C)CC(C)C)OC 269982a_100000221073_100000210624 [0,0,0,0,0,1|3,0,0]=4 150 B16R1.20229 COc1ccc(c(c1)N(C)CC(C)C)OC 34a_100000221073_100000210624 [0,0,0,0,0,1|3,0,0]=4 151 B16R1.20229 COc1ccc(c(c1)N(C)CC(C)O)OC 2230a_100000221073_100011218427 [0,0,0,0,0,1|3,0,0]=4 152 B16R1.20229 COc1ccc(c(c1)N(C)CC(C)O)OC 269982a_100000221073_100011218427 [0,0,0,0,0,1|3,0,0]=4 153 B16R1.20229 COc1ccc(c(c1)N(C)CC(C)O)OC 34a_100000221073_100011218427 [0,0,0,0,0,1|3,0,0]=4 154 B16R1.20229 COc1ccc(c(c1)N(C)C[C@@H](C)O)OC 2230a_100000221073_100009817552 [0,0,0,0,0,1|3,0,0]=4 155 B16R1.20229 COc1ccc(c(c1)N(C)C[C@@H](C)O)OC 269982a_100000221073_100009817552 [0,0,0,0,0,1|3,0,0]=4 156 B16R1.20229 COc1ccc(c(c1)N(C)C[C@@H](C)O)OC 34a_100000221073_100009817552 [0,0,0,0,0,1|3,0,0]=4 157 B16R1.20229 COc1ccc(c(c1)[C@@H](N)CC(C)C)OC 271570a_100015190218_100011215452 [0,0,0,0,0,1|2,0,0]=3 158 B13R1.89 COc1ccccc1C(O)C(Cl)Cl 7a_206447358928_200000210301 [2,0,0,0,0,0|2,0,0]=4 159 B13R1.89 [13CH3]Oc1ccccc1C(O)C(Cl)Cl 7a_206447358928_200025704644 [2,0,0,0,0,0|2,0,0]=4 160 B13R1.897 CC(=O)C(O)c1cc(ccc1C)C 1458a_100011497465_200000210301 [2,0,0,0,0,0|1,0,1]=4 161 B13R1.897 Cc1ccc(c(c1)C(O)C(=O)[13CH3])C 1458a_100011497465_200025704644 [2,0,0,0,0,0|1,0,1]=4 162 B13R1.2209 CCC(=O)c1cc(ccc1OC)C 1458a_100000204667_100000210202 [2,0,0,0,0,0|0,0,2]=4 163 B13R1.2209 CCC(=O)c1cc(ccc1OC)C 7a_100000183590_200000210301 [2,0,0,0,0,0|0,0,2]=4 164 B13R1.2209 CCC(=O)c1cc(ccc1OC)O 1458a_200000100057_100000210202 [2,0,0,0,0,0|0,0,2]=4 165 B13R1.2209 CCC(=O)c1cc(ccc1O[13CH3])C 7a_100000183590_200025704644 [2,0,0,0,0,0|0,0,2]=4 166 B13R1.2209 CNC(C)c1cc(ccc1OC)C 269862a_106832991636_100000212259 [2,0,0,0,0,0|2,0,0]=4 167 B13R1.3089 COc1ccc(cc1CC(=O)C)C 1458a_100000070787_100000199068 [2,0,0,0,0,0|1,0,1]=4 168 B13R1.3089 COc1ccc(cc1CC(=O)C)C 1458a_100000204598_200000210301 [2,0,0,0,0,0|1,0,1]=4 169 B13R1.3089 COc1ccc(cc1CC(=O)C)O 271570a_203496583355_200011493461 [2,0,0,0,0,0|1,0,1]=4 170 B13R1.3089 COc1ccc(cc1CC(=O)[13CH3])C 1458a_100000204598_200025704644 [2,0,0,0,0,0|1,0,1]=4 171 B13R1.3089 COc1ccc(cc1CN(C)C)C 2230a_100102631434_100000199068 [2,0,0,0,0,0|2,0,0]=4 172 B13R1.3089 COc1ccc(cc1CN(C)C)C 269982a_100102631434_100000199068 [2,0,0,0,0,0|2,0,0]=4 173 B13R1.3089 COc1ccc(cc1CN(C)C)C 270004a_100102631434_100000203738 [2,0,0,0,0,0|2,0,0]=4 174 B13R1.3089 COc1ccc(cc1NC(C)C)C 2230a_100000210980_100000210206 [2,0,0,0,0,0|2,0,0]=4 175 B13R1.3089 COc1ccc(cc1NC(C)C)C 34a_100000210980_100000210206 [2,0,0,0,0,0|2,0,0]=4 176 B13R1.3089 COc1ccc(cc1OC(C)C)C 34a_100011216497_100000210206 [2,0,0,0,0,0|2,0,0]=4 177 B13R1.3089 COc1ccc(cc1OC(C)C)C 7a_100011216497_100000210206 [2,0,0,0,0,0|2,0,0]=4 178 B13R1.3089 COc1ccc(cc1OC(C)C)O 271570a_203496583355_200010232110 [2,0,0,0,0,0|2,0,0]=4 179 B13R1.3089 COc1ccc(cc1SC(C)C)C 62a_100000186399_100000210206 [2,0,0,0,0,0|2,0,0]=4 180 B13R1.3089 COc1ccc(cc1SC(C)C)C 62a_100000210206_100000186399 [2,0,0,0,0,0|2,0,0]=4 181 B13R1.3089 COc1ccc(cc1SC(C)C)O 62a_100000210206_100010234764 [2,0,0,0,0,0|2,0,0]=4 182 B13R1.3089 COc1ccc(cc1SC(C)C)O 62a_100010234764_100000210206 [2,0,0,0,0,0|2,0,0]=4 183 B13R1.355 C=CCc1cc(ccc1OC)OC 7a_200000185190_200000210301 [2,0,0,0,0,0|0,0,2]=4 184 B13R1.355 C=CCc1cc(ccc1O[13CH3])OC 7a_200000185190_200025704644 [2,0,0,0,0,0|0,0,2]=4 185 B13R1.355 C=Cc1ccc(c(c1)CCN)OC 271570a_100011290941_100000763266 [2,0,0,0,0,0|1,0,1]=4 186 B13R1.355 CC=Cc1cc(ccc1OC)OC 271570a_100016259895_100011215452 [2,0,0,0,0,0|0,0,2]=4 187 B13R1.355 CCNc1cc(ccc1OC)CC 2230a_100012035449_100000210202 [2,0,0,0,0,0|2,0,0]=4 188 B13R1.355 CCNc1cc(ccc1OC)CC 34a_100012035449_100000210202 [2,0,0,0,0,0|2,0,0]=4 189 B13R1.355 CCNc1cc(ccc1OC)OC 2230a_100000184736_100000210202 [2,0,0,0,0,0|1,0,0]=3 190 B13R1.355 CCNc1cc(ccc1OC)OC 34a_100000184736_100000210202 [2,0,0,0,0,0|1,0,0]=3 191 B13R1.355 CCOc1cc(ccc1OC)CC 34a_100009844796_100000210202 [2,0,0,0,0,0|2,0,0]=4 192 B13R1.355 CCOc1cc(ccc1OC)CC 7a_100009844796_100000210202 [2,0,0,0,0,0|2,0,0]=4 193 B13R1.355 CCOc1cc(ccc1OC)OC 34a_100000074795_100000210202 [2,0,0,0,0,0|1,0,0]=3 194 B13R1.355 CCSc1cc(ccc1OC)CC 62a_100000210202_100010062400 [2,0,0,0,0,0|2,0,0]=4 195 B13R1.355 CCSc1cc(ccc1OC)CC 62a_100010062400_100000210202 [2,0,0,0,0,0|2,0,0]=4 196 B13R1.355 CCSc1cc(ccc1OC)NC 62a_100000210202_114948341033 [2,0,0,0,0,0|2,0,0]=4 197 B13R1.355 CCSc1cc(ccc1OC)NC 62a_114948341033_100000210202 [2,0,0,0,0,0|2,0,0]=4 198 B13R1.355 CCSc1cc(ccc1OC)OC 62a_100000210202_100011215452 [2,0,0,0,0,0|1,0,0]=3 199 B13R1.355 CCSc1cc(ccc1OC)OC 62a_100011215452_100000210202 [2,0,0,0,0,0|1,0,0]=3 200 B13R1.355 CCc1ccc(c(c1)CNC)OC 207a_100102657272_200000117280 [2,0,0,0,0,0|2,0,0]=4 201 B13R1.355 CCc1ccc(c(c1)CNC)OC 26a_100102657272_100009844796 [2,0,0,0,0,0|2,0,0]=4 202 B13R1.355 CCc1ccc(c(c1)CNC)OC 270004a_106832991635_200000117280 [2,0,0,0,0,0|2,0,0]=4 203 B13R1.355 CNCc1cc(ccc1OC)OC 207a_100102657272_100000170336 [2,0,0,0,0,0|1,0,0]=3 204 B13R1.355 CNCc1cc(ccc1OC)OC 26a_100102657272_100000074795 [2,0,0,0,0,0|1,0,0]=3 205 B13R1.355 CNCc1cc(ccc1OC)OC 270004a_106832991635_100000170336 [2,0,0,0,0,0|1,0,0]=3 206 B13R1.355 CNCc1cc(ccc1OC)OC 34a_100000185951_200000210301 [2,0,0,0,0,0|1,0,0]=3 207 B13R1.355 CNCc1cc(ccc1OC)OC 34a_100102657272_100011233847 [2,0,0,0,0,0|1,0,0]=3 208 B13R1.355 CNCc1cc(ccc1OC)OC 7a_106832991635_100000205131 [2,0,0,0,0,0|1,0,0]=3 209 B13R1.355 CNCc1cc(ccc1OC)SC 62a_100000690607_200000210301 [2,0,0,0,0,0|1,1,0]=4 210 B13R1.355 CNCc1cc(ccc1OC)SC 62a_200000210301_100000690607 [2,0,0,0,0,0|1,1,0]=4 211 B13R1.355 CNCc1cc(ccc1OC)S[13CH3] 62a_100000690607_200025704644 [2,0,0,0,0,0|1,1,0]=4 212 B13R1.355 CNCc1cc(ccc1OC)S[13CH3] 62a_200025704644_100000690607 [2,0,0,0,0,0|1,1,0]=4 213 B13R1.355 COCc1cc(ccc1OC)OC 34a_100000212306_200000210301 [2,0,0,0,0,0|1,0,0]=3 214 B13R1.355 COCc1cc(ccc1OC)OC 34a_100138415774_100011233847 [2,0,0,0,0,0|1,0,0]=3 215 B13R1.355 COCc1cc(ccc1OC)SC 62a_200000210301_200011493686 [2,0,0,0,0,0|1,1,0]=4 216 B13R1.355 COCc1cc(ccc1OC)SC 62a_200011493686_200000210301 [2,0,0,0,0,0|1,1,0]=4 217 B13R1.355 COCc1cc(ccc1OC)S[13CH3] 62a_200011493686_200025704644 [2,0,0,0,0,0|1,1,0]=4 218 B13R1.355 COCc1cc(ccc1OC)S[13CH3] 62a_200025704644_200011493686 [2,0,0,0,0,0|1,1,0]=4 219 B13R1.355 COc1ccc(c(c1)CCO)SC 62a_100012259501_200000210301 [2,0,0,0,0,0|1,1,0]=4 220 B13R1.355 COc1ccc(c(c1)CCO)SC 62a_200000210301_100012259501 [2,0,0,0,0,0|1,1,0]=4 221 B13R1.355 COc1ccc(c(c1)CCO)S[13CH3] 62a_100012259501_200025704644 [2,0,0,0,0,0|1,1,0]=4 222 B13R1.355 COc1ccc(c(c1)CCO)S[13CH3] 62a_200025704644_100012259501 [2,0,0,0,0,0|1,1,0]=4 223 B13R1.355 COc1ccc(c(c1)CN[13CH3])OC 34a_100000185951_200025704644 [2,0,0,0,0,0|1,0,0]=3 224 B13R1.355 COc1ccc(c(c1)CO[13CH3])OC 34a_100000212306_200025704644 [2,0,0,0,0,0|1,0,0]=3 225 B13R1.355 COc1ccc(c(c1)CSC)OC 62a_100000205131_200000210301 [2,0,0,0,0,0|1,0,0]=3 226 B13R1.355 COc1ccc(c(c1)CSC)OC 62a_200000210301_100011233847 [2,0,0,0,0,0|1,0,0]=3 227 B13R1.355 COc1ccc(c(c1)CS[13CH3])OC 62a_100000205131_200025704644 [2,0,0,0,0,0|1,0,0]=3 228 B13R1.355 COc1ccc(c(c1)CS[13CH3])OC 62a_200025704644_100011233847 [2,0,0,0,0,0|1,0,0]=3 229 B13R1.355 COc1ccc(c(c1)NCF)OC 34a_100000184736_100015361967 [2,0,0,0,0,0|2,0,0]=4 230 B13R1.355 COc1ccc(c(c1)OCF)OC 34a_100000074795_100015361967 [2,0,0,0,0,0|2,0,0]=4 231 B13R1.355 COc1ccc(c(c1)SCF)OC 62a_100011215452_100015361967 [2,0,0,0,0,0|2,0,0]=4 232 B13R1.355 COc1ccc(c(c1)SCF)OC 62a_100015361967_100011215452 [2,0,0,0,0,0|2,0,0]=4 233 B13R1.355 COc1ccc(cc1CCN)SC 62a_100000763266_200000210301 [2,0,0,0,0,0|0,1,0]=3 234 B13R1.355 COc1ccc(cc1CCN)SC 62a_200000210301_100000763266 [2,0,0,0,0,0|0,1,0]=3 235 B13R1.355 COc1ccc(cc1CCN)S[13CH3] 62a_100000763266_200025704644 [2,0,0,0,0,0|0,1,0]=3 236 B13R1.355 COc1ccc(cc1CCN)S[13CH3] 62a_200025704644_100000763266 [2,0,0,0,0,0|0,1,0]=3 237 B13R1.2430 C=C(C)c1cc(ccc1OC)OC 271570a_100000694244_100011215452 [2,0,0,0,0,0|1,0,1]=4 238 B13R1.2430 CNc1ccc(c(c1)C(C)C)OC 2230a_100025764739_200000210301 [2,0,0,0,0,0|2,0,0]=4 239 B13R1.2430 CNc1ccc(c(c1)C(C)C)OC 34a_100025764739_200000210301 [2,0,0,0,0,0|2,0,0]=4 240 B13R1.2430 COc1ccc(c(c1)C(=O)C)OC 1458a_100000185243_200000210301 [2,0,0,0,0,0|0,0,2]=4 241 B13R1.2430 COc1ccc(c(c1)C(=O)C)OC 34a_100000081070_200000210301 [2,0,0,0,0,0|0,0,2]=4 242 B13R1.2430 COc1ccc(c(c1)C(=O)C)OC 34a_100000211518_200000210301 [2,0,0,0,0,0|0,0,2]=4 243 B13R1.2430 COc1ccc(c(c1)C(=O)C)OC 7a_100000081070_200000210301 [2,0,0,0,0,0|0,0,2]=4 244 B13R1.2430 COc1ccc(c(c1)C(=O)C)OC 7a_100000211518_200000210301 [2,0,0,0,0,0|0,0,2]=4 245 B13R1.2430 COc1ccc(c(c1)C(=O)C)O[13CH3] 34a_100000211518_200025704644 [2,0,0,0,0,0|0,0,2]=4 246 B13R1.2430 COc1ccc(c(c1)C(=O)C)O[13CH3] 7a_100000211518_200025704644 [2,0,0,0,0,0|0,0,2]=4 247 B13R1.2430 COc1ccc(c(c1)C(=O)[13CH3])OC 1458a_100000185243_200025704644 [2,0,0,0,0,0|0,0,2]=4 248 B13R1.2430 COc1ccc(c(c1)C(C)C)OC 34a_100011998526_200000210301 [2,0,0,0,0,0|1,0,0]=3 249 B13R1.2430 COc1ccc(c(c1)C(C)C)OC 7a_100011998526_200000210301 [2,0,0,0,0,0|1,0,0]=3 250 B13R1.2430 COc1ccc(c(c1)C(C)C)O[13CH3] 34a_100011998526_200025704644 [2,0,0,0,0,0|1,0,0]=3 251 B13R1.2430 COc1ccc(c(c1)C(C)C)O[13CH3] 7a_100011998526_200025704644 [2,0,0,0,0,0|1,0,0]=3 252 B13R1.2430 COc1ccc(c(c1)N(C)C)OC 2230a_100000221073_200000210301 [2,0,0,0,0,0|2,0,0]=4 253 B13R1.2430 COc1ccc(c(c1)N(C)C)OC 269982a_100000221073_200000210301 [2,0,0,0,0,0|2,0,0]=4 254 B13R1.2430 COc1ccc(c(c1)N(C)C)OC 34a_100000221073_200000210301 [2,0,0,0,0,0|2,0,0]=4 255 B13R1.2430 COc1ccc(c(c1)N(C)[13CH3])OC 2230a_100000221073_200025704644 [2,0,0,0,0,0|2,0,0]=4 256 B13R1.2430 COc1ccc(c(c1)N(C)[13CH3])OC 269982a_100000221073_200025704644 [2,0,0,0,0,0|2,0,0]=4 257 B13R1.2430 COc1ccc(c(c1)N(C)[13CH3])OC 34a_100000221073_200025704644 [2,0,0,0,0,0|2,0,0]=4 258 B13R1.2430 COc1ccc(c(c1)[C@H](C)N)SC 62a_200000210301_200015425320 [2,0,0,0,0,0|1,1,0]=4 259 B13R1.2430 COc1ccc(c(c1)[C@H](C)N)SC 62a_200015425320_200000210301 [2,0,0,0,0,0|1,1,0]=4 260 B13R1.2430 COc1ccc(c(c1)[C@H](C)N)S[13CH3] 62a_200015425320_200025704644 [2,0,0,0,0,0|1,1,0]=4 261 B13R1.2430 COc1ccc(c(c1)[C@H](C)N)S[13CH3] 62a_200025704644_200015425320 [2,0,0,0,0,0|1,1,0]=4 262 B13R1.2430 COc1ccc(cc1C(=O)C)O[13CH3] 34a_100000081070_200025704644 [2,0,0,0,0,0|0,0,2]=4 263 B13R1.2430 COc1ccc(cc1C(=O)C)O[13CH3] 7a_100000081070_200025704644 [2,0,0,0,0,0|0,0,2]=4 264 B13R1.2430 COc1ccc(cc1C(C)C)N[13CH3] 2230a_100025764739_200025704644 [2,0,0,0,0,0|2,0,0]=4 265 B13R1.2430 COc1ccc(cc1C(C)C)N[13CH3] 34a_100025764739_200025704644 [2,0,0,0,0,0|2,0,0]=4 266 B13R1.2431 CCC(=O)c1cc(ccc1C)OC 1458a_100011399813_100000210202 [2,0,0,0,0,0|0,0,2]=4 267 B13R1.2431 CCC(=O)c1cc(ccc1O)OC 1458a_100000211986_100000210202 [2,0,0,0,0,0|0,0,2]=4 268 B13R1.2431 CNC(C)c1cc(ccc1O)OC 269862a_106832991636_100000211518 [2,0,0,0,0,0|2,0,0]=4 269 B13R1.97 COc1ccc(c(c1)CN(C)C)C 270004a_100102631434_100012017359 [2,0,0,0,0,0|2,0,0]=4 270 B13R1.97 COc1ccc(c(c1)CN(C)C)O 271570a_203496583355_100000727244 [2,0,0,0,0,0|2,0,0]=4 271 B13R1.97 COc1ccc(c(c1)NC(C)C)C 2230a_100000760359_100000210206 [2,0,0,0,0,0|2,0,0]=4 272 B13R1.97 COc1ccc(c(c1)NC(C)C)C 34a_100000760359_100000210206 [2,0,0,0,0,0|2,0,0]=4 273 B13R1.97 COc1ccc(c(c1)NC(C)C)O 34a_100000188146_100000210206 [2,0,0,0,0,0|2,0,0]=4 274 B13R1.97 COc1ccc(c(c1)OC(C)C)C 34a_100012179981_100000210206 [2,0,0,0,0,0|2,0,0]=4 275 B13R1.97 COc1ccc(c(c1)OC(C)C)C 7a_100012179981_100000210206 [2,0,0,0,0,0|2,0,0]=4 276 B13R1.97 COc1ccc(c(c1)SC(C)C)C 62a_100000210206_100012349166 [2,0,0,0,0,0|2,0,0]=4 277 B13R1.97 COc1ccc(c(c1)SC(C)C)C 62a_100012349166_100000210206 [2,0,0,0,0,0|2,0,0]=4 278 B13R1.97 COc1ccc(c(c1)SC(C)C)O 62a_100000210206_100000685887 [2,0,0,0,0,0|2,0,0]=4 279 B15R1.7065 CCOc1ccc(cc1C(O)C(Cl)Cl)C 7a_206835378202_100000210202 [1,1,0,0,0,0|2,0,0]=4 280 B15R1.7065 Cc1ccc(c(c1)C(O)C(Cl)Cl)OCF 7a_206835378202_100015361967 [1,1,0,0,0,0|2,0,0]=4 281 B15R1.764 CCCC(=O)c1cc(ccc1OC)OC 1458a_100000185243_100000210303 [1,1,0,0,0,0|0,0,2]=4 282 B15R1.764 CCCN(C)c1cc(ccc1OC)OC 2230a_100000221073_100000210303 [1,1,0,0,0,0|2,0,0]=4 283 B15R1.764 CCCN(C)c1cc(ccc1OC)OC 269982a_100000221073_100000210303 [1,1,0,0,0,0|2,0,0]=4 284 B15R1.764 CCCN(C)c1cc(ccc1OC)OC 34a_100000221073_100000210303 [1,1,0,0,0,0|2,0,0]=4 285 B15R1.764 CCNC(=O)c1cc(ccc1OC)OC 11a_100015525214_100000185243 [1,1,0,0,0,0|0,0,2]=4 286 B15R1.764 CCNC(=O)c1cc(ccc1OC)OC 240690a_100015525214_100000185243 [1,1,0,0,0,0|0,0,2]=4 287 B15R1.764 CCNC(=O)c1cc(ccc1OC)OC 527a_100015525214_100000185243 [1,1,0,0,0,0|0,0,2]=4 288 B15R1.764 CCNC(C)c1cc(ccc1OC)CC 269862a_100015525214_200000080740 [1,1,0,0,0,0|2,0,0]=4 289 B15R1.764 CCNC(C)c1cc(ccc1OC)OC 2230a_100000203798_100000210202 [1,1,0,0,0,0|1,0,0]=3 290 B15R1.764 CCNC(C)c1cc(ccc1OC)OC 269862a_100015525214_100000211297 [1,1,0,0,0,0|1,0,0]=3 291 B15R1.764 CCOC(=O)c1cc(ccc1OC)OC 7a_200011212540_200000210301 [1,1,0,0,0,0|0,0,2]=4 292 B15R1.764 CCOC(=O)c1cc(ccc1O[13CH3])OC 7a_200011212540_200025704644 [1,1,0,0,0,0|0,0,2]=4 293 B15R1.764 CCOC(C)c1cc(ccc1OC)OC 34a_100000246477_100000210202 [1,1,0,0,0,0|1,0,0]=3 294 B15R1.764 CCOC(C)c1cc(ccc1OC)OC 7a_100000246477_100000210202 [1,1,0,0,0,0|1,0,0]=3 295 B15R1.764 CNCC(=O)c1cc(ccc1OC)OC 34a_100102657272_100000212055 [1,1,0,0,0,0|0,0,2]=4 296 B15R1.764 CNCC(=O)c1cc(ccc1OC)OC 7a_106832991635_100000181217 [1,1,0,0,0,0|0,0,2]=4 297 B15R1.764 CNCC(O)c1cc(ccc1OC)OC 2230a_100000738559_200000210301 [1,1,0,0,0,0|0,0,0]=2 298 B15R1.764 COCC(=O)c1cc(ccc1OC)OC 34a_100138415774_100000212055 [1,1,0,0,0,0|0,0,2]=4 299 B15R1.764 COCN(C)c1cc(ccc1OC)OC 2230a_100000221073_100000766300 [1,1,0,0,0,0|2,0,0]=4 300 B15R1.764 COCN(C)c1cc(ccc1OC)OC 269982a_100000221073_100000766300 [1,1,0,0,0,0|2,0,0]=4 301 B15R1.764 COc1ccc(c(c1)C(=O)CCF)OC 1458a_100000185243_100011217306 [1,1,0,0,0,0|0,0,2]=4 302 B15R1.764 COc1ccc(c(c1)C(=O)CCO)OC 1458a_100000185243_100000211926 [1,1,0,0,0,0|0,0,2]=4 303 B15R1.764 COc1ccc(c(c1)C(=O)CSC)OC 62a_100000181217_200000210301 [1,1,0,0,0,0|0,0,2]=4 304 B15R1.764 COc1ccc(c(c1)C(=O)CS[13CH3])OC 62a_100000181217_200025704644 [1,1,0,0,0,0|0,0,2]=4 305 B15R1.764 COc1ccc(c(c1)C(C)OCF)OC 34a_100000246477_100015361967 [1,1,0,0,0,0|2,0,0]=4 306 B15R1.764 COc1ccc(c(c1)C(C)OCF)OC 7a_100000246477_100015361967 [1,1,0,0,0,0|2,0,0]=4 307 B15R1.764 COc1ccc(c(c1)C(O)CN[13CH3])OC 2230a_100000738559_200025704644 [1,1,0,0,0,0|0,0,0]=2 308 B15R1.764 COc1ccc(c(c1)N(C)CCF)OC 2230a_100000221073_100011217306 [1,1,0,0,0,0|2,0,0]=4 309 B15R1.764 COc1ccc(c(c1)N(C)CCF)OC 269982a_100000221073_100011217306 [1,1,0,0,0,0|2,0,0]=4 310 B15R1.764 COc1ccc(c(c1)N(C)CCF)OC 34a_100000221073_100011217306 [1,1,0,0,0,0|2,0,0]=4 311 B15R1.764 COc1ccc(c(c1)N(C)CCO)OC 2230a_100000221073_100000211926 [1,1,0,0,0,0|2,0,0]=4 312 B15R1.764 COc1ccc(c(c1)N(C)CCO)OC 2230a_200011233031_200000210301 [1,1,0,0,0,0|2,0,0]=4 313 B15R1.764 COc1ccc(c(c1)N(C)CCO)OC 269982a_100000221073_100000211926 [1,1,0,0,0,0|2,0,0]=4 314 B15R1.764 COc1ccc(c(c1)N(C)CCO)OC 269982a_200011233031_200000210301 [1,1,0,0,0,0|2,0,0]=4 315 B15R1.764 COc1ccc(c(c1)N(C)CCO)OC 34a_100000221073_100000211926 [1,1,0,0,0,0|2,0,0]=4 316 B15R1.764 COc1ccc(c(c1)N(C)CCO)OC 34a_200011233031_200000210301 [1,1,0,0,0,0|2,0,0]=4 317 B15R1.764 COc1ccc(c(c1)N(C)CSC)OC 2230a_100000221073_100011218213 [1,1,0,0,0,0|2,0,0]=4 318 B15R1.764 COc1ccc(c(c1)N(C)CSC)OC 269982a_100000221073_100011218213 [1,1,0,0,0,0|2,0,0]=4 319 B15R1.764 COc1ccc(c(c1)N(C)CSC)OC 34a_100000221073_100011218213 [1,1,0,0,0,0|2,0,0]=4 320 B15R1.764 COc1ccc(c(c1)N([13CH3])CCO)OC 2230a_200011233031_200025704644 [1,1,0,0,0,0|2,0,0]=4 321 B15R1.764 COc1ccc(c(c1)N([13CH3])CCO)OC 269982a_200011233031_200025704644 [1,1,0,0,0,0|2,0,0]=4 322 B15R1.764 COc1ccc(c(c1)N([13CH3])CCO)OC 34a_200011233031_200025704644 [1,1,0,0,0,0|2,0,0]=4 323 B15R1.1791 CNC(C)c1cc(c(cc1OC)Br)OC 269862a_106832991636_100012352748 [1,1,0,0,0,0|2,0,0]=4 324 B15R1.4588 CCC(NC)c1cc(ccc1OC)OC 269862a_106832991636_100011206950 [1,1,0,0,0,0|1,0,0]=3 325 B15R1.4588 COc1ccc(c(c1)C(CN)OC)OC 34a_100000738559_200000210301 [1,1,0,0,0,0|0,0,0]=2 326 B15R1.4588 COc1ccc(c(c1)C(CN)O[13CH3])OC 34a_100000738559_200025704644 [1,1,0,0,0,0|0,0,0]=2 327 B15R1.717 COc1cc(c(c(c1)NC(C)C)OC)Br 34a_100010294495_100000210206 [1,1,0,0,0,0|2,0,0]=4 328 B15R1.717 COc1cc(c(c(c1)OC(C)C)OC)Br 34a_200020900881_100000210206 [1,1,0,0,0,0|2,0,0]=4 329 B15R1.717 COc1cc(c(c(c1)SC(C)C)OC)N 62a_100000210206_100010294495 [1,1,0,0,0,0|2,0,0]=4 330 B15R1.717 COc1cc(c(c(c1)SC(C)C)OC)N 62a_100010294495_100000210206 [1,1,0,0,0,0|2,0,0]=4 331 B15R1.717 COc1cc(c(c(c1)SC(C)C)OC)O 62a_100000210206_200020900881 [1,1,0,0,0,0|2,0,0]=4 332 B15R1.1788 COc1cc(c(cc1Br)OC)CN(C)C 270004a_100102631434_100000188581 [1,1,0,0,0,0|2,0,0]=4 333 B15R1.1788 COc1cc(c(cc1Br)OC)OC(C)C 34a_100009816818_100000210206 [1,1,0,0,0,0|2,0,0]=4 334 B15R1.1788 COc1cc(c(cc1Br)OC)OC(C)C 7a_100009816818_100000210206 [1,1,0,0,0,0|2,0,0]=4 335 B15R1.1788 COc1cc(c(cc1Br)OC)SC(C)C 62a_100000210206_100013799044 [1,1,0,0,0,0|2,0,0]=4 336 B15R1.1788 COc1cc(c(cc1Br)OC)SC(C)C 62a_100013799044_100000210206 [1,1,0,0,0,0|2,0,0]=4 337 B15R1.1788 COc1cc(c(cc1C)OC)CN(C)C 270004a_100102631434_100000079178 [1,1,0,0,0,0|2,0,0]=4 338 B15R1.1788 COc1cc(c(cc1C)OC)SC(C)C 62a_100000039368_100000210206 [1,1,0,0,0,0|2,0,0]=4 339 B15R1.1788 COc1cc(c(cc1C)OC)SC(C)C 62a_100000210206_100000039368 [1,1,0,0,0,0|2,0,0]=4 340 B15R1.1788 COc1cc(c(cc1Cl)OC)CN(C)C 270004a_100102631434_100010168916 [1,1,0,0,0,0|2,0,0]=4 341 B15R1.1788 COc1cc(c(cc1Cl)OC)NC(C)C 2230a_100000179761_100000210206 [1,1,0,0,0,0|2,0,0]=4 342 B15R1.1788 COc1cc(c(cc1Cl)OC)NC(C)C 34a_100000179761_100000210206 [1,1,0,0,0,0|2,0,0]=4 343 B15R1.1788 COc1cc(c(cc1Cl)OC)SC(C)C 62a_100000023288_100000210206 [1,1,0,0,0,0|2,0,0]=4 344 B15R1.1788 COc1cc(c(cc1Cl)OC)SC(C)C 62a_100000210206_100000023288 [1,1,0,0,0,0|2,0,0]=4 345 B15R1.1788 COc1cc(c(cc1I)OC)CN(C)C 270004a_100102631434_200010262236 [1,1,0,0,0,0|2,0,0]=4 346 B15R1.1870 COc1ccc(c(c1F)SC(C)C)OC 62a_100000210206_200016180952 [1,1,0,0,0,0|2,0,0]=4 347 B15R1.1870 COc1ccc(c(c1F)SC(C)C)OC 62a_200016180952_100000210206 [1,1,0,0,0,0|2,0,0]=4 348 B15R1.1910 C#CC(C)Nc1cc(ccc1OC)OC 34a_100000184736_200000035995 [1,1,0,0,0,0|2,0,0]=4 349 B15R1.1910 C#CC(C)Oc1cc(ccc1OC)OC 34a_100000074795_200000035995 [1,1,0,0,0,0|2,0,0]=4 350 B15R1.1910 C#CC(C)Sc1cc(ccc1OC)OC 62a_200000035995_100011215452 [1,1,0,0,0,0|2,0,0]=4 351 B15R1.1910 C=CC(C)Sc1cc(ccc1OC)OC 62a_100011215867_100011215452 [1,1,0,0,0,0|2,0,0]=4 352 B15R1.1910 CCC(=O)Cc1cc(ccc1OC)OC 1458a_100000210414_100000205131 [1,1,0,0,0,0|1,0,1]=4 353 B15R1.1910 CCC(=O)Cc1cc(ccc1OC)OC 1458a_100000212042_100000210202 [1,1,0,0,0,0|1,0,1]=4 354 B15R1.1910 CCC(C)Nc1cc(ccc1OC)OC 2230a_100000184736_100000758301 [1,1,0,0,0,0|2,0,0]=4 355 B15R1.1910 CCC(C)Nc1cc(ccc1OC)OC 34a_100000184736_100011215416 [1,1,0,0,0,0|2,0,0]=4 356 B15R1.1910 CCC(C)Oc1cc(ccc1OC)OC 34a_100000074795_100011215416 [1,1,0,0,0,0|2,0,0]=4 357 B15R1.1910 CCC(C)Sc1cc(ccc1OC)OC 62a_100000758301_100011215452 [1,1,0,0,0,0|2,0,0]=4 358 B15R1.1910 CCC(C)Sc1cc(ccc1OC)OC 62a_100011215452_100000758301 [1,1,0,0,0,0|2,0,0]=4 359 B15R1.1910 CCN(C)Cc1cc(ccc1OC)OC 269982a_100000225621_100011233847 [1,1,0,0,0,0|2,0,0]=4 360 B15R1.1910 CCN(C)Cc1cc(ccc1OC)OC 26a_100000225621_100000074795 [1,1,0,0,0,0|2,0,0]=4 361 B15R1.1910 CNC(=O)Cc1cc(ccc1OC)OC 11a_106832991635_100000212042 [1,1,0,0,0,0|1,0,1]=4 362 B15R1.1910 CNC(=O)Cc1cc(ccc1OC)OC 1626a_100102657272_100000212042 [1,1,0,0,0,0|1,0,1]=4 363 B15R1.1910 CNC(=O)Cc1cc(ccc1OC)OC 240690a_100102657272_100000212042 [1,1,0,0,0,0|1,0,1]=4 364 B15R1.1910 CNC(=O)Cc1cc(ccc1OC)OC 527a_100102657272_100000212042 [1,1,0,0,0,0|1,0,1]=4 365 B15R1.1910 COc1ccc(c(c1)CC(=O)CF)OC 1458a_100000212042_100015361967 [1,1,0,0,0,0|1,0,1]=4 366 B15R1.1910 COc1ccc(c(c1)CC(=O)CO)OC 1458a_100000210174_100000205131 [1,1,0,0,0,0|1,0,1]=4 367 B15R1.1910 COc1ccc(c(c1)NC(C)C#N)OC 2230a_100000184736_100000184139 [1,1,0,0,0,0|1,0,1]=4 368 B15R1.1910 COc1ccc(c(c1)NC(C)CO)OC 2230a_100000184736_100012180447 [1,1,0,0,0,0|2,0,0]=4 369 B15R1.1910 COc1ccc(c(c1)NC(C)CO)OC 34a_100000184736_100012180447 [1,1,0,0,0,0|2,0,0]=4 370 B15R1.1910 COc1ccc(c(c1)OC(C)CO)OC 34a_100000074795_100012180447 [1,1,0,0,0,0|2,0,0]=4 371 B15R1.1910 COc1ccc(c(c1)SC(C)C#N)OC 62a_100000703298_100011215452 [1,1,0,0,0,0|1,0,1]=4 372 B15R1.1910 COc1ccc(c(c1)SC(C)C#N)OC 62a_100011215452_100000703298 [1,1,0,0,0,0|1,0,1]=4 373 B15R1.1910 COc1ccc(c(c1)SC(C)CO)OC 62a_100012180447_100011215452 [1,1,0,0,0,0|2,0,0]=4 374 B15R1.1910 COc1ccc(c(c1)SC(C)OC)OC 62a_100009879195_100011215452 [1,1,0,0,0,0|2,0,0]=4 375 B15R1.1910 COc1ccc(c(c1)SC(C)OC)OC 62a_100011215452_100009879195 [1,1,0,0,0,0|2,0,0]=4 376 B15R1.1910 COc1ccc(c(c1)S[C@H](C)CO)OC 62a_100011215452_100016084084 [1,1,0,0,0,0|2,0,0]=4 377 B15R1.1910 COc1ccc(c(c1)S[C@H](C)CO)OC 62a_100016084084_100011215452 [1,1,0,0,0,0|2,0,0]=4 378 B15R1.4599 COc1ccc(c(c1)NC(C)(C)C)OC 34a_100000184736_100000210625 [1,1,0,0,0,0|2,0,0]=4 379 B15R1.4599 COc1ccc(c(c1)OC(C)(C)C)OC 34a_100000074795_100000210625 [1,1,0,0,0,0|2,0,0]=4 380 B15R1.4599 COc1ccc(c(c1)SC(C)(C)C)OC 62a_100000211941_100011215452 [1,1,0,0,0,0|2,0,0]=4 381 B15R1.4599 COc1ccc(c(c1)SC(C)(C)C)OC 62a_100011215452_100000211941 [1,1,0,0,0,0|2,0,0]=4 382 B15R1.5636 CCOc1ccc(cc1CC(=O)C)OC 34a_200000075431_100000210202 [1,1,0,0,0,0|1,0,1]=4 383 B15R1.5636 CCOc1ccc(cc1CC(=O)C)OC 7a_200000075431_100000210202 [1,1,0,0,0,0|1,0,1]=4 384 B15R1.5636 COc1ccc(c(c1)CC(=O)C)OCF 34a_200000075431_100015361967 [1,1,0,0,0,0|1,0,1]=4 385 B15R1.5636 COc1ccc(c(c1)CC(=O)C)OCF 7a_200000075431_100015361967 [1,1,0,0,0,0|1,0,1]=4 386 B17R1.6682 CNC(C)C(=O)Nc1cc(ccc1OC)OC 2230a_106832991635_100000181165 [0,1,0,0,0,1|0,0,2]=4 387 B17R1.6682 CNC(C)C(=O)Nc1cc(ccc1OC)OC 34a_100102657272_100000181165 [0,1,0,0,0,1|0,0,2]=4 388 B17R1.6682 CNC(C)C(=O)Nc1cc(ccc1OC)OC 7a_106832991635_100000181165 [0,1,0,0,0,1|0,0,2]=4 389 B17R1.6673 COc1ccc(c(c1)C(CN)OC(C)C)OC 34a_100000738559_100000210206 [0,1,0,0,0,1|2,0,0]=4 390 B17R1.6680 C#CC(C)OC(C)c1cc(ccc1OC)OC 34a_100000246477_200000035995 [0,1,0,0,0,1|2,0,0]=4 391 B17R1.6680 CCC(C)NC(C)c1cc(ccc1OC)OC 2230a_100000203798_100000758301 [0,1,0,0,0,1|2,0,0]=4 392 B17R1.6680 CCC(C)NC(C)c1cc(ccc1OC)OC 269862a_100000209981_100000211297 [0,1,0,0,0,1|2,0,0]=4 393 B17R1.6680 CCC(C)OC(C)c1cc(ccc1OC)OC 34a_100000246477_100011215416 [0,1,0,0,0,1|2,0,0]=4 394 B17R1.6680 CCC(C)OC(C)c1cc(ccc1OC)OC 7a_100000246477_100000758301 [0,1,0,0,0,1|2,0,0]=4 395 B17R1.6680 COc1ccc(c(c1)C(C)NC(C)C#N)OC 2230a_100000203798_100000184139 [0,1,0,0,0,1|1,0,1]=4 396 B17R1.6680 COc1ccc(c(c1)C(C)NC(C)CO)OC 2230a_100000203798_100012180447 [0,1,0,0,0,1|2,0,0]=4 397 B17R1.6680 COc1ccc(c(c1)C(C)N[C@H](C)CF)OC 269862a_100102880703_100000211297 [0,1,0,0,0,1|2,0,0]=4 398 B17R1.6680 COc1ccc(c(c1)C(C)N[C@H](C)CO)OC 269862a_100000737577_100000211297 [0,1,0,0,0,1|2,0,0]=4 399 B17R1.6680 COc1ccc(c(c1)C(C)OC(C)C#N)OC 7a_100000246477_100000703298 [0,1,0,0,0,1|1,0,1]=4 400 B17R1.6680 COc1ccc(c(c1)C(C)OC(C)CO)OC 34a_100000246477_100012180447 [0,1,0,0,0,1|2,0,0]=4 401 B17R1.6680 COc1ccc(c(c1)C(C)OC(C)CO)OC 7a_100000246477_100012180447 [0,1,0,0,0,1|2,0,0]=4 402 B17R1.20261 COc1cc(c(c(c1)[C@@H](N)CC(C)C)OC)N 271570a_100015190218_100010294495 [0,1,0,0,0,1|2,0,0]=4 403 B17R1.20261 COc1cc(c(c(c1)[C@@H](N)CC(C)C)OC)O 271570a_100015190218_200020900881 [0,1,0,0,0,1|2,0,0]=4 404 B17R1.28784 COc1cc(c(cc1Br)OC)[C@@H](N)CC(C)C 271570a_100015190218_100013799044 [0,1,0,0,0,1|2,0,0]=4 405 B17R1.28784 COc1cc(c(cc1C)OC)[C@@H](N)CC(C)C 271570a_100015190218_100000039368 [0,1,0,0,0,1|2,0,0]=4 406 B17R1.28784 COc1cc(c(cc1Cl)OC)[C@@H](N)CC(C)C 271570a_100015190218_100000023288 [0,1,0,0,0,1|2,0,0]=4 407 B17R1.28784 COc1cc(c(cc1O)OC)[C@@H](N)CC(C)C 271570a_100015190218_100009816818 [0,1,0,0,0,1|2,0,0]=4 408 B17R1.48266 COc1ccc(c(c1F)[C@@H](N)CC(C)C)OC 271570a_100015190218_200016180952 [0,1,0,0,0,1|2,0,0]=4 409 B17R1.165058 COc1ccc(c(c1)C(C)OC(C)(C)C)OC 34a_100000246477_100000210625 [0,1,0,0,0,1|2,0,0]=4 410 B17R1.18651 COc1ccc(c(c1)N(CCO)C(C)C)OC 2230a_200011233031_100000210206 [0,2,0,0,0,0|2,0,0]=4 411 B17R1.18651 COc1ccc(c(c1)N(CCO)C(C)C)OC 269982a_200011233031_100000210206 [0,2,0,0,0,0|2,0,0]=4 412 B17R1.18651 COc1ccc(c(c1)N(CCO)C(C)C)OC 34a_200011233031_100000210206 [0,2,0,0,0,0|2,0,0]=4 413 B15R2.4846 CNC1CCOc2c1cc(cc2)OC 2230a_100015190458_200000210301 [1,0,0,1,0,0|2,0,0]=4 414 B15R2.4846 CNC1CCOc2c1cc(cc2)OC 34a_100015190458_200000210301 [1,0,0,1,0,0|2,0,0]=4 415 B15R2.4846 COc1ccc2c(c1)C(CCO2)N[13CH3] 2230a_100015190458_200025704644 [1,0,0,1,0,0|2,0,0]=4 416 B15R2.4846 COc1ccc2c(c1)C(CCO2)N[13CH3] 34a_100015190458_200025704644 [1,0,0,1,0,0|2,0,0]=4 417 B15R2.5265 COc1ccc(c(c1)NC2CC2)OC 34a_100000184736_100000211595 [1,0,0,1,0,0|2,0,0]=4 418 B15R2.5265 COc1ccc(c(c1)OC2CC2)OC 34a_100000074795_100000211595 [1,0,0,1,0,0|2,0,0]=4 419 B15R2.5265 COc1ccc(c(c1)SC2CC2)OC 62a_100011215452_100000211595 [1,0,0,1,0,0|2,0,0]=4 420 B17R2.12011 COc1ccc2c(c1)C(CCO2)NC(C)C 2230a_100015190458_100000210206 [0,0,0,1,0,1|2,0,0]=4 421 B17R2.12011 COc1ccc2c(c1)C(CCO2)NC(C)C 34a_100015190458_100000210206 [0,0,0,1,0,1|2,0,0]=4 422 B17R2.433138 COc1ccc(c(c1)C(C)OC2CC2)OC 34a_100000246477_100000211595 [0,0,0,1,0,1|2,0,0]=4 423 B15R1.3762 COc1ccc(cc1[C@@H](N)CC(C)C)C 271570a_100015190218_100000186399 [1,0,0,0,0,1|2,0,0]=4 424 B15R1.3762 COc1ccc(cc1[C@@H](N)CC(C)C)O 271570a_100015190218_100010084122 [1,0,0,0,0,1|2,0,0]=4 425 B15R1.1863 COc1ccc(c(c1)[C@@H](N)CC(C)C)C 271570a_100015190218_100012349166 [1,0,0,0,0,1|2,0,0]=4 426 B15R1.1863 COc1ccc(c(c1)[C@@H](N)CC(C)C)O 271570a_100015190218_100000685887 [1,0,0,0,0,1|2,0,0]=4 427 B15R1.1882 C=C(C)CNc1cc(ccc1OC)OC 2230a_100000184736_100000748629 [1,0,0,0,0,1|1,0,1]=4 428 B15R1.1882 C=C(C)CNc1cc(ccc1OC)OC 34a_100000184736_100000748629 [1,0,0,0,0,1|1,0,1]=4 429 B15R1.1882 C=C(C)COc1cc(ccc1OC)OC 34a_100000074795_100000748629 [1,0,0,0,0,1|1,0,1]=4 430 B15R1.1882 C=C(C)CSc1cc(ccc1OC)OC 62a_100000748629_100011215452 [1,0,0,0,0,1|1,0,1]=4 431 B15R1.1882 C=C(C)CSc1cc(ccc1OC)OC 62a_100011215452_100000211660 [1,0,0,0,0,1|1,0,1]=4 432 B15R1.1882 CCc1ccc(c(c1)CNC(C)C)OC 207a_100138425928_200000117280 [1,0,0,0,0,1|2,0,0]=4 433 B15R1.1882 CCc1ccc(c(c1)NCC(C)C)OC 2230a_100012035449_100000210760 [1,0,0,0,0,1|2,0,0]=4 434 B15R1.1882 CCc1ccc(c(c1)NCC(C)C)OC 34a_100012035449_100000210624 [1,0,0,0,0,1|2,0,0]=4 435 B15R1.1882 CCc1ccc(c(c1)NCC(C)O)OC 2230a_100012035449_100011218427 [1,0,0,0,0,1|2,0,0]=4 436 B15R1.1882 CCc1ccc(c(c1)NCC(C)O)OC 34a_100012035449_100011218427 [1,0,0,0,0,1|2,0,0]=4 437 B15R1.1882 CCc1ccc(c(c1)NC[C@@H](C)O)OC 2230a_100012035449_100009817552 [1,0,0,0,0,1|2,0,0]=4 438 B15R1.1882 CCc1ccc(c(c1)NC[C@@H](C)O)OC 34a_100012035449_100009817552 [1,0,0,0,0,1|2,0,0]=4 439 B15R1.1882 CCc1ccc(c(c1)OCC(C)C)OC 34a_100009844796_100000210624 [1,0,0,0,0,1|2,0,0]=4 440 B15R1.1882 CCc1ccc(c(c1)OCC(C)C)OC 7a_100009844796_100000210760 [1,0,0,0,0,1|2,0,0]=4 441 B15R1.1882 CCc1ccc(c(c1)OCC(C)O)OC 34a_100009844796_100011218427 [1,0,0,0,0,1|2,0,0]=4 442 B15R1.1882 CCc1ccc(c(c1)OCC(C)O)OC 7a_100009844796_100011218427 [1,0,0,0,0,1|2,0,0]=4 443 B15R1.1882 CCc1ccc(c(c1)OC[C@@H](C)O)OC 34a_100009844796_100009817552 [1,0,0,0,0,1|2,0,0]=4 444 B15R1.1882 CCc1ccc(c(c1)OC[C@@H](C)O)OC 7a_100009844796_100009817552 [1,0,0,0,0,1|2,0,0]=4 445 B15R1.1882 CCc1ccc(c(c1)SCC(C)C)OC 62a_100000210624_100010062400 [1,0,0,0,0,1|2,0,0]=4 446 B15R1.1882 CCc1ccc(c(c1)SCC(C)C)OC 62a_100010062400_100000210760 [1,0,0,0,0,1|2,0,0]=4 447 B15R1.1882 CCc1ccc(c(c1)SCC(C)O)OC 62a_100010062400_100011218427 [1,0,0,0,0,1|2,0,0]=4 448 B15R1.1882 CCc1ccc(c(c1)SCC(C)O)OC 62a_100011218427_100010062400 [1,0,0,0,0,1|2,0,0]=4 449 B15R1.1882 CCc1ccc(c(c1)SC[C@@H](C)O)OC 62a_100009817552_100010062400 [1,0,0,0,0,1|2,0,0]=4 450 B15R1.1882 CCc1ccc(c(c1)SC[C@@H](C)O)OC 62a_100010062400_100009817552 [1,0,0,0,0,1|2,0,0]=4 451 B15R1.1882 CNc1ccc(c(c1)SCC(C)C)OC 62a_100000210624_114948341033 [1,0,0,0,0,1|2,0,0]=4 452 B15R1.1882 CNc1ccc(c(c1)SCC(C)C)OC 62a_114948341033_100000210760 [1,0,0,0,0,1|2,0,0]=4 453 B15R1.1882 CNc1ccc(c(c1)SCC(C)O)OC 62a_100011218427_114948341033 [1,0,0,0,0,1|2,0,0]=4 454 B15R1.1882 CNc1ccc(c(c1)SCC(C)O)OC 62a_114948341033_100011218427 [1,0,0,0,0,1|2,0,0]=4 455 B15R1.1882 CNc1ccc(c(c1)SC[C@@H](C)O)OC 62a_100009817552_114948341033 [1,0,0,0,0,1|2,0,0]=4 456 B15R1.1882 CNc1ccc(c(c1)SC[C@@H](C)O)OC 62a_114948341033_100009817552 [1,0,0,0,0,1|2,0,0]=4 457 B15R1.1882 COc1ccc(c(c1)C=CC(C)C)OC 271570a_100016257149_100011215452 [1,0,0,0,0,1|1,0,1]=4 458 B15R1.1882 COc1ccc(c(c1)C=CC(C)O)OC 271570a_200011019289_100011215452 [1,0,0,0,0,1|1,0,1]=4 459 B15R1.1882 COc1ccc(c(c1)CCC(=O)C)OC 1458a_100000736209_200000210301 [1,0,0,0,0,1|1,0,1]=4 460 B15R1.1882 COc1ccc(c(c1)CCC(=O)[13CH3])OC 1458a_100000736209_200025704644 [1,0,0,0,0,1|1,0,1]=4 461 B15R1.1882 COc1ccc(c(c1)CNC(=O)C)OC 11a_100000185951_100015343762 [1,0,0,0,0,1|1,0,1]=4 462 B15R1.1882 COc1ccc(c(c1)CNC(=O)C)OC 1626a_100000185951_100015343762 [1,0,0,0,0,1|1,0,1]=4 463 B15R1.1882 COc1ccc(c(c1)CNC(=O)C)OC 240690a_100000185951_100015343762 [1,0,0,0,0,1|1,0,1]=4 464 B15R1.1882 COc1ccc(c(c1)CNC(=O)C)OC 527a_100000185951_100103153847 [1,0,0,0,0,1|1,0,1]=4 465 B15R1.1882 COc1ccc(c(c1)CNC(C)C)OC 207a_100138425928_100000170336 [1,0,0,0,0,1|1,0,0]=3 466 B15R1.1882 COc1ccc(c(c1)CNC(C)C)OC 34a_100000185951_100000210206 [1,0,0,0,0,1|1,0,0]=3 467 B15R1.1882 COc1ccc(c(c1)CNC(C)C)OC 34a_100138425928_100011233847 [1,0,0,0,0,1|1,0,0]=3 468 B15R1.1882 COc1ccc(c(c1)COC(C)C)OC 34a_100000212225_100011233847 [1,0,0,0,0,1|1,0,0]=3 469 B15R1.1882 COc1ccc(c(c1)COC(C)C)OC 34a_100000212306_100000210206 [1,0,0,0,0,1|1,0,0]=3 470 B15R1.1882 COc1ccc(c(c1)CSC(C)C)OC 62a_100000205131_100000210206 [1,0,0,0,0,1|1,0,0]=3 471 B15R1.1882 COc1ccc(c(c1)CSC(C)C)OC 62a_100000210206_100011233847 [1,0,0,0,0,1|1,0,0]=3 472 B15R1.1882 COc1ccc(c(c1)NCC(=O)N)OC 2230a_100000184736_100000747473 [1,0,0,0,0,1|1,0,1]=4 473 B15R1.1882 COc1ccc(c(c1)NCC(=O)N)OC 34a_100000184736_100000187820 [1,0,0,0,0,1|1,0,1]=4 474 B15R1.1882 COc1ccc(c(c1)NCC(C)C)OC 2230a_100000184736_100000210760 [1,0,0,0,0,1|1,0,0]=3 475 B15R1.1882 COc1ccc(c(c1)NCC(C)C)OC 34a_100000184736_100000210624 [1,0,0,0,0,1|1,0,0]=3 476 B15R1.1882 COc1ccc(c(c1)NCC(C)O)OC 2230a_100000184736_100011218427 [1,0,0,0,0,1|1,0,0]=3 477 B15R1.1882 COc1ccc(c(c1)NCC(C)O)OC 34a_100000184736_100011218427 [1,0,0,0,0,1|1,0,0]=3 478 B15R1.1882 COc1ccc(c(c1)NCC(F)F)OC 2230a_100000184736_100011934356 [1,0,0,0,0,1|2,0,0]=4 479 B15R1.1882 COc1ccc(c(c1)NCC(F)F)OC 34a_100000184736_100011934356 [1,0,0,0,0,1|2,0,0]=4 480 B15R1.1882 COc1ccc(c(c1)NC[C@@H](C)O)OC 2230a_100000184736_100009817552 [1,0,0,0,0,1|1,0,0]=3 481 B15R1.1882 COc1ccc(c(c1)NC[C@@H](C)O)OC 34a_100000184736_100009817552 [1,0,0,0,0,1|1,0,0]=3 482 B15R1.1882 COc1ccc(c(c1)OCC(=O)N)OC 34a_100000074795_100000187820 [1,0,0,0,0,1|1,0,1]=4 483 B15R1.1882 COc1ccc(c(c1)OCC(C)C)OC 34a_100000074795_100000210624 [1,0,0,0,0,1|1,0,0]=3 484 B15R1.1882 COc1ccc(c(c1)OCC(C)O)OC 34a_100000074795_100011218427 [1,0,0,0,0,1|1,0,0]=3 485 B15R1.1882 COc1ccc(c(c1)OCC(F)F)OC 34a_100000074795_100011934356 [1,0,0,0,0,1|2,0,0]=4 486 B15R1.1882 COc1ccc(c(c1)OC[C@@H](C)O)OC 34a_100000074795_100009817552 [1,0,0,0,0,1|1,0,0]=3 487 B15R1.1882 COc1ccc(c(c1)SCC(=O)N)OC 62a_100000747473_100011215452 [1,0,0,0,0,1|1,0,1]=4 488 B15R1.1882 COc1ccc(c(c1)SCC(=O)N)OC 62a_100011215452_100000747473 [1,0,0,0,0,1|1,0,1]=4 489 B15R1.1882 COc1ccc(c(c1)SCC(C)C)OC 62a_100000210624_100011215452 [1,0,0,0,0,1|1,0,0]=3 490 B15R1.1882 COc1ccc(c(c1)SCC(C)C)OC 62a_100011215452_100000210760 [1,0,0,0,0,1|1,0,0]=3 491 B15R1.1882 COc1ccc(c(c1)SCC(C)O)OC 62a_100011215452_100011218427 [1,0,0,0,0,1|1,0,0]=3 492 B15R1.1882 COc1ccc(c(c1)SCC(C)O)OC 62a_100011218427_100011215452 [1,0,0,0,0,1|1,0,0]=3 493 B15R1.1882 COc1ccc(c(c1)SCC(F)F)OC 62a_100011215452_100011934356 [1,0,0,0,0,1|2,0,0]=4 494 B15R1.1882 COc1ccc(c(c1)SCC(F)F)OC 62a_100011934356_100011215452 [1,0,0,0,0,1|2,0,0]=4 495 B15R1.1882 COc1ccc(c(c1)SC[C@@H](C)O)OC 62a_100009817552_100011215452 [1,0,0,0,0,1|1,0,0]=3 496 B15R1.1882 COc1ccc(c(c1)SC[C@@H](C)O)OC 62a_100011215452_100009817552 [1,0,0,0,0,1|1,0,0]=3 497 B17R1.165069 COc1ccc(c(c1)CNC(C)C(C)C)OC 207a_100000211541_100000170336 [0,0,0,0,0,2|2,0,0]=4 498 B17R1.165069 COc1ccc(c(c1)CNC(C)C(C)C)OC 270004a_100000211541_100000170336 [0,0,0,0,0,2|2,0,0]=4 499 B17R1.165069 COc1ccc(c(c1)COC(C)C(C)C)OC 7a_100000748068_100000205131 [0,0,0,0,0,2|2,0,0]=4 500 B17R1.165276 COc1ccc(c(c1)NC(C)CC(C)C)OC 2230a_100000184736_100000731052 [0,0,0,0,0,2|2,0,0]=4 501 B17R1.165276 COc1ccc(c(c1)NC(C)CC(C)C)OC 34a_100000184736_100000731052 [0,0,0,0,0,2|2,0,0]=4 502 B17R1.165276 COc1ccc(c(c1)OC(C)CC(C)C)OC 34a_100000074795_100000731052 [0,0,0,0,0,2|2,0,0]=4 503 B17R1.165276 COc1ccc(c(c1)SC(C)CC(C)C)OC 62a_100000731052_100011215452 [0,0,0,0,0,2|2,0,0]=4 504 B17R1.165276 COc1ccc(c(c1)SC(C)CC(C)C)OC 62a_100011215452_100000731052 [0,0,0,0,0,2|2,0,0]=4 505 B17R1.6698 COc1ccc(c(c1)C(C)NCC(C)C)OC 2230a_100000203798_100000210760 [0,0,0,0,0,2|2,0,0]=4 506 B17R1.6698 COc1ccc(c(c1)C(C)NCC(C)C)OC 269862a_100000210953_100000211297 [0,0,0,0,0,2|2,0,0]=4 507 B17R1.6698 COc1ccc(c(c1)C(C)NCC(C)C)OC 270004a_100000203798_100000210432 [0,0,0,0,0,2|2,0,0]=4 508 B17R1.6698 COc1ccc(c(c1)C(C)NCC(C)O)OC 2230a_100000203798_100011218427 [0,0,0,0,0,2|2,0,0]=4 509 B17R1.6698 COc1ccc(c(c1)C(C)NCC(C)O)OC 269862a_100000210904_100000211297 [0,0,0,0,0,2|2,0,0]=4 510 B17R1.6698 COc1ccc(c(c1)C(C)NC[C@@H](C)O)OC 2230a_100000203798_100009817552 [0,0,0,0,0,2|2,0,0]=4 511 B17R1.6698 COc1ccc(c(c1)C(C)OCC(C)C)OC 34a_100000246477_100000210624 [0,0,0,0,0,2|2,0,0]=4 512 B17R1.6698 COc1ccc(c(c1)C(C)OCC(C)C)OC 7a_100000246477_100000210760 [0,0,0,0,0,2|2,0,0]=4 513 B17R1.6698 COc1ccc(c(c1)C(C)OCC(C)O)OC 34a_100000246477_100011218427 [0,0,0,0,0,2|2,0,0]=4 514 B17R1.6698 COc1ccc(c(c1)C(C)OCC(C)O)OC 7a_100000246477_100011218427 [0,0,0,0,0,2|2,0,0]=4 515 B17R1.6698 COc1ccc(c(c1)C(C)OC[C@@H](C)O)OC 34a_100000246477_100009817552 [0,0,0,0,0,2|2,0,0]=4 516 B17R1.6698 COc1ccc(c(c1)C(C)OC[C@@H](C)O)OC 7a_100000246477_100009817552 [0,0,0,0,0,2|2,0,0]=4 517 B17R1.6698 COc1ccc(c(c1)C(O)CNC(=O)C)OC 240690a_100000738559_100015343762 [0,0,0,0,0,2|1,0,1]=4 518 B17R1.6698 COc1ccc(c(c1)C(O)CNC(=O)C)OC 527a_100000738559_100103153847 [0,0,0,0,0,2|1,0,1]=4 519 B17R1.6698 COc1ccc(c(c1)C(O)CNC(C)C)OC 2230a_100000738559_100000210206 [0,0,0,0,0,2|1,0,0]=3