0 B16R2.1575 COc1cc(c2ccc(nc2c1)O)OC 271570a_203496583355_100000719704 [0,0,0,0,0,0|1,0,1]=2 1 B15R2.1851 C=Cc1cc(c2cccnc2c1)OC 271570a_100011290941_100010248854 [1,0,0,0,0,0|2,0,1]=4 2 B15R2.1851 C=Cc1cc(cc2c1cccc2)OC 271570a_100011290941_100010152498 [1,0,0,0,0,0|2,0,1]=4 3 B15R2.1851 C=Cc1cc(cc2c1cccn2)OC 271570a_100011290941_100010248855 [1,0,0,0,0,0|2,0,1]=4 4 B15R2.1851 CNc1cc(c2ccccc2n1)OC 27a_100102657272_200010892118 [1,0,0,0,0,0|3,0,0]=4 5 B15R2.1851 CNc1cc(cc2c1cccn2)OC 27a_100102657272_100010248855 [1,0,0,0,0,0|2,0,0]=3 6 B15R2.1851 CNc1cc(cc2c1nccc2)OC 34a_100000014381_200000210301 [1,0,0,0,0,0|3,0,0]=4 7 B15R2.1851 COc1cc(c2ccccc2c1)OC 34a_200000076035_200000210301 [1,0,0,0,0,0|1,0,0]=2 8 B15R2.1851 COc1cc(c2ccccc2c1)OC 7a_200000076035_200000210301 [1,0,0,0,0,0|1,0,0]=2 9 B15R2.1851 COc1cc(c2ccccc2c1)O[13CH3] 34a_200000076035_200025704644 [1,0,0,0,0,0|1,0,0]=2 10 B15R2.1851 COc1cc(c2ccccc2c1)O[13CH3] 7a_200000076035_200025704644 [1,0,0,0,0,0|1,0,0]=2 11 B15R2.1851 COc1cc(c2ccccc2c1)SC 62a_200000210301_100010152498 [1,0,0,0,0,0|1,1,0]=3 12 B15R2.1851 COc1cc(c2ccccc2c1)S[13CH3] 62a_200025704644_100010152498 [1,0,0,0,0,0|1,1,0]=3 13 B15R2.1851 COc1cc(c2cccnc2c1)SC 62a_100010248855_200000210301 [1,0,0,0,0,0|1,1,0]=3 14 B15R2.1851 COc1cc(c2cccnc2c1)SC 62a_200000210301_100010248855 [1,0,0,0,0,0|1,1,0]=3 15 B15R2.1851 COc1cc(c2cccnc2c1)S[13CH3] 62a_100010248855_200025704644 [1,0,0,0,0,0|1,1,0]=3 16 B15R2.1851 COc1cc(c2cccnc2c1)S[13CH3] 62a_200025704644_100010248855 [1,0,0,0,0,0|1,1,0]=3 17 B15R2.1851 COc1cc(c2ncccc2c1)N[13CH3] 34a_100000014381_200025704644 [1,0,0,0,0,0|3,0,0]=4 18 B15R2.1851 COc1cc(c2ncccc2c1)SC 62a_200000210301_200010235761 [1,0,0,0,0,0|2,1,0]=4 19 B15R2.1851 COc1cc(c2ncccc2c1)S[13CH3] 62a_200025704644_200010235761 [1,0,0,0,0,0|2,1,0]=4 20 B15R2.1851 COc1cc(cc2c1cccn2)SC 62a_200000210301_100010248854 [1,0,0,0,0,0|1,1,0]=3 21 B15R2.1851 COc1cc(cc2c1cccn2)S[13CH3] 62a_200025704644_100010248854 [1,0,0,0,0,0|1,1,0]=3 22 B15R2.1851 COc1cc(cc2c1nccc2)SC 62a_200000210301_100010248852 [1,0,0,0,0,0|2,1,0]=4 23 B15R2.1851 COc1cc(cc2c1nccc2)S[13CH3] 62a_200025704644_100010248852 [1,0,0,0,0,0|2,1,0]=4 24 B15R2.1851 COc1nc(cc2c1cccc2)SC 62a_200000210301_200000116906 [1,0,0,0,0,0|2,1,0]=4 25 B15R2.1851 COc1nc(cc2c1cccc2)S[13CH3] 62a_200025704644_200000116906 [1,0,0,0,0,0|2,1,0]=4 26 B15R2.2708 COc1cc(c2ccc(=O)oc2c1)C 34a_100000029242_200000210301 [1,0,0,0,0,0|0,0,0]=1 27 B15R2.2708 COc1cc(c2ccc(=O)oc2c1)C 7a_100000029242_200000210301 [1,0,0,0,0,0|0,0,0]=1 28 B15R2.2708 Cc1cc(cc2c1ccc(=O)o2)O[13CH3] 34a_100000029242_200025704644 [1,0,0,0,0,0|0,0,0]=1 29 B15R2.2708 Cc1cc(cc2c1ccc(=O)o2)O[13CH3] 7a_100000029242_200025704644 [1,0,0,0,0,0|0,0,0]=1 30 B15R2.22666 COc1cc(cc2c1OCC(=O)N2)O 271570a_203496583355_100012360411 [1,0,0,0,0,0|2,0,1]=4 31 B17R2.12620 C=Cc1ccc2c(cc(cc2n1)OC)OC 271570a_100011290941_100000719704 [0,1,0,0,0,0|2,0,0]=3 32 B17R2.12620 CNc1ccc2c(cc(cc2n1)OC)OC 27a_100102657272_100000719704 [0,1,0,0,0,0|2,0,0]=3 33 B15R1.420 C#CC(=O)Cc1cc(cc(c1)OC)OC 1458a_100000211873_100011215721 [0,0,1,0,0,0|1,0,2]=4 34 B15R1.420 C=CC(=O)Cc1cc(cc(c1)OC)OC 1458a_100000185746_100011215721 [0,0,1,0,0,0|1,0,0]=2 35 B15R1.420 C=CC(=O)Cc1nc(cc(n1)OC)OC 1458a_100000185746_100000042204 [0,0,1,0,0,0|3,0,0]=4 36 B15R1.420 C=CC(=O)Nc1cc(cc(c1)OC)C#N 1626a_100000125286_100000185746 [0,0,1,0,0,0|3,0,0]=4 37 B15R1.420 C=CC(=O)Nc1cc(cc(c1)OC)C#N 22a_100000125286_100000185746 [0,0,1,0,0,0|3,0,0]=4 38 B15R1.420 C=CC(=O)Nc1cc(cc(c1)OC)CO 22a_100012182899_100000185746 [0,0,1,0,0,0|3,0,0]=4 39 B15R1.420 C=CC(=O)Nc1cc(cc(c1)OC)OC 1626a_100000210928_100000185746 [0,0,1,0,0,0|1,0,0]=2 40 B15R1.420 C=CC(=O)Nc1cc(cc(c1)OC)OC 22a_100000210928_100000185746 [0,0,1,0,0,0|1,0,0]=2 41 B15R1.420 C=CC(C)Sc1cc(cc(c1)OC)OC 62a_100011215867_100000685218 [0,0,1,0,0,0|1,1,1]=4 42 B15R1.420 CCC(=O)Cc1cc(cc(c1)OC)OC 1458a_100000210414_100011215721 [0,0,1,0,0,0|1,0,2]=4 43 B15R1.420 CCC(=O)Cc1cc(cc(c1)OC)OC 1458a_100011214962_100000210202 [0,0,1,0,0,0|1,0,2]=4 44 B15R1.420 CCC(=O)Nc1cc(cc(c1)OC)OC 11a_100000210928_100000210414 [0,0,1,0,0,0|1,0,2]=4 45 B15R1.420 CCC(=O)Nc1cc(cc(c1)OC)OC 1626a_100000210928_100000210414 [0,0,1,0,0,0|1,0,2]=4 46 B15R1.420 CCC(=O)Nc1cc(cc(c1)OC)OC 22a_100000210928_100000210414 [0,0,1,0,0,0|1,0,2]=4 47 B15R1.420 CCC(=O)Nc1cc(cc(c1)OC)OC 527a_100000210928_100000210414 [0,0,1,0,0,0|1,0,2]=4 48 B15R1.420 CNC(=O)Cc1cc(cc(c1)OC)OC 11a_106832991635_100011214962 [0,0,1,0,0,0|2,0,1]=4 49 B15R1.420 CNC(=O)Cc1cc(cc(c1)OC)OC 240690a_100102657272_100011214962 [0,0,1,0,0,0|2,0,1]=4 50 B15R1.420 CNC(=O)Cc1cc(cc(c1)OC)OC 527a_100102657272_100011214962 [0,0,1,0,0,0|2,0,1]=4 51 B15R1.420 CNC(=O)Nc1cc(cc(c1)OC)OC 2430a_100000210928_100102657272 [0,0,1,0,0,0|2,0,1]=4 52 B15R1.420 CNC(=O)Nc1cc(cc(c1)OC)OC 512a_100000210928_100102657272 [0,0,1,0,0,0|2,0,1]=4 53 B15R1.420 COc1cc(cc(c1)OC)CC(=O)CF 1458a_100011214962_100015361967 [0,0,1,0,0,0|2,0,1]=4 54 B15R1.420 COc1cc(cc(c1)OC)CC(=O)CO 1458a_100000210174_100011215721 [0,0,1,0,0,0|2,0,1]=4 55 B15R1.420 COc1cc(cc(c1)OC)NC(=O)CO 22a_100000210928_100000210174 [0,0,1,0,0,0|2,0,1]=4 56 B15R1.420 COc1cc(cc(c1)OC)NC(=O)CO 527a_100000210928_100000210174 [0,0,1,0,0,0|2,0,1]=4 57 B15R1.716 COc1cc(c(c(c1)OC)Cl)NC(=O)C 11a_100009955059_100015343762 [0,0,1,0,0,0|2,0,1]=4 58 B15R1.716 COc1cc(c(c(c1)OC)Cl)NC(=O)C 1626a_100009955059_100015343762 [0,0,1,0,0,0|2,0,1]=4 59 B15R1.716 COc1cc(c(c(c1)OC)Cl)NC(=O)C 22a_100009955059_100000070787 [0,0,1,0,0,0|2,0,1]=4 60 B15R1.716 COc1cc(c(c(c1)OC)Cl)NC(=O)C 527a_100009955059_100103153847 [0,0,1,0,0,0|2,0,1]=4 61 B15R1.1904 CCc1cc(ccc1C=CC(C)O)OC 271570a_200011019289_100000720562 [0,0,1,0,0,0|2,0,1]=4 62 B15R1.1904 CCc1ccc(c(c1)OC)C=CC(C)O 271570a_200011019289_200010710389 [0,0,1,0,0,0|2,0,1]=4 63 B15R1.1904 COc1cc(c(cn1)C=CC(C)O)OC 271570a_200011019289_100010191559 [0,0,1,0,0,0|2,0,1]=4 64 B15R1.1904 COc1ccc(c(c1)OC)C=CC(=O)C 1458a_100000211080_200000210301 [0,0,1,0,0,0|1,0,0]=2 65 B15R1.1904 COc1ccc(c(c1)OC)C=CC(=O)[13CH3] 1458a_100000211080_200025704644 [0,0,1,0,0,0|1,0,0]=2 66 B15R1.1904 COc1ccc(c(c1)OC)C=CC(C)C 271570a_100016257149_100000750026 [0,0,1,0,0,0|2,0,1]=4 67 B15R1.1904 COc1ccc(c(c1)OC)C=CC(C)O 271570a_200011019289_100000750026 [0,0,1,0,0,0|1,0,1]=3 68 B15R1.1904 COc1ccc(c(c1)OC)CCC(=O)C 1458a_100011217809_200000210301 [0,0,1,0,0,0|1,0,2]=4 69 B15R1.1904 COc1ccc(c(c1)OC)CCC(=O)[13CH3] 1458a_100011217809_200025704644 [0,0,1,0,0,0|1,0,2]=4 70 B15R1.1904 COc1ccc(c(c1)OC)CNC(=O)C 11a_100000737765_100015343762 [0,0,1,0,0,0|2,0,1]=4 71 B15R1.1904 COc1ccc(c(c1)OC)CNC(=O)C 1626a_100000737765_100015343762 [0,0,1,0,0,0|2,0,1]=4 72 B15R1.1904 COc1ccc(c(c1)OC)CNC(=O)C 240690a_100000737765_100015343762 [0,0,1,0,0,0|2,0,1]=4 73 B15R1.1904 COc1ccc(c(c1)OC)CNC(=O)C 527a_100000737765_100103153847 [0,0,1,0,0,0|2,0,1]=4 74 B15R1.1904 COc1ccc(c(c1)OC)NCC(=O)N 2230a_100000211191_100000747473 [0,0,1,0,0,0|2,0,1]=4 75 B15R1.1904 COc1ccc(c(c1)OC)NCC(=O)N 34a_100000211191_100000187820 [0,0,1,0,0,0|2,0,1]=4 76 B15R1.1904 COc1ccc(c(c1)OC)NCC(=O)[O-] 34a_100000211191_100020667443 [0,0,1,0,0,0|1,0,2]=4 77 B15R1.1904 COc1ccc(c(c1)OC)OCC(=O)N 34a_100009840267_100000187820 [0,0,1,0,0,0|2,0,1]=4 78 B15R1.1904 COc1ccc(c(c1)OC)OCC(=O)[O-] 34a_100009840267_100020667443 [0,0,1,0,0,0|1,0,2]=4 79 B15R1.1904 COc1ccc(c(c1)OC)SCC(=O)N 62a_100000747473_100000750026 [0,0,1,0,0,0|2,0,1]=4 80 B15R1.1904 COc1ccc(c(c1)OC)SCC(=O)N 62a_100000750026_100000747473 [0,0,1,0,0,0|2,0,1]=4 81 B15R1.1904 COc1ccc(c(c1)OC)SCC(=O)[O-] 62a_100000750026_100020667443 [0,0,1,0,0,0|1,0,2]=4 82 B15R1.1904 COc1ccc(c(c1)OC)SCC(=O)[O-] 62a_100020667443_100000750026 [0,0,1,0,0,0|1,0,2]=4 83 B15R1.1904 COc1ccc(c(n1)OC)C=CC(C)O 271570a_200011019289_100009816055 [0,0,1,0,0,0|2,0,1]=4 84 B15R1.3619 CC=Cc1cc(cc(c1C=O)OC)OC 271570a_100016259895_100000688085 [0,0,1,0,0,0|3,0,0]=4 85 B15R1.38045 COc1cc(c(c(c1)OC)NCC=O)Cl 34a_100000041261_200009817547 [0,0,1,0,0,0|2,0,1]=4 86 B15R1.38045 COc1cc(c(c(c1)OC)SCC=O)F 62a_200009812871_200015260668 [0,0,1,0,0,0|2,0,1]=4 87 B15R1.38045 COc1cc(c(c(c1)OC)SCC=O)F 62a_200015260668_200009812871 [0,0,1,0,0,0|2,0,1]=4 88 B14R1.378 C=CC(=O)Cc1cc(cc(c1)OC)Br 1458a_100000185746_100010162483 [1,0,1,0,0,0|2,0,0]=4 89 B14R1.378 C=CC(=O)Cc1cc(cc(c1)OC)Cl 1458a_100000185746_100010188059 [1,0,1,0,0,0|2,0,0]=4 90 B14R1.378 C=CC(=O)Cc1cc(cc(c1)OC)F 1458a_100000185746_100011934817 [1,0,1,0,0,0|2,0,0]=4 91 B14R1.378 C=CC(=O)Cc1cc(nc(c1)OC)C 1458a_100000185746_200012183585 [1,0,1,0,0,0|2,0,0]=4 92 B14R1.378 C=CC(=O)Nc1cc(cc(c1)CC)C 1626a_100012022893_100000185746 [1,0,1,0,0,0|2,0,0]=4 93 B14R1.378 C=CC(=O)Nc1cc(cc(c1)CC)C 22a_100012022893_100000185746 [1,0,1,0,0,0|2,0,0]=4 94 B14R1.378 C=CC(=O)Nc1cc(cc(c1)OC)Br 1626a_100000750983_100000185746 [1,0,1,0,0,0|2,0,0]=4 95 B14R1.378 C=CC(=O)Nc1cc(cc(c1)OC)Br 22a_100000750983_100000185746 [1,0,1,0,0,0|2,0,0]=4 96 B14R1.378 C=CC(=O)Nc1cc(cc(c1)OC)C 1626a_100012001870_100000185746 [1,0,1,0,0,0|1,0,0]=3 97 B14R1.378 C=CC(=O)Nc1cc(cc(c1)OC)C 22a_100012001870_100000185746 [1,0,1,0,0,0|1,0,0]=3 98 B14R1.378 C=CC(=O)Nc1cc(cc(c1)OC)Cl 1626a_100000051436_100000185746 [1,0,1,0,0,0|2,0,0]=4 99 B14R1.378 C=CC(=O)Nc1cc(cc(c1)OC)Cl 22a_100000051436_100000185746 [1,0,1,0,0,0|2,0,0]=4 100 B14R1.378 C=CC(=O)Nc1cc(cc(c1)OC)F 1626a_100000687699_100000185746 [1,0,1,0,0,0|2,0,0]=4 101 B14R1.378 C=CC(=O)Nc1cc(cc(c1)OC)F 22a_100000687699_100000185746 [1,0,1,0,0,0|2,0,0]=4 102 B14R1.378 C=CC(=O)Nc1cc(cc(c1)OC)O 1626a_200000692186_100000185746 [1,0,1,0,0,0|1,0,0]=3 103 B14R1.378 C=CC(=O)Nc1cc(cc(c1)OC)O 22a_200000692186_100000185746 [1,0,1,0,0,0|1,0,0]=3 104 B14R1.379 COc1cc(cc(c1)OC)CC(=O)C 1458a_100000070787_100011215721 [1,0,1,0,0,0|1,0,1]=4 105 B14R1.379 COc1cc(cc(c1)OC)CC(=O)C 1458a_100011214962_200000210301 [1,0,1,0,0,0|1,0,1]=4 106 B14R1.379 COc1cc(cc(c1)OC)CC(=O)[13CH3] 1458a_100011214962_200025704644 [1,0,1,0,0,0|1,0,1]=4 107 B14R1.379 COc1cc(cc(c1)OC)NC(=O)C 11a_100000210928_100015343762 [1,0,1,0,0,0|1,0,1]=4 108 B14R1.379 COc1cc(cc(c1)OC)NC(=O)C 1626a_100000210928_100015343762 [1,0,1,0,0,0|1,0,1]=4 109 B14R1.379 COc1cc(cc(c1)OC)NC(=O)C 22a_100000210928_100000070787 [1,0,1,0,0,0|1,0,1]=4 110 B14R1.379 COc1cc(cc(c1)OC)NC(=O)C 527a_100000210928_100103153847 [1,0,1,0,0,0|1,0,1]=4 111 B14R1.763 C=CCNc1cc(cc(c1)OC)OC 2230a_100000210928_100000210623 [1,0,1,0,0,0|1,0,1]=4 112 B14R1.763 C=CCNc1cc(cc(c1)OC)OC 34a_100000210928_100015514636 [1,0,1,0,0,0|1,0,1]=4 113 B14R1.763 C=CCOc1cc(cc(c1)OC)OC 34a_100000181322_100015514636 [1,0,1,0,0,0|0,0,1]=3 114 B14R1.763 C=CCOc1cc(cc(c1)OC)OC 7a_100000181322_100015514636 [1,0,1,0,0,0|0,0,1]=3 115 B14R1.763 C=CCSc1cc(cc(c1)OC)OC 62a_100000210623_100000685218 [1,0,1,0,0,0|0,1,1]=4 116 B14R1.763 COc1cc(cc(c1)OCC=O)OC 34a_100000181322_200009817547 [1,0,1,0,0,0|1,0,1]=4 117 B14R1.763 COc1cc(cc(c1)OCC=O)OC 7a_100000181322_200015260668 [1,0,1,0,0,0|1,0,1]=4 118 B14R1.103 COc1ccc(c(c1)C)C=CC(C)O 271570a_200011019289_100000759875 [1,0,1,0,0,0|1,0,1]=4 119 B14R1.103 COc1ccc(c(c1)F)C=CC(=O)C 1458a_200102525171_200000210301 [1,0,1,0,0,0|2,0,0]=4 120 B14R1.103 COc1ccc(c(c1)F)C=CC(=O)[13CH3] 1458a_200102525171_200025704644 [1,0,1,0,0,0|2,0,0]=4 121 B14R1.103 COc1ccc(c(c1)O)C=CC(C)O 271570a_200011019289_100000719091 [1,0,1,0,0,0|1,0,1]=4 122 B14R1.1355 COc1ccc(c(c1)OC)NCC=O 2230a_100000211191_200015260668 [1,0,1,0,0,0|1,0,1]=4 123 B14R1.1355 COc1ccc(c(c1)OC)NCC=O 34a_100000211191_200009817547 [1,0,1,0,0,0|1,0,1]=4 124 B14R1.1355 COc1ccc(c(c1)OC)OCC=O 34a_100009840267_200009817547 [1,0,1,0,0,0|1,0,1]=4 125 B14R1.1355 COc1ccc(c(c1)OC)SCC=O 62a_100000750026_200015260668 [1,0,1,0,0,0|1,0,1]=4 126 B14R1.1355 COc1ccc(c(c1)OC)SCC=O 62a_200015260668_100000750026 [1,0,1,0,0,0|1,0,1]=4 127 B14R1.1600 COc1cc(ccc1C=CC(C)O)C 271570a_200011019289_100010200004 [1,0,1,0,0,0|1,0,1]=4 128 B14R1.1600 COc1cc(ccc1C=CC(C)O)O 271570a_200011019289_100011827694 [1,0,1,0,0,0|1,0,1]=4 129 B14R1.576 C=Cc1c(cc(cc1OC)OC)OC 271570a_100011290941_100000186544 [1,0,1,0,0,0|0,0,1]=3 130 B14R1.576 C=Cc1cc(cc(c1C=O)OC)OC 271570a_100011290941_100000688085 [1,0,1,0,0,0|2,0,0]=4 131 B14R1.14885 C=C=Cc1c(cc(cc1OC)OC)F 271570a_100015277604_200009812871 [1,0,1,0,0,0|1,0,1]=4 132 B14R1.14885 CC=Cc1c(cc(cc1OC)OC)F 271570a_100016259895_200009812871 [1,0,1,0,0,0|1,0,1]=4 133 B14R2.1019 COc1cc(c2ccccc2c1)Br 34a_100010001680_200000210301 [2,0,0,0,0,0|2,0,0]=4 134 B14R2.1019 COc1cc(c2ccccc2c1)Br 7a_100010001680_200000210301 [2,0,0,0,0,0|2,0,0]=4 135 B14R2.1019 COc1cc(c2ccccc2c1)O 271570a_203496583355_100010152498 [2,0,0,0,0,0|1,0,0]=3 136 B14R2.1019 COc1cc(c2ccccc2n1)O 271570a_203496583355_100009887561 [2,0,0,0,0,0|2,0,0]=4 137 B14R2.1019 COc1cc(c2cccnc2c1)O 271570a_203496583355_100010248855 [2,0,0,0,0,0|1,0,0]=3 138 B14R2.1019 COc1cc(c2ncccc2c1)O 271570a_203496583355_200010235761 [2,0,0,0,0,0|2,0,0]=4 139 B14R2.1019 CSc1cc(c2ccccc2c1)O 62a_200000210301_100010089979 [2,0,0,0,0,0|1,1,0]=4 140 B14R2.1019 [13CH3]Oc1cc(c2ccccc2c1)Br 34a_100010001680_200025704644 [2,0,0,0,0,0|2,0,0]=4 141 B14R2.1019 [13CH3]Oc1cc(c2ccccc2c1)Br 7a_100010001680_200025704644 [2,0,0,0,0,0|2,0,0]=4 142 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)O 62a_200025704644_100010089979 [2,0,0,0,0,0|1,1,0]=4 143 B14R2.1146 COc1cc(cc2c1cccc2)Br 34a_100010089979_200000210301 [2,0,0,0,0,0|2,0,0]=4 144 B14R2.1146 COc1cc(cc2c1cccc2)Br 7a_100010089979_200000210301 [2,0,0,0,0,0|2,0,0]=4 145 B14R2.1146 COc1cc(cc2c1cccn2)O 271570a_203496583355_100010248854 [2,0,0,0,0,0|1,0,0]=3 146 B14R2.1146 COc1cc(cc2c1nccc2)C 34a_100009888445_200000210301 [2,0,0,0,0,0|2,0,0]=4 147 B14R2.1146 COc1cc(cc2c1nccc2)C 7a_100009888445_200000210301 [2,0,0,0,0,0|2,0,0]=4 148 B14R2.1146 COc1cc(cc2c1nccc2)O 271570a_203496583355_100010248852 [2,0,0,0,0,0|2,0,0]=4 149 B14R2.1146 COc1cc(nc2c1cccc2)C 34a_100000698765_200000210301 [2,0,0,0,0,0|2,0,0]=4 150 B14R2.1146 COc1cc(nc2c1cccc2)O 271570a_203496583355_200010892118 [2,0,0,0,0,0|2,0,0]=4 151 B14R2.1146 CSc1cc(cc2c1cccc2)O 62a_200000210301_100010001680 [2,0,0,0,0,0|1,1,0]=4 152 B14R2.1146 Cc1cc(c2ccccc2n1)O[13CH3] 34a_100000698765_200025704644 [2,0,0,0,0,0|2,0,0]=4 153 B14R2.1146 Cc1cc(c2ncccc2c1)O[13CH3] 34a_100009888445_200025704644 [2,0,0,0,0,0|2,0,0]=4 154 B14R2.1146 Cc1cc(c2ncccc2c1)O[13CH3] 7a_100009888445_200025704644 [2,0,0,0,0,0|2,0,0]=4 155 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 34a_100010089979_200025704644 [2,0,0,0,0,0|2,0,0]=4 156 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 7a_100010089979_200025704644 [2,0,0,0,0,0|2,0,0]=4 157 B14R2.1146 [13CH3]Sc1cc(cc2c1cccc2)O 62a_200025704644_100010001680 [2,0,0,0,0,0|1,1,0]=4 158 B14R2.134 C=Cc1ccc2ccc(=O)oc2c1 271570a_100011290941_100009993525 [2,0,0,0,0,0|1,0,1]=4 159 B14R2.134 COc1ccc2c(c1)OC(=O)CC2 7a_100000044819_200000210301 [2,0,0,0,0,0|0,0,2]=4 160 B14R2.134 COc1ccc2ccc(=O)oc2c1 34a_100000185914_200000210301 [2,0,0,0,0,0|0,0,0]=2 161 B14R2.134 COc1ccc2ccc(=O)oc2c1 7a_100000185914_200000210301 [2,0,0,0,0,0|0,0,0]=2 162 B14R2.134 COc1ccc2ccc(cc2c1)Br 34a_100009816537_200000210301 [2,0,0,0,0,0|2,0,0]=4 163 B14R2.134 COc1ccc2ccc(cc2c1)Br 7a_100009816537_200000210301 [2,0,0,0,0,0|2,0,0]=4 164 B14R2.134 COc1ccc2ccc(cc2c1)C 34a_100000091598_200000210301 [2,0,0,0,0,0|2,0,0]=4 165 B14R2.134 COc1ccc2ccc(cc2c1)C 7a_100000091598_200000210301 [2,0,0,0,0,0|2,0,0]=4 166 B14R2.134 COc1ccc2ccc(cc2c1)N 34a_100015378740_200000210301 [2,0,0,0,0,0|2,0,0]=4 167 B14R2.134 COc1ccc2ccc(cc2c1)N 7a_100015378740_200000210301 [2,0,0,0,0,0|2,0,0]=4 168 B14R2.134 COc1ccc2ccc(cc2c1)O 271570a_203496583355_100010090027 [2,0,0,0,0,0|1,0,1]=4 169 B14R2.134 COc1ccc2ccc(nc2c1)C 34a_100009867695_200000210301 [2,0,0,0,0,0|2,0,0]=4 170 B14R2.134 COc1ccc2ccc(nc2c1)C 7a_100009867695_200000210301 [2,0,0,0,0,0|2,0,0]=4 171 B14R2.134 COc1ccc2ccc(nc2c1)Cl 34a_100000079174_200000210301 [2,0,0,0,0,0|2,0,0]=4 172 B14R2.134 COc1ccc2ccc(nc2c1)Cl 7a_100000079174_200000210301 [2,0,0,0,0,0|2,0,0]=4 173 B14R2.134 COc1ccc2ccc(nc2c1)O 271570a_203496583355_100009877240 [2,0,0,0,0,0|1,0,1]=4 174 B14R2.134 CSc1ccc2ccc(=O)oc2c1 62a_200000210301_100009993525 [2,0,0,0,0,0|0,1,0]=3 175 B14R2.134 Cc1ccc2ccc(cc2c1)O[13CH3] 34a_100000091598_200025704644 [2,0,0,0,0,0|2,0,0]=4 176 B14R2.134 Cc1ccc2ccc(cc2c1)O[13CH3] 7a_100000091598_200025704644 [2,0,0,0,0,0|2,0,0]=4 177 B14R2.134 Cc1ccc2ccc(cc2n1)O[13CH3] 34a_100009867695_200025704644 [2,0,0,0,0,0|2,0,0]=4 178 B14R2.134 Cc1ccc2ccc(cc2n1)O[13CH3] 7a_100009867695_200025704644 [2,0,0,0,0,0|2,0,0]=4 179 B14R2.134 [13CH3]Oc1ccc2c(c1)OC(=O)CC2 7a_100000044819_200025704644 [2,0,0,0,0,0|0,0,2]=4 180 B14R2.134 [13CH3]Oc1ccc2ccc(=O)oc2c1 34a_100000185914_200025704644 [2,0,0,0,0,0|0,0,0]=2 181 B14R2.134 [13CH3]Oc1ccc2ccc(=O)oc2c1 7a_100000185914_200025704644 [2,0,0,0,0,0|0,0,0]=2 182 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)Br 34a_100009816537_200025704644 [2,0,0,0,0,0|2,0,0]=4 183 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)Br 7a_100009816537_200025704644 [2,0,0,0,0,0|2,0,0]=4 184 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)N 34a_100015378740_200025704644 [2,0,0,0,0,0|2,0,0]=4 185 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)N 7a_100015378740_200025704644 [2,0,0,0,0,0|2,0,0]=4 186 B14R2.134 [13CH3]Oc1ccc2ccc(nc2c1)Cl 34a_100000079174_200025704644 [2,0,0,0,0,0|2,0,0]=4 187 B14R2.134 [13CH3]Oc1ccc2ccc(nc2c1)Cl 7a_100000079174_200025704644 [2,0,0,0,0,0|2,0,0]=4 188 B14R2.134 [13CH3]Sc1ccc2ccc(=O)oc2c1 62a_200025704644_100009993525 [2,0,0,0,0,0|0,1,0]=3 189 B14R2.1073 COc1cccc2c1ccc(c2)Br 34a_100010202202_200000210301 [2,0,0,0,0,0|2,0,0]=4 190 B14R2.1073 COc1cccc2c1ccc(c2)Br 7a_100010202202_200000210301 [2,0,0,0,0,0|2,0,0]=4 191 B14R2.1073 COc1cccc2c1ccc(c2)F 34a_100009846233_200000210301 [2,0,0,0,0,0|2,0,0]=4 192 B14R2.1073 COc1cccc2c1ccc(c2)F 7a_100009846233_200000210301 [2,0,0,0,0,0|2,0,0]=4 193 B14R2.1073 COc1cccc2c1ccc(c2)N 34a_100000035793_200000210301 [2,0,0,0,0,0|2,0,0]=4 194 B14R2.1073 COc1cccc2c1ccc(n2)O 271570a_203496583355_100010382897 [2,0,0,0,0,0|1,0,1]=4 195 B14R2.1073 CSc1cccc2c1ccc(=O)[nH]2 62a_200000210301_100000726145 [2,0,0,0,0,0|1,1,0]=4 196 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)Br 34a_100010202202_200025704644 [2,0,0,0,0,0|2,0,0]=4 197 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)Br 7a_100010202202_200025704644 [2,0,0,0,0,0|2,0,0]=4 198 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)F 34a_100009846233_200025704644 [2,0,0,0,0,0|2,0,0]=4 199 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)F 7a_100009846233_200025704644 [2,0,0,0,0,0|2,0,0]=4 200 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)N 34a_100000035793_200025704644 [2,0,0,0,0,0|2,0,0]=4 201 B14R2.1073 [13CH3]Sc1cccc2c1ccc(=O)[nH]2 62a_200025704644_100000726145 [2,0,0,0,0,0|1,1,0]=4 202 B16R1.1523 C=CCC(=O)Cc1cc(cc(c1)OC)OC 1458a_100000210193_100011215721 [0,1,1,0,0,0|1,0,0]=3 203 B16R1.1523 C=CCC(=O)Cc1cc(cc(c1)OC)OC 1458a_100011214962_100000210623 [0,1,1,0,0,0|1,0,0]=3 204 B16R1.1523 C=CCC(=O)Nc1cc(cc(c1)OC)OC 11a_100000210928_100000210193 [0,1,1,0,0,0|1,0,0]=3 205 B16R1.1523 C=CCC(=O)Nc1cc(cc(c1)OC)OC 1626a_100000210928_100000210193 [0,1,1,0,0,0|1,0,0]=3 206 B16R1.1523 C=CCC(=O)Nc1cc(cc(c1)OC)OC 22a_100000210928_100000210193 [0,1,1,0,0,0|1,0,0]=3 207 B16R1.1523 C=CCC(=O)Nc1cc(cc(c1)OC)OC 527a_100000210928_100000210193 [0,1,1,0,0,0|1,0,0]=3 208 B16R1.1523 CC=CC(=O)Cc1cc(cc(c1)OC)OC 1458a_100000210699_100011215721 [0,1,1,0,0,0|1,0,0]=3 209 B16R1.1523 CC=CC(=O)Nc1cc(cc(c1)OC)OC 11a_100000210928_100000210699 [0,1,1,0,0,0|1,0,0]=3 210 B16R1.1523 CC=CC(=O)Nc1cc(cc(c1)OC)OC 1626a_100000210928_100000210699 [0,1,1,0,0,0|1,0,0]=3 211 B16R1.1523 CC=CC(=O)Nc1cc(cc(c1)OC)OC 22a_100000210928_100000210699 [0,1,1,0,0,0|1,0,0]=3 212 B16R1.1523 COc1cc(cc(c1)OC)CC(=O)C=CBr 1458a_100016273825_100011215721 [0,1,1,0,0,0|1,0,0]=3 213 B16R1.1523 COc1cc(cc(c1)OC)CC(=O)C=CCl 1458a_200016279998_100011215721 [0,1,1,0,0,0|1,0,0]=3 214 B16R1.1523 COc1cc(cc(c1)OC)CC(=O)C=CI 1458a_100016256311_100011215721 [0,1,1,0,0,0|1,0,0]=3 215 B16R1.1523 COc1cc(cc(c1)OC)NC(=O)C=CBr 1626a_100000210928_100016273825 [0,1,1,0,0,0|1,0,0]=3 216 B16R1.1523 COc1cc(cc(c1)OC)NC(=O)C=CCl 11a_100000210928_200016279998 [0,1,1,0,0,0|1,0,0]=3 217 B16R1.1523 COc1cc(cc(c1)OC)NC(=O)C=CCl 1626a_100000210928_200016279998 [0,1,1,0,0,0|1,0,0]=3 218 B16R1.1523 COc1cc(cc(c1)OC)NC(=O)C=CI 1626a_100000210928_100016256311 [0,1,1,0,0,0|1,0,0]=3 219 B16R1.11588 C=CC(=O)Nc1cc(c(c(c1)OC)Cl)OC 1626a_100009986809_100000185746 [0,1,1,0,0,0|1,0,0]=3 220 B16R1.11588 C=CC(=O)Nc1cc(c(c(c1)OC)Cl)OC 22a_100009986809_100000185746 [0,1,1,0,0,0|1,0,0]=3 221 B16R1.11659 COc1cc(cc(c1)OC(C=O)C=O)OC 34a_100000181322_100000736813 [0,1,1,0,0,0|1,0,1]=4 222 B16R1.11664 C=C(Br)C(=O)Nc1cc(cc(c1)OC)OC 11a_100000210928_100009813364 [0,1,1,0,0,0|1,0,0]=3 223 B16R1.11664 C=C(Br)C(=O)Nc1cc(cc(c1)OC)OC 1626a_100000210928_100009813364 [0,1,1,0,0,0|1,0,0]=3 224 B16R1.11664 C=C(C)C(=O)Cc1cc(cc(c1)OC)OC 1458a_100000185857_100011215721 [0,1,1,0,0,0|1,0,0]=3 225 B16R1.11664 C=C(C)C(=O)Nc1cc(cc(c1)OC)OC 11a_100000210928_100000185857 [0,1,1,0,0,0|1,0,0]=3 226 B16R1.11664 C=C(C)C(=O)Nc1cc(cc(c1)OC)OC 1626a_100000210928_100000185857 [0,1,1,0,0,0|1,0,0]=3 227 B16R1.11664 C=C(C)C(=O)Nc1cc(cc(c1)OC)OC 22a_100000210928_100000185857 [0,1,1,0,0,0|1,0,0]=3 228 B16R1.11664 C=C(Cl)C(=O)Nc1cc(cc(c1)OC)OC 11a_100000210928_100000039160 [0,1,1,0,0,0|1,0,0]=3 229 B16R1.11664 C=C(Cl)C(=O)Nc1cc(cc(c1)OC)OC 1626a_100000210928_100000039160 [0,1,1,0,0,0|1,0,0]=3 230 B16R1.11664 C=C(Cl)C(=O)Nc1cc(cc(c1)OC)OC 22a_100000210928_100000039160 [0,1,1,0,0,0|1,0,0]=3 231 B16R1.11664 C=C(F)C(=O)Nc1cc(cc(c1)OC)OC 11a_100000210928_100000036797 [0,1,1,0,0,0|1,0,0]=3 232 B16R1.11664 C=C(F)C(=O)Nc1cc(cc(c1)OC)OC 1626a_100000210928_100000036797 [0,1,1,0,0,0|1,0,0]=3 233 B16R1.11664 C=C(F)C(=O)Nc1cc(cc(c1)OC)OC 22a_100000210928_100000036797 [0,1,1,0,0,0|1,0,0]=3 234 B16R1.11664 COc1cc(cc(c1)OC)NC(=O)C(=O)N 22a_100000210928_100011215815 [0,1,1,0,0,0|2,0,0]=4 235 B16R1.14455 C=CC(=O)Nc1cc(cc(c1Cl)OC)OC 1626a_100009955059_100000185746 [0,1,1,0,0,0|1,0,0]=3 236 B16R1.14455 C=CC(=O)Nc1cc(cc(c1Cl)OC)OC 22a_100009955059_100000185746 [0,1,1,0,0,0|1,0,0]=3 237 B16R1.5641 COc1ccc(c(c1)OC)C=CC(C)(C)O 271570a_200016258132_100000750026 [0,1,1,0,0,0|1,0,1]=4 238 B16R1.14579 COc1cc(c(c(c1)OC)C=CC(C)O)F 271570a_200011019289_200009812871 [0,1,1,0,0,0|1,0,1]=4 239 B16R1.20052 COc1cc(c(cc1Br)C=CC(=O)C)OC 1458a_200009812227_200000210301 [0,1,1,0,0,0|1,0,0]=3 240 B16R1.20052 COc1cc(c(cc1Br)C=CC(=O)[13CH3])OC 1458a_200009812227_200025704644 [0,1,1,0,0,0|1,0,0]=3 241 B16R1.20052 COc1cc(c(cc1F)C=CC(C)O)OC 271570a_200011019289_100010141368 [0,1,1,0,0,0|1,0,1]=4 242 B16R1.20144 COc1ccc(c(c1C)OC)C=CC(C)O 271570a_200011019289_100010234078 [0,1,1,0,0,0|1,0,1]=4 243 B16R1.20144 COc1ccc(c(c1F)OC)C=CC(C)O 271570a_200011019289_200010341284 [0,1,1,0,0,0|1,0,1]=4 244 B16R1.20195 COc1ccc(c(c1)OC)C(=CC(=O)C)C 1458a_100016998046_200000210301 [0,1,1,0,0,0|1,0,0]=3 245 B16R1.20195 COc1ccc(c(c1)OC)C(=CC(=O)[13CH3])C 1458a_100016998046_200025704644 [0,1,1,0,0,0|1,0,0]=3 246 B16R1.20195 COc1ccc(c(c1)OC)C(=O)CC(=O)C 1458a_100000070787_200000212151 [0,1,1,0,0,0|1,0,1]=4 247 B16R1.20195 COc1ccc(c(c1)OC)C(=O)CC(=O)N 1458a_100000210807_100000187820 [0,1,1,0,0,0|1,0,1]=4 248 B16R1.20195 COc1ccc(c(c1)OC)C(=O)CC(=O)[O-] 1458a_100000210807_100020667443 [0,1,1,0,0,0|0,0,2]=4 249 B16R1.20196 COc1ccc(c(c1)OC)NC(=O)C(=O)N 22a_100000211191_100011215815 [0,1,1,0,0,0|2,0,0]=4 250 B16R1.20197 CCC(=O)C=Cc1ccc(cc1OC)OC 1458a_100000211080_100000210202 [0,1,1,0,0,0|1,0,0]=3 251 B16R1.20197 CNC(=O)C=Cc1ccc(cc1OC)OC 11a_106832991635_100000211080 [0,1,1,0,0,0|1,0,0]=3 252 B16R1.20197 CNC(=O)C=Cc1ccc(cc1OC)OC 1626a_100102657272_100000211080 [0,1,1,0,0,0|1,0,0]=3 253 B16R1.20197 COC(=O)CNc1ccc(cc1OC)OC 2230a_100000211191_100000747449 [0,1,1,0,0,0|1,0,1]=4 254 B16R1.20197 COC(=O)CNc1ccc(cc1OC)OC 34a_100000211191_100000747449 [0,1,1,0,0,0|1,0,1]=4 255 B16R1.20197 COC(=O)COc1ccc(cc1OC)OC 34a_100009840267_100000747449 [0,1,1,0,0,0|1,0,1]=4 256 B16R1.20197 COC(=O)CSc1ccc(cc1OC)OC 62a_100000747449_100000750026 [0,1,1,0,0,0|1,0,1]=4 257 B16R1.20197 COC(=O)CSc1ccc(cc1OC)OC 62a_100000750026_100000747449 [0,1,1,0,0,0|1,0,1]=4 258 B16R1.20197 COc1ccc(c(c1)OC)C=CC(=O)CF 1458a_100000211080_100015361967 [0,1,1,0,0,0|1,0,0]=3 259 B16R1.20197 COc1ccc(c(c1)OC)CNC(=O)CO 240690a_100000737765_100000210174 [0,1,1,0,0,0|1,0,1]=4 260 B16R1.20197 COc1ccc(c(c1)OC)CNC(=O)CO 527a_100000737765_100000210174 [0,1,1,0,0,0|1,0,1]=4 261 B16R1.72561 COc1cc(c(c(c1)OC)NCC=O)OC 2230a_100011205168_200015260668 [0,1,1,0,0,0|1,0,1]=4 262 B16R1.72561 COc1cc(c(c(c1)OC)NCC=O)OC 34a_100011205168_200009817547 [0,1,1,0,0,0|1,0,1]=4 263 B16R1.72561 COc1cc(c(c(c1)OC)OCC=O)OC 34a_200000073592_200009817547 [0,1,1,0,0,0|1,0,1]=4 264 B16R1.72561 COc1cc(c(c(c1)OC)SCC=O)OC 62a_100000186544_200015260668 [0,1,1,0,0,0|1,0,1]=4 265 B16R1.72561 COc1cc(c(c(c1)OC)SCC=O)OC 62a_200015260668_100000186544 [0,1,1,0,0,0|1,0,1]=4 266 B16R2.1618 C=C(C)c1cc(cc2c1cccc2)OC 271570a_100000694244_100010152498 [1,1,0,0,0,0|2,0,0]=4 267 B16R2.1618 C=C(C)c1cc(cc2c1cccn2)OC 271570a_100000694244_100010248855 [1,1,0,0,0,0|2,0,0]=4 268 B16R2.1618 COc1cc(c2ccccc2c1)C(=O)C 1458a_100010090016_200000210301 [1,1,0,0,0,0|2,0,0]=4 269 B16R2.1618 COc1cc(c2ccccc2c1)C(=O)[13CH3] 1458a_100010090016_200025704644 [1,1,0,0,0,0|2,0,0]=4 270 B16R2.1618 COc1cc(c2cccnc2c1)N(C)C 27a_100102631434_100010248855 [1,1,0,0,0,0|2,0,0]=4 271 B16R2.1944 COc1cc(c2c(ccnc2c1)O)OC 271570a_203496583355_200000751283 [1,1,0,0,0,0|1,0,0]=3 272 B16R2.3814 CC=Cc1cc(c2cccnc2c1)OC 271570a_100016259895_100010248854 [1,1,0,0,0,0|2,0,0]=4 273 B16R2.3814 CCSc1cc(c2cccnc2c1)OC 62a_100000210202_100010248854 [1,1,0,0,0,0|1,1,0]=4 274 B16R2.3814 COc1cc(cc2c1cccn2)SCF 62a_100015361967_100010248854 [1,1,0,0,0,0|1,1,0]=4 275 B16R2.40082 C=C(C)c1cc(c2cccnc2c1)OC 271570a_100000694244_100010248854 [1,1,0,0,0,0|2,0,0]=4 276 B16R2.51757 CC=Cc1cc(cc2c1cccc2)OC 271570a_100016259895_100010152498 [1,1,0,0,0,0|2,0,0]=4 277 B16R2.51757 CC=Cc1cc(cc2c1cccn2)OC 271570a_100016259895_100010248855 [1,1,0,0,0,0|2,0,0]=4 278 B16R2.51757 CCNc1cc(cc2c1cccn2)OC 27a_100015525214_100010248855 [1,1,0,0,0,0|2,0,0]=4 279 B16R2.51757 CCOc1cc(cc2c1cccc2)OC 34a_200000076035_100000210202 [1,1,0,0,0,0|1,0,0]=3 280 B16R2.51757 CCOc1cc(cc2c1cccc2)OC 7a_200000076035_100000210202 [1,1,0,0,0,0|1,0,0]=3 281 B16R2.51757 CCSc1cc(cc2c1cccc2)OC 62a_100000210202_100010152498 [1,1,0,0,0,0|1,1,0]=4 282 B16R2.51757 CCSc1cc(cc2c1cccn2)OC 62a_100000210202_100010248855 [1,1,0,0,0,0|1,1,0]=4 283 B16R2.51757 CCSc1cc(cc2c1cccn2)OC 62a_100010248855_100000210202 [1,1,0,0,0,0|1,1,0]=4 284 B16R2.51757 COc1cc(c2ccccc2c1)OCF 34a_200000076035_100015361967 [1,1,0,0,0,0|1,0,0]=3 285 B16R2.51757 COc1cc(c2ccccc2c1)OCF 7a_200000076035_100015361967 [1,1,0,0,0,0|1,0,0]=3 286 B16R2.51757 COc1cc(c2ccccc2c1)SCF 62a_100015361967_100010152498 [1,1,0,0,0,0|1,1,0]=4 287 B16R2.51757 COc1cc(c2cccnc2c1)SCF 62a_100010248855_100015361967 [1,1,0,0,0,0|1,1,0]=4 288 B16R2.51757 COc1cc(c2cccnc2c1)SCF 62a_100015361967_100010248855 [1,1,0,0,0,0|1,1,0]=4 289 B16R2.21673 CCOc1cc(c2ccc(=O)oc2c1)C 34a_100000029242_100000210202 [1,1,0,0,0,0|0,0,0]=2 290 B16R2.21673 CCOc1cc(c2ccc(=O)oc2c1)C 7a_100000029242_100000210202 [1,1,0,0,0,0|0,0,0]=2 291 B16R2.21673 Cc1cc(cc2c1ccc(=O)o2)OCF 34a_100000029242_100015361967 [1,1,0,0,0,0|0,0,0]=2 292 B16R2.21673 Cc1cc(cc2c1ccc(=O)o2)OCF 7a_100000029242_100015361967 [1,1,0,0,0,0|0,0,0]=2 293 B18R2.632 C=C(C)c1ccc2c(cc(cc2n1)OC)OC 271570a_100000694244_100000719704 [0,2,0,0,0,0|2,0,0]=4 294 B18R2.632 COc1cc(c2ccc(nc2c1)N(C)C)OC 27a_100102631434_100000719704 [0,2,0,0,0,0|2,0,0]=4 295 B18R2.75876 C=C=Cc1ccc2c(cc(cc2n1)OC)OC 271570a_100015277604_100000719704 [0,2,0,0,0,0|2,0,0]=4 296 B18R2.75876 CC=Cc1ccc2c(cc(cc2n1)OC)OC 271570a_100016259895_100000719704 [0,2,0,0,0,0|2,0,0]=4 297 B18R2.75876 CCNc1ccc2c(cc(cc2n1)OC)OC 27a_100015525214_100000719704 [0,2,0,0,0,0|2,0,0]=4 298 B14R1.357 CCC(=O)c1cc(cc(c1)OC)OC 1458a_100000210870_100000210202 [0,0,1,0,1,0|0,0,2]=4 299 B14R1.357 CNC(=O)c1cc(cc(c1)OC)OC 11a_106832991635_100000210870 [0,0,1,0,1,0|1,0,1]=4 300 B14R1.357 CNC(=O)c1cc(cc(c1)OC)OC 1626a_100102657272_100000210870 [0,0,1,0,1,0|1,0,1]=4 301 B14R1.357 CNC(=O)c1cc(cc(c1)OC)OC 240690a_100102657272_100000210870 [0,0,1,0,1,0|1,0,1]=4 302 B14R1.357 CNC(=O)c1cc(cc(c1)OC)OC 527a_100102657272_100000210870 [0,0,1,0,1,0|1,0,1]=4 303 B14R1.357 COC(=O)c1cc(cc(c1)OC)OC 34a_100000076322_200000210301 [0,0,1,0,1,0|1,0,1]=4 304 B14R1.357 COC(=O)c1cc(cc(c1)OC)OC 7a_100000076322_200000210301 [0,0,1,0,1,0|1,0,1]=4 305 B14R1.357 COC(=O)c1cc(cc(c1)O[13CH3])OC 34a_100000076322_200025704644 [0,0,1,0,1,0|1,0,1]=4 306 B14R1.357 COC(=O)c1cc(cc(c1)O[13CH3])OC 7a_100000076322_200025704644 [0,0,1,0,1,0|1,0,1]=4 307 B14R1.357 COc1cc(cc(c1)C(=O)CF)OC 1458a_100000210870_100015361967 [0,0,1,0,1,0|1,0,1]=4 308 B14R1.101 COc1ccc(c(c1)OC)C=C(C)C 271570a_100102525489_100000750026 [0,0,1,0,1,0|2,0,0]=4 309 B14R1.101 COc1ccc(c(c1)OC)CC(=O)C 1458a_100000195418_200000210301 [0,0,1,0,1,0|1,0,1]=4 310 B14R1.101 COc1ccc(c(c1)OC)CC(=O)[13CH3] 1458a_100000195418_200025704644 [0,0,1,0,1,0|1,0,1]=4 311 B14R1.101 COc1ccc(c(c1)OC)NC(=O)C 11a_100000211191_100015343762 [0,0,1,0,1,0|2,0,0]=4 312 B14R1.101 COc1ccc(c(c1)OC)NC(=O)C 1626a_100000211191_100015343762 [0,0,1,0,1,0|2,0,0]=4 313 B14R1.101 COc1ccc(c(c1)OC)NC(=O)C 22a_100000211191_100000070787 [0,0,1,0,1,0|2,0,0]=4 314 B14R1.101 COc1ccc(c(c1)OC)NC(=O)C 527a_100000211191_100103153847 [0,0,1,0,1,0|2,0,0]=4 315 B14R2.1101 COc1cc(c2cc[nH]c2c1)SC 62a_200000210301_100010006585 [1,0,0,0,1,0|1,1,0]=4 316 B14R2.1101 COc1cc(c2cc[nH]c2c1)S[13CH3] 62a_200025704644_100010006585 [1,0,0,0,1,0|1,1,0]=4 317 B14R2.1101 COc1cc(cc2c1cc[nH]2)SC 62a_200000210301_100010006603 [1,0,0,0,1,0|1,1,0]=4 318 B14R2.1101 COc1cc(cc2c1cc[nH]2)S[13CH3] 62a_200025704644_100010006603 [1,0,0,0,1,0|1,1,0]=4 319 B16R1.434 C=CC(=O)NCc1cc(cc(c1)OC)OC 1626a_100000737887_100000185746 [0,0,1,0,0,1|1,0,0]=3 320 B16R1.434 C=CC(=O)NCc1cc(cc(c1)OC)OC 240690a_100000737887_200121576911 [0,0,1,0,0,1|1,0,0]=3 321 B16R1.434 C=CC(C)OCc1cc(cc(c1)OC)OC 34a_100000695699_100011215721 [0,0,1,0,0,1|1,0,1]=4 322 B16R1.434 C=CC(O)COc1cc(cc(c1)OC)OC 34a_100000181322_100000730141 [0,0,1,0,0,1|0,0,2]=4 323 B16R1.434 C=CC(O)COc1cc(cc(c1)OC)OC 7a_100000181322_100000730141 [0,0,1,0,0,1|0,0,2]=4 324 B16R1.434 CCC(=O)COc1cc(cc(c1)OC)OC 7a_100000181322_100000747405 [0,0,1,0,0,1|0,0,2]=4 325 B16R1.434 CNC(=O)COc1cc(cc(c1)OC)OC 34a_100000181322_100000183359 [0,0,1,0,0,1|1,0,1]=4 326 B16R1.434 CNC(=O)COc1cc(cc(c1)OC)OC 7a_100000181322_100000183359 [0,0,1,0,0,1|1,0,1]=4 327 B16R1.434 COC(=O)COc1cc(cc(c1)OC)OC 34a_100000181322_100000747449 [0,0,1,0,0,1|1,0,1]=4 328 B16R1.434 COC(=O)COc1cc(cc(c1)OC)OC 7a_100000181322_100000747449 [0,0,1,0,0,1|1,0,1]=4 329 B16R1.800 C=C(C)COc1cc(cc(c1Cl)OC)OC 34a_100010658696_100000748629 [0,0,1,0,0,1|2,0,0]=4 330 B16R1.800 C=C(C)COc1cc(cc(c1Cl)OC)OC 7a_100010658696_100000748629 [0,0,1,0,0,1|2,0,0]=4 331 B16R1.800 C=C(F)COc1cc(cc(c1Cl)OC)OC 34a_100010658696_100009893438 [0,0,1,0,0,1|2,0,0]=4 332 B16R1.800 C=C(F)COc1cc(cc(c1Cl)OC)OC 7a_100010658696_100000042424 [0,0,1,0,0,1|2,0,0]=4 333 B16R1.800 COc1cc(c(c(c1)OCC(=O)N)Cl)OC 34a_100010658696_100000187820 [0,0,1,0,0,1|2,0,0]=4 334 B16R1.800 COc1cc(c(c(c1)OCC(=O)N)Cl)OC 7a_100010658696_100000187820 [0,0,1,0,0,1|2,0,0]=4 335 B16R1.800 COc1cc(c(c(c1)OCC(=O)[O-])Cl)OC 34a_100010658696_100020667443 [0,0,1,0,0,1|2,0,0]=4 336 B16R1.1772 COc1ccc(c(c1)OC)C=NNC(=O)C 4a_100000189765_100000188320 [0,0,1,0,0,1|2,0,0]=4 337 B16R2.1461 COc1cc2ccc(=O)oc2cc1OC 7a_100000032626_200000210301 [0,0,0,0,1,1|0,0,0]=2 338 B16R2.1461 COc1cc2ccc(=O)oc2cc1O[13CH3] 7a_100000032626_200025704644 [0,0,0,0,1,1|0,0,0]=2 339 B13R1.81 C=CC(=O)Cc1cccc(c1)OC 1458a_100000185746_100000211672 [2,0,1,0,0,0|1,0,0]=4 340 B13R1.81 C=CC(=O)Nc1cccc(c1)OC 1626a_100000210024_100000185746 [2,0,1,0,0,0|1,0,0]=4 341 B13R1.81 C=CC(=O)Nc1cccc(c1)OC 22a_100000210024_100000185746 [2,0,1,0,0,0|1,0,0]=4 342 B13R1.81 C=CC(=O)Nc1cccc(c1)OC 34a_100011235909_200000210301 [2,0,1,0,0,0|1,0,0]=4 343 B13R1.81 C=CC(=O)Nc1cccc(c1)OC 7a_100011235909_200000210301 [2,0,1,0,0,0|1,0,0]=4 344 B13R1.81 C=CC(=O)Nc1cccc(c1)O[13CH3] 34a_100011235909_200025704644 [2,0,1,0,0,0|1,0,0]=4 345 B13R1.81 C=CC(=O)Nc1cccc(c1)O[13CH3] 7a_100011235909_200025704644 [2,0,1,0,0,0|1,0,0]=4 346 B13R1.124 C=CCOc1cc(cc(c1)OC)C 34a_100011216608_100015514636 [2,0,1,0,0,0|0,0,1]=4 347 B13R1.124 C=CCOc1cc(cc(c1)OC)C 7a_100011216608_100015514636 [2,0,1,0,0,0|0,0,1]=4 348 B13R1.2874 C=CC(=O)Cc1cc(cc(c1)C)C 1458a_100000185746_100000181317 [2,0,1,0,0,0|1,0,0]=4 349 B13R1.2874 C=CC(=O)Nc1cc(cc(c1)C)C 1626a_100000210930_100000185746 [2,0,1,0,0,0|1,0,0]=4 350 B13R1.2874 C=CC(=O)Nc1cc(cc(c1)C)C 22a_100000210930_100000185746 [2,0,1,0,0,0|1,0,0]=4 351 B13R1.2874 C=CC(=O)Nc1cc(cc(c1)O)C 1626a_100011995906_100000185746 [2,0,1,0,0,0|1,0,0]=4 352 B13R1.2874 C=CC(=O)Nc1cc(cc(c1)O)C 22a_100011995906_100000185746 [2,0,1,0,0,0|1,0,0]=4 353 B13R1.358 C=C=Cc1cc(cc(c1)OC)OC 271570a_100015277604_100000685218 [2,0,1,0,0,0|0,0,1]=4 354 B13R1.358 CC=Cc1cc(cc(c1)OC)OC 271570a_100016259895_100000685218 [2,0,1,0,0,0|0,0,1]=4 355 B13R1.3 CC(=O)/C=C/c1ccc(cc1)O[13CH3] 34a_100000189429_200025704644 [2,0,1,0,0,0|1,0,0]=4 356 B13R1.3 COc1ccc(cc1)/C=C/C(=O)C 34a_100000189429_200000210301 [2,0,1,0,0,0|1,0,0]=4 357 B13R1.3 COc1ccc(cc1)C=CC(=O)C 1458a_100000184205_200000210301 [2,0,1,0,0,0|1,0,0]=4 358 B13R1.3 COc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000184205_200025704644 [2,0,1,0,0,0|1,0,0]=4 359 B13R1.1249 C=C=Cc1ccc(cc1OC)OC 271570a_100015277604_100000750026 [2,0,1,0,0,0|0,0,1]=4 360 B13R1.1249 CC=Cc1ccc(cc1OC)OC 271570a_100016259895_100000750026 [2,0,1,0,0,0|0,0,1]=4 361 B13R1.90 COc1ccccc1C=CC(=O)C 1458a_100000182468_200000210301 [2,0,1,0,0,0|1,0,0]=4 362 B13R1.90 COc1ccccc1C=CC(=O)[13CH3] 1458a_100000182468_200025704644 [2,0,1,0,0,0|1,0,0]=4 363 B13R1.434 C=Cc1c(cc(cc1OC)OC)F 271570a_100011290941_200009812871 [2,0,1,0,0,0|1,0,0]=4 364 B13R1.434 COc1cc(c(c(c1)OC)C=O)O 271570a_203496583355_100000688085 [2,0,1,0,0,0|0,0,0]=3 365 B13R1.434 COc1cc(c(c(c1)SC)C=O)O 62a_200000210301_100010762613 [2,0,1,0,0,0|0,1,0]=4 366 B13R1.434 COc1cc(c(c(c1)S[13CH3])C=O)O 62a_200025704644_100010762613 [2,0,1,0,0,0|0,1,0]=4 367 B13R2.57 COc1ccc2ccccc2c1 34a_100000185828_200000210301 [3,0,0,0,0,0|1,0,0]=4 368 B13R2.57 COc1ccc2ccccc2c1 7a_100000185828_200000210301 [3,0,0,0,0,0|1,0,0]=4 369 B13R2.57 COc1ccc2cccnc2c1 34a_100011216045_200000210301 [3,0,0,0,0,0|1,0,0]=4 370 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 34a_100000185828_200025704644 [3,0,0,0,0,0|1,0,0]=4 371 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 7a_100000185828_200025704644 [3,0,0,0,0,0|1,0,0]=4 372 B13R2.57 [13CH3]Oc1ccc2cccnc2c1 34a_100011216045_200025704644 [3,0,0,0,0,0|1,0,0]=4 373 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010001680 [3,0,0,0,0,0|1,0,0]=4 374 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010089979 [3,0,0,0,0,0|1,0,0]=4 375 B13R2.1613 COc1cccc2c1cccc2 34a_100000210388_200000210301 [3,0,0,0,0,0|1,0,0]=4 376 B13R2.1613 COc1cccc2c1cccc2 7a_100000210388_200000210301 [3,0,0,0,0,0|1,0,0]=4 377 B13R2.1613 COc1cccc2c1cccn2 34a_100011197808_200000210301 [3,0,0,0,0,0|1,0,0]=4 378 B13R2.1613 [13CH3]Oc1cccc2c1cccc2 34a_100000210388_200025704644 [3,0,0,0,0,0|1,0,0]=4 379 B13R2.1613 [13CH3]Oc1cccc2c1cccc2 7a_100000210388_200025704644 [3,0,0,0,0,0|1,0,0]=4 380 B13R2.1613 [13CH3]Oc1cccc2c1cccn2 34a_100011197808_200025704644 [3,0,0,0,0,0|1,0,0]=4 381 B13R2.155 O=c1ccc2ccc(cc2o1)O 271570a_203496583355_100009993525 [3,0,0,0,0,0|0,0,0]=3 382 B13R2.5179 O=c1ccc2c(cccc2[nH]1)O 271570a_203496583355_100000726145 [3,0,0,0,0,0|1,0,0]=4 383 B15R1.421 C=C(Br)C(=O)Nc1cc(cc(c1)OC)C 11a_100012001870_100009813364 [1,1,1,0,0,0|1,0,0]=4 384 B15R1.421 C=C(Br)C(=O)Nc1cc(cc(c1)OC)C 1626a_100012001870_100009813364 [1,1,1,0,0,0|1,0,0]=4 385 B15R1.421 C=C(Br)C(=O)Nc1cc(cc(c1)OC)O 1626a_200000692186_100009813364 [1,1,1,0,0,0|1,0,0]=4 386 B15R1.421 C=C(C)C(=O)Nc1cc(cc(c1)OC)C 11a_100012001870_100000185857 [1,1,1,0,0,0|1,0,0]=4 387 B15R1.421 C=C(C)C(=O)Nc1cc(cc(c1)OC)C 1626a_100012001870_100000185857 [1,1,1,0,0,0|1,0,0]=4 388 B15R1.421 C=C(C)C(=O)Nc1cc(cc(c1)OC)C 22a_100012001870_100000185857 [1,1,1,0,0,0|1,0,0]=4 389 B15R1.421 C=C(C)C(=O)Nc1cc(cc(c1)OC)O 1626a_200000692186_100000185857 [1,1,1,0,0,0|1,0,0]=4 390 B15R1.421 C=C(C)C(=O)Nc1cc(cc(c1)OC)O 22a_200000692186_100000185857 [1,1,1,0,0,0|1,0,0]=4 391 B15R1.421 C=C(Cl)C(=O)Nc1cc(cc(c1)OC)C 11a_100012001870_100000039160 [1,1,1,0,0,0|1,0,0]=4 392 B15R1.421 C=C(Cl)C(=O)Nc1cc(cc(c1)OC)C 1626a_100012001870_100000039160 [1,1,1,0,0,0|1,0,0]=4 393 B15R1.421 C=C(Cl)C(=O)Nc1cc(cc(c1)OC)C 22a_100012001870_100000039160 [1,1,1,0,0,0|1,0,0]=4 394 B15R1.421 C=C(Cl)C(=O)Nc1cc(cc(c1)OC)O 1626a_200000692186_100000039160 [1,1,1,0,0,0|1,0,0]=4 395 B15R1.421 C=C(Cl)C(=O)Nc1cc(cc(c1)OC)O 22a_200000692186_100000039160 [1,1,1,0,0,0|1,0,0]=4 396 B15R1.421 C=C(F)C(=O)Nc1cc(cc(c1)OC)C 11a_100012001870_100000036797 [1,1,1,0,0,0|1,0,0]=4 397 B15R1.421 C=C(F)C(=O)Nc1cc(cc(c1)OC)C 1626a_100012001870_100000036797 [1,1,1,0,0,0|1,0,0]=4 398 B15R1.421 C=C(F)C(=O)Nc1cc(cc(c1)OC)C 22a_100012001870_100000036797 [1,1,1,0,0,0|1,0,0]=4 399 B15R1.421 C=C(F)C(=O)Nc1cc(cc(c1)OC)O 1626a_200000692186_100000036797 [1,1,1,0,0,0|1,0,0]=4 400 B15R1.421 C=C(F)C(=O)Nc1cc(cc(c1)OC)O 22a_200000692186_100000036797 [1,1,1,0,0,0|1,0,0]=4 401 B15R1.1258 C=CCC(=O)Nc1cc(cc(c1)OC)C 11a_100012001870_100000210193 [1,1,1,0,0,0|1,0,0]=4 402 B15R1.1258 C=CCC(=O)Nc1cc(cc(c1)OC)C 1626a_100012001870_100000210193 [1,1,1,0,0,0|1,0,0]=4 403 B15R1.1258 C=CCC(=O)Nc1cc(cc(c1)OC)C 22a_100012001870_100000210193 [1,1,1,0,0,0|1,0,0]=4 404 B15R1.1258 C=CCC(=O)Nc1cc(cc(c1)OC)C 527a_100012001870_100000210193 [1,1,1,0,0,0|1,0,0]=4 405 B15R1.1258 C=CCC(=O)Nc1cc(cc(c1)OC)O 1626a_200000692186_100000210193 [1,1,1,0,0,0|1,0,0]=4 406 B15R1.1258 C=CCC(=O)Nc1cc(cc(c1)OC)O 22a_200000692186_100000210193 [1,1,1,0,0,0|1,0,0]=4 407 B15R1.1258 C=CCC(=O)Nc1cc(cc(c1)OC)O 527a_200000692186_100000210193 [1,1,1,0,0,0|1,0,0]=4 408 B15R1.1258 CC=CC(=O)Nc1cc(cc(c1)OC)C 11a_100012001870_100000210699 [1,1,1,0,0,0|1,0,0]=4 409 B15R1.1258 CC=CC(=O)Nc1cc(cc(c1)OC)C 1626a_100012001870_100000210699 [1,1,1,0,0,0|1,0,0]=4 410 B15R1.1258 CC=CC(=O)Nc1cc(cc(c1)OC)C 22a_100012001870_100000210699 [1,1,1,0,0,0|1,0,0]=4 411 B15R1.1258 CC=CC(=O)Nc1cc(cc(c1)OC)O 1626a_200000692186_100000210699 [1,1,1,0,0,0|1,0,0]=4 412 B15R1.1258 CC=CC(=O)Nc1cc(cc(c1)OC)O 22a_200000692186_100000210699 [1,1,1,0,0,0|1,0,0]=4 413 B15R1.1258 COc1cc(cc(c1)NC(=O)C=CBr)C 1626a_100012001870_100016273825 [1,1,1,0,0,0|1,0,0]=4 414 B15R1.1258 COc1cc(cc(c1)NC(=O)C=CBr)O 1626a_200000692186_100016273825 [1,1,1,0,0,0|1,0,0]=4 415 B15R1.1258 COc1cc(cc(c1)NC(=O)C=CCl)C 11a_100012001870_200016279998 [1,1,1,0,0,0|1,0,0]=4 416 B15R1.1258 COc1cc(cc(c1)NC(=O)C=CCl)C 1626a_100012001870_200016279998 [1,1,1,0,0,0|1,0,0]=4 417 B15R1.1258 COc1cc(cc(c1)NC(=O)C=CCl)O 1626a_200000692186_200016279998 [1,1,1,0,0,0|1,0,0]=4 418 B15R1.1258 COc1cc(cc(c1)NC(=O)C=CI)C 1626a_100012001870_100016256311 [1,1,1,0,0,0|1,0,0]=4 419 B15R1.1258 COc1cc(cc(c1)NC(=O)C=CI)O 1626a_200000692186_100016256311 [1,1,1,0,0,0|1,0,0]=4 420 B15R1.397 C=C(C)COc1cc(cc(c1)OC)OC 34a_100000181322_100000748629 [1,1,1,0,0,0|0,0,1]=4 421 B15R1.397 C=C(C)COc1cc(cc(c1)OC)OC 7a_100000181322_100000748629 [1,1,1,0,0,0|0,0,1]=4 422 B15R1.397 C=C(F)COc1cc(cc(c1)OC)OC 34a_100000181322_100009893438 [1,1,1,0,0,0|0,0,1]=4 423 B15R1.397 C=C(F)COc1cc(cc(c1)OC)OC 7a_100000181322_100000042424 [1,1,1,0,0,0|0,0,1]=4 424 B15R1.1162 C/C=C/COc1cc(cc(c1)OC)OC 34a_100000181322_100102629194 [1,1,1,0,0,0|0,0,1]=4 425 B15R1.1162 C/C=C/COc1cc(cc(c1)OC)OC 7a_100000181322_100102629194 [1,1,1,0,0,0|0,0,1]=4 426 B15R1.1162 C=CCCOc1cc(cc(c1)OC)OC 34a_100000181322_100000754431 [1,1,1,0,0,0|0,0,1]=4 427 B15R1.1162 C=CCCOc1cc(cc(c1)OC)OC 7a_100000181322_100000754431 [1,1,1,0,0,0|0,0,1]=4 428 B15R1.1162 C=CCOCc1cc(cc(c1)OC)OC 34a_100000700211_100015514636 [1,1,1,0,0,0|0,0,1]=4 429 B15R1.1162 C=CCOCc1cc(cc(c1)OC)OC 34a_200000210373_100011215721 [1,1,1,0,0,0|0,0,1]=4 430 B15R1.1162 C=CCOCc1cc(cc(c1)OC)OC 7a_100000700211_100015514636 [1,1,1,0,0,0|0,0,1]=4 431 B15R1.1162 CC=CCOc1cc(cc(c1)OC)OC 34a_100000181322_100000070051 [1,1,1,0,0,0|0,0,1]=4 432 B15R1.1162 CC=CCOc1cc(cc(c1)OC)OC 7a_100000181322_100000070051 [1,1,1,0,0,0|0,0,1]=4 433 B15R1.5430 C=CCOc1cc(cc(c1Cl)OC)OC 34a_100010658696_100015514636 [1,1,1,0,0,0|0,0,1]=4 434 B15R1.5430 C=CCOc1cc(cc(c1Cl)OC)OC 7a_100010658696_100015514636 [1,1,1,0,0,0|0,0,1]=4 435 B15R1.1856 CNC(=O)C=Cc1ccc(cc1C)OC 11a_106832991635_100102882216 [1,1,1,0,0,0|1,0,0]=4 436 B15R1.1856 CNC(=O)C=Cc1ccc(cc1C)OC 1626a_100102657272_100102882216 [1,1,1,0,0,0|1,0,0]=4 437 B15R1.2078 COCC=Cc1ccc(cc1OC)OC 271570a_100016286323_100000750026 [1,1,1,0,0,0|0,0,1]=4 438 B15R1.10175 C=C(C)c1c(cc(cc1OC)OC)OC 271570a_100000694244_100000186544 [1,1,1,0,0,0|0,0,1]=4 439 B15R1.26780 C=C=Cc1c(cc(cc1OC)OC)OC 271570a_100015277604_100000186544 [1,1,1,0,0,0|0,0,1]=4 440 B15R1.26780 CC=Cc1c(cc(cc1OC)OC)OC 271570a_100016259895_100000186544 [1,1,1,0,0,0|0,0,1]=4 441 B15R2.1282 CC=Cc1ccc2ccc(=O)oc2c1 271570a_100016259895_100009993525 [2,1,0,0,0,0|1,0,0]=4 442 B15R2.1282 CCOc1ccc2ccc(=O)oc2c1 34a_100000185914_100000210202 [2,1,0,0,0,0|0,0,0]=3 443 B15R2.1282 CCOc1ccc2ccc(=O)oc2c1 7a_100000185914_100000210202 [2,1,0,0,0,0|0,0,0]=3 444 B15R2.1282 CCSc1ccc2ccc(=O)oc2c1 62a_100000210202_100009993525 [2,1,0,0,0,0|0,1,0]=4 445 B15R2.1282 O=c1ccc2ccc(cc2o1)OCF 34a_100000185914_100015361967 [2,1,0,0,0,0|0,0,0]=3 446 B15R2.1282 O=c1ccc2ccc(cc2o1)OCF 7a_100000185914_100015361967 [2,1,0,0,0,0|0,0,0]=3 447 B15R2.1282 O=c1ccc2ccc(cc2o1)SCF 62a_100015361967_100009993525 [2,1,0,0,0,0|0,1,0]=4 448 B15R2.7174 C=C(C)c1ccc2ccc(=O)oc2c1 271570a_100000694244_100009993525 [2,1,0,0,0,0|1,0,0]=4 449 B15R2.89396 CNc1ccc2c(cc(=O)oc2c1)C 7a_100000010859_200000210301 [2,1,0,0,0,0|1,0,0]=4 450 B15R2.89396 COc1ccc2c(cc(=O)oc2c1)C 34a_100000181958_200000210301 [2,1,0,0,0,0|0,0,0]=3 451 B15R2.89396 COc1ccc2c(cc(=O)oc2c1)C 7a_100000181958_200000210301 [2,1,0,0,0,0|0,0,0]=3 452 B15R2.89396 CSc1ccc2c(cc(=O)oc2c1)O 62a_200000210301_100010062223 [2,1,0,0,0,0|0,1,0]=4 453 B15R2.89396 Cc1cc(=O)oc2c1ccc(c2)N[13CH3] 7a_100000010859_200025704644 [2,1,0,0,0,0|1,0,0]=4 454 B15R2.89396 Cc1cc(=O)oc2c1ccc(c2)O[13CH3] 34a_100000181958_200025704644 [2,1,0,0,0,0|0,0,0]=3 455 B15R2.89396 Cc1cc(=O)oc2c1ccc(c2)O[13CH3] 7a_100000181958_200025704644 [2,1,0,0,0,0|0,0,0]=3 456 B15R2.89396 [13CH3]Sc1ccc2c(cc(=O)oc2c1)O 62a_200025704644_100010062223 [2,1,0,0,0,0|0,1,0]=4 457 B17R1.4840 C=CCC(=O)CCc1cc(cc(c1)OC)OC 1458a_100000212342_100000210623 [0,1,1,0,0,1|1,0,0]=4 458 B17R1.4840 C=CCC(=O)NCc1cc(cc(c1)OC)OC 11a_100000737887_100000210193 [0,1,1,0,0,1|1,0,0]=4 459 B17R1.4840 C=CCC(=O)NCc1cc(cc(c1)OC)OC 1626a_100000737887_100000210193 [0,1,1,0,0,1|1,0,0]=4 460 B17R1.4840 C=CCC(=O)NCc1cc(cc(c1)OC)OC 240690a_100000737887_100000210193 [0,1,1,0,0,1|1,0,0]=4 461 B17R1.4840 C=CCC(=O)NCc1cc(cc(c1)OC)OC 527a_100000737887_100000210193 [0,1,1,0,0,1|1,0,0]=4 462 B17R1.4840 C=COC(=O)CNc1cc(cc(c1)OC)OC 2230a_100000210928_100000036128 [0,1,1,0,0,1|1,0,0]=4 463 B17R1.4840 C=COC(=O)CNc1cc(cc(c1)OC)OC 34a_100000210928_100000036128 [0,1,1,0,0,1|1,0,0]=4 464 B17R1.4840 C=COC(=O)COc1cc(cc(c1)OC)OC 34a_100000181322_100000036128 [0,1,1,0,0,1|0,0,0]=3 465 B17R1.4840 C=COC(=O)CSc1cc(cc(c1)OC)OC 62a_100000036128_100000685218 [0,1,1,0,0,1|0,1,0]=4 466 B17R1.4840 CC=CC(=O)NCc1cc(cc(c1)OC)OC 11a_100000737887_100000210699 [0,1,1,0,0,1|1,0,0]=4 467 B17R1.4840 CC=CC(=O)NCc1cc(cc(c1)OC)OC 1626a_100000737887_100000210699 [0,1,1,0,0,1|1,0,0]=4 468 B17R1.4840 CC=CC(=O)NCc1cc(cc(c1)OC)OC 240690a_100000737887_100000210699 [0,1,1,0,0,1|1,0,0]=4 469 B17R1.4840 COc1cc(cc(c1)OC)CNC(=O)C=CBr 1626a_100000737887_100016273825 [0,1,1,0,0,1|1,0,0]=4 470 B17R1.4840 COc1cc(cc(c1)OC)CNC(=O)C=CBr 240690a_100000737887_100016273825 [0,1,1,0,0,1|1,0,0]=4 471 B17R1.4840 COc1cc(cc(c1)OC)CNC(=O)C=CCl 11a_100000737887_200016279998 [0,1,1,0,0,1|1,0,0]=4 472 B17R1.4840 COc1cc(cc(c1)OC)CNC(=O)C=CCl 1626a_100000737887_200016279998 [0,1,1,0,0,1|1,0,0]=4 473 B17R1.4840 COc1cc(cc(c1)OC)CNC(=O)C=CCl 240690a_100000737887_200016279998 [0,1,1,0,0,1|1,0,0]=4 474 B17R1.4840 COc1cc(cc(c1)OC)CNC(=O)C=CI 1626a_100000737887_100016256311 [0,1,1,0,0,1|1,0,0]=4 475 B17R1.5518 C=CC(=O)NC(C)c1cc(cc(c1)OC)OC 1626a_100159265467_100000185746 [0,1,1,0,0,1|1,0,0]=4 476 B17R1.5518 C=CC(=O)NC(C)c1cc(cc(c1)OC)OC 240690a_100159265467_200121576911 [0,1,1,0,0,1|1,0,0]=4 477 B17R1.5519 C=CC(=O)N(C)Cc1cc(cc(c1)OC)OC 1626a_100000207622_100000185746 [0,1,1,0,0,1|1,0,0]=4 478 B17R1.5519 C=CC(=O)N(C)Cc1cc(cc(c1)OC)OC 240690a_100000207622_200121576911 [0,1,1,0,0,1|1,0,0]=4 479 B17R1.14983 C=C(Br)C(=O)NCc1cc(cc(c1)OC)OC 11a_100000737887_100009813364 [0,1,1,0,0,1|1,0,0]=4 480 B17R1.14983 C=C(Br)C(=O)NCc1cc(cc(c1)OC)OC 1626a_100000737887_100009813364 [0,1,1,0,0,1|1,0,0]=4 481 B17R1.14983 C=C(C)C(=O)NCc1cc(cc(c1)OC)OC 11a_100000737887_100000185857 [0,1,1,0,0,1|1,0,0]=4 482 B17R1.14983 C=C(C)C(=O)NCc1cc(cc(c1)OC)OC 1626a_100000737887_100000185857 [0,1,1,0,0,1|1,0,0]=4 483 B17R1.14983 C=C(Cl)C(=O)NCc1cc(cc(c1)OC)OC 11a_100000737887_100000039160 [0,1,1,0,0,1|1,0,0]=4 484 B17R1.14983 C=C(Cl)C(=O)NCc1cc(cc(c1)OC)OC 1626a_100000737887_100000039160 [0,1,1,0,0,1|1,0,0]=4 485 B17R1.14983 C=C(F)C(=O)NCc1cc(cc(c1)OC)OC 11a_100000737887_100000036797 [0,1,1,0,0,1|1,0,0]=4 486 B17R1.14983 C=C(F)C(=O)NCc1cc(cc(c1)OC)OC 1626a_100000737887_100000036797 [0,1,1,0,0,1|1,0,0]=4 487 B17R1.14983 COc1cc(cc(c1)OCC(=O)C(=O)C)OC 34a_100000181322_100011261029 [0,1,1,0,0,1|0,0,1]=4 488 B17R1.4896 C/C=C/CC(=O)Cc1cc(cc(c1)OC)OC 1458a_100011214962_100102629194 [0,2,1,0,0,0|1,0,0]=4 489 B17R1.4896 C=CC=CC(=O)Cc1cc(cc(c1)OC)OC 1458a_100016291481_100011215721 [0,2,1,0,0,0|1,0,0]=4 490 B17R1.4896 C=CC=CC(=O)Nc1cc(cc(c1)OC)OC 1626a_100000210928_100016291481 [0,2,1,0,0,0|1,0,0]=4 491 B17R1.4896 C=CC=CC(=O)Nc1cc(cc(c1)OC)OC 22a_100000210928_100016291481 [0,2,1,0,0,0|1,0,0]=4 492 B17R1.4896 C=CCCC(=O)Cc1cc(cc(c1)OC)OC 1458a_100000749702_100011215721 [0,2,1,0,0,0|1,0,0]=4 493 B17R1.4896 C=CCCC(=O)Cc1cc(cc(c1)OC)OC 1458a_100011214962_100000754431 [0,2,1,0,0,0|1,0,0]=4 494 B17R1.4896 C=CCCC(=O)Nc1cc(cc(c1)OC)OC 11a_100000210928_100000749702 [0,2,1,0,0,0|1,0,0]=4 495 B17R1.4896 C=CCCC(=O)Nc1cc(cc(c1)OC)OC 1626a_100000210928_100000749702 [0,2,1,0,0,0|1,0,0]=4 496 B17R1.4896 C=CCCC(=O)Nc1cc(cc(c1)OC)OC 22a_100000210928_100000749702 [0,2,1,0,0,0|1,0,0]=4 497 B17R1.4896 C=CCCC(=O)Nc1cc(cc(c1)OC)OC 527a_100000210928_100000749702 [0,2,1,0,0,0|1,0,0]=4 498 B17R1.4896 C=CCNC(=O)Cc1cc(cc(c1)OC)OC 240690a_100020586998_100011214962 [0,2,1,0,0,0|1,0,0]=4 499 B17R1.4896 C=CCNC(=O)Cc1cc(cc(c1)OC)OC 527a_100020586998_100011214962 [0,2,1,0,0,0|1,0,0]=4 500 B17R1.4896 C=CCNC(=O)Nc1cc(cc(c1)OC)OC 2430a_100000210928_100020586998 [0,2,1,0,0,0|1,0,0]=4 501 B17R1.4896 C=CCNC(=O)Nc1cc(cc(c1)OC)OC 512a_100000210928_100020586998 [0,2,1,0,0,0|1,0,0]=4 502 B17R1.4896 CC=CCC(=O)Cc1cc(cc(c1)OC)OC 1458a_100011214962_100000070051 [0,2,1,0,0,0|1,0,0]=4 503 B17R1.4896 CC=CCC(=O)Cc1cc(cc(c1)OC)OC 1458a_100121576822_100011215721 [0,2,1,0,0,0|1,0,0]=4 504 B17R1.4896 CC=CCC(=O)Nc1cc(cc(c1)OC)OC 11a_100000210928_100121576822 [0,2,1,0,0,0|1,0,0]=4 505 B17R1.4896 CC=CCC(=O)Nc1cc(cc(c1)OC)OC 1626a_100000210928_100121576822 [0,2,1,0,0,0|1,0,0]=4 506 B17R1.4896 CC=CCC(=O)Nc1cc(cc(c1)OC)OC 22a_100000210928_100121576822 [0,2,1,0,0,0|1,0,0]=4 507 B17R1.4896 CC=CCC(=O)Nc1cc(cc(c1)OC)OC 527a_100000210928_100121576822 [0,2,1,0,0,0|1,0,0]=4 508 B17R1.4896 CCC=CC(=O)Cc1cc(cc(c1)OC)OC 1458a_100000212282_100011215721 [0,2,1,0,0,0|1,0,0]=4 509 B17R1.4896 CCC=CC(=O)Nc1cc(cc(c1)OC)OC 11a_100000210928_100000212282 [0,2,1,0,0,0|1,0,0]=4 510 B17R1.4896 CCC=CC(=O)Nc1cc(cc(c1)OC)OC 1626a_100000210928_100000212282 [0,2,1,0,0,0|1,0,0]=4 511 B17R1.4896 CCC=CC(=O)Nc1cc(cc(c1)OC)OC 22a_100000210928_100000212282 [0,2,1,0,0,0|1,0,0]=4 512 B17R1.4896 COC=CC(=O)Cc1cc(cc(c1)OC)OC 1458a_100016268678_100011215721 [0,2,1,0,0,0|1,0,0]=4 513 B17R1.4896 COC=CC(=O)Nc1cc(cc(c1)OC)OC 1626a_100000210928_100016268678 [0,2,1,0,0,0|1,0,0]=4 514 B17R1.4896 COC=CC(=O)Nc1cc(cc(c1)OC)OC 22a_100000210928_100016268678 [0,2,1,0,0,0|1,0,0]=4 515 B17R1.15153 C=C(C)CC(=O)Cc1cc(cc(c1)OC)OC 1458a_100011214962_100000748629 [0,2,1,0,0,0|1,0,0]=4 516 B17R1.15153 C=C(F)CC(=O)Cc1cc(cc(c1)OC)OC 1458a_100011214962_100009893438 [0,2,1,0,0,0|1,0,0]=4 517 B17R1.15153 COc1cc(cc(c1)OC)CC(=O)C=C(C)C 1458a_100000211388_100011215721 [0,2,1,0,0,0|1,0,0]=4 518 B17R1.15153 COc1cc(cc(c1)OC)CC(=O)C=C(C)Cl 1458a_200042562850_100011215721 [0,2,1,0,0,0|1,0,0]=4 519 B17R1.15153 COc1cc(cc(c1)OC)CC(=O)C=C(C)I 1458a_100025716642_100011215721 [0,2,1,0,0,0|1,0,0]=4 520 B17R1.15153 COc1cc(cc(c1)OC)CC(=O)C=C(Cl)Cl 1458a_100000137448_100011215721 [0,2,1,0,0,0|1,0,0]=4 521 B17R1.15153 COc1cc(cc(c1)OC)NC(=O)C=C(C)C 11a_100000210928_100000211388 [0,2,1,0,0,0|1,0,0]=4 522 B17R1.15153 COc1cc(cc(c1)OC)NC(=O)C=C(C)C 1626a_100000210928_100000211388 [0,2,1,0,0,0|1,0,0]=4 523 B17R1.15153 COc1cc(cc(c1)OC)NC(=O)C=C(C)C 22a_100000210928_100000211388 [0,2,1,0,0,0|1,0,0]=4 524 B17R1.15153 COc1cc(cc(c1)OC)NC(=O)C=C(C)Cl 11a_100000210928_200042562850 [0,2,1,0,0,0|1,0,0]=4 525 B17R1.15153 COc1cc(cc(c1)OC)NC(=O)C=C(C)Cl 1626a_100000210928_200042562850 [0,2,1,0,0,0|1,0,0]=4 526 B17R1.15153 COc1cc(cc(c1)OC)NC(=O)C=C(C)Cl 22a_100000210928_200042562850 [0,2,1,0,0,0|1,0,0]=4 527 B17R1.15153 COc1cc(cc(c1)OC)NC(=O)C=C(C)I 11a_100000210928_100025716642 [0,2,1,0,0,0|1,0,0]=4 528 B17R1.15153 COc1cc(cc(c1)OC)NC(=O)C=C(C)I 1626a_100000210928_100025716642 [0,2,1,0,0,0|1,0,0]=4 529 B17R1.15153 COc1cc(cc(c1)OC)NC(=O)C=C(Cl)Cl 1626a_100000210928_100000137448 [0,2,1,0,0,0|1,0,0]=4 530 B17R1.21173 C=CCC(=O)Cc1cc(c(c(c1)OC)O)OC 1458a_100000043605_100000210623 [0,2,1,0,0,0|1,0,0]=4 531 B17R1.21173 C=CCC(=O)Nc1cc(c(c(c1)OC)Cl)OC 11a_100009986809_100000210193 [0,2,1,0,0,0|1,0,0]=4 532 B17R1.21173 C=CCC(=O)Nc1cc(c(c(c1)OC)Cl)OC 1626a_100009986809_100000210193 [0,2,1,0,0,0|1,0,0]=4 533 B17R1.21173 C=CCC(=O)Nc1cc(c(c(c1)OC)Cl)OC 22a_100009986809_100000210193 [0,2,1,0,0,0|1,0,0]=4 534 B17R1.21173 C=CCC(=O)Nc1cc(c(c(c1)OC)Cl)OC 527a_100009986809_100000210193 [0,2,1,0,0,0|1,0,0]=4 535 B17R1.21173 CC=CC(=O)Nc1cc(c(c(c1)OC)Cl)OC 11a_100009986809_100000210699 [0,2,1,0,0,0|1,0,0]=4 536 B17R1.21173 CC=CC(=O)Nc1cc(c(c(c1)OC)Cl)OC 1626a_100009986809_100000210699 [0,2,1,0,0,0|1,0,0]=4 537 B17R1.21173 CC=CC(=O)Nc1cc(c(c(c1)OC)Cl)OC 22a_100009986809_100000210699 [0,2,1,0,0,0|1,0,0]=4 538 B17R1.21173 COc1cc(cc(c1Cl)OC)NC(=O)C=CBr 1626a_100009986809_100016273825 [0,2,1,0,0,0|1,0,0]=4 539 B17R1.21173 COc1cc(cc(c1Cl)OC)NC(=O)C=CCl 11a_100009986809_200016279998 [0,2,1,0,0,0|1,0,0]=4 540 B17R1.21173 COc1cc(cc(c1Cl)OC)NC(=O)C=CCl 1626a_100009986809_200016279998 [0,2,1,0,0,0|1,0,0]=4 541 B17R1.21173 COc1cc(cc(c1Cl)OC)NC(=O)C=CI 1626a_100009986809_100016256311 [0,2,1,0,0,0|1,0,0]=4 542 B17R1.438241 C=CCC(=O)Nc1cc(cc(c1Cl)OC)OC 11a_100009955059_100000210193 [0,2,1,0,0,0|1,0,0]=4 543 B17R1.438241 C=CCC(=O)Nc1cc(cc(c1Cl)OC)OC 1626a_100009955059_100000210193 [0,2,1,0,0,0|1,0,0]=4 544 B17R1.438241 C=CCC(=O)Nc1cc(cc(c1Cl)OC)OC 22a_100009955059_100000210193 [0,2,1,0,0,0|1,0,0]=4 545 B17R1.438241 C=CCC(=O)Nc1cc(cc(c1Cl)OC)OC 527a_100009955059_100000210193 [0,2,1,0,0,0|1,0,0]=4 546 B17R1.438241 CC=CC(=O)Nc1cc(cc(c1Cl)OC)OC 11a_100009955059_100000210699 [0,2,1,0,0,0|1,0,0]=4 547 B17R1.438241 CC=CC(=O)Nc1cc(cc(c1Cl)OC)OC 1626a_100009955059_100000210699 [0,2,1,0,0,0|1,0,0]=4 548 B17R1.438241 CC=CC(=O)Nc1cc(cc(c1Cl)OC)OC 22a_100009955059_100000210699 [0,2,1,0,0,0|1,0,0]=4 549 B17R1.438241 COc1cc(c(c(c1)OC)Cl)NC(=O)C=CBr 1626a_100009955059_100016273825 [0,2,1,0,0,0|1,0,0]=4 550 B17R1.438241 COc1cc(c(c(c1)OC)Cl)NC(=O)C=CCl 11a_100009955059_200016279998 [0,2,1,0,0,0|1,0,0]=4 551 B17R1.438241 COc1cc(c(c(c1)OC)Cl)NC(=O)C=CCl 1626a_100009955059_200016279998 [0,2,1,0,0,0|1,0,0]=4 552 B17R1.438241 COc1cc(c(c(c1)OC)Cl)NC(=O)C=CI 1626a_100009955059_100016256311 [0,2,1,0,0,0|1,0,0]=4 553 B17R1.14681 C=C(Br)C(=O)Nc1cc(c(c(c1)OC)Cl)OC 11a_100009986809_100009813364 [0,2,1,0,0,0|1,0,0]=4 554 B17R1.14681 C=C(Br)C(=O)Nc1cc(c(c(c1)OC)Cl)OC 1626a_100009986809_100009813364 [0,2,1,0,0,0|1,0,0]=4 555 B17R1.14681 C=C(C)C(=O)Nc1cc(c(c(c1)OC)Cl)OC 11a_100009986809_100000185857 [0,2,1,0,0,0|1,0,0]=4 556 B17R1.14681 C=C(C)C(=O)Nc1cc(c(c(c1)OC)Cl)OC 1626a_100009986809_100000185857 [0,2,1,0,0,0|1,0,0]=4 557 B17R1.14681 C=C(C)C(=O)Nc1cc(c(c(c1)OC)Cl)OC 22a_100009986809_100000185857 [0,2,1,0,0,0|1,0,0]=4 558 B17R1.14681 C=C(Cl)C(=O)Nc1cc(c(c(c1)OC)Cl)OC 11a_100009986809_100000039160 [0,2,1,0,0,0|1,0,0]=4 559 B17R1.14681 C=C(Cl)C(=O)Nc1cc(c(c(c1)OC)Cl)OC 1626a_100009986809_100000039160 [0,2,1,0,0,0|1,0,0]=4 560 B17R1.14681 C=C(Cl)C(=O)Nc1cc(c(c(c1)OC)Cl)OC 22a_100009986809_100000039160 [0,2,1,0,0,0|1,0,0]=4 561 B17R1.14681 C=C(F)C(=O)Nc1cc(c(c(c1)OC)Cl)OC 11a_100009986809_100000036797 [0,2,1,0,0,0|1,0,0]=4 562 B17R1.14681 C=C(F)C(=O)Nc1cc(c(c(c1)OC)Cl)OC 1626a_100009986809_100000036797 [0,2,1,0,0,0|1,0,0]=4 563 B17R1.14681 C=C(F)C(=O)Nc1cc(c(c(c1)OC)Cl)OC 22a_100009986809_100000036797 [0,2,1,0,0,0|1,0,0]=4 564 B17R1.14848 C=CC(=O)Nc1cc(c(c(c1)OC)OC)OC 1626a_100000209829_100000185746 [0,2,1,0,0,0|1,0,0]=4 565 B17R1.14848 C=CC(=O)Nc1cc(c(c(c1)OC)OC)OC 22a_100000209829_100000185746 [0,2,1,0,0,0|1,0,0]=4 566 B17R1.20239 C=CC(=O)Nc1c(c(cc(c1Cl)OC)OC)Cl 1626a_100010296497_100000185746 [0,2,1,0,0,0|1,0,0]=4 567 B17R1.20239 C=CC(=O)Nc1c(c(cc(c1F)OC)OC)F 1626a_100009883675_100000185746 [0,2,1,0,0,0|1,0,0]=4 568 B17R1.18186 CCOc1ccc(c(c1)OCC)C=CC(=O)C 1458a_100020603539_200000210301 [0,2,1,0,0,0|1,0,0]=4 569 B17R1.18186 CCOc1ccc(c(c1)OCC)C=CC(=O)[13CH3] 1458a_100020603539_200025704644 [0,2,1,0,0,0|1,0,0]=4 570 B17R1.28762 CCC(=O)C=Cc1cc(c(cc1OC)OC)Br 1458a_200009812227_100000210202 [0,2,1,0,0,0|1,0,0]=4 571 B17R1.28762 CCC(=O)C=Cc1cc(c(cc1OC)OC)Cl 6a_100000069025_100000211110 [0,2,1,0,0,0|1,0,0]=4 572 B17R1.28762 CCC(=O)C=Cc1cc(c(cc1OC)OC)I 6a_200010205283_100000211110 [0,2,1,0,0,0|1,0,0]=4 573 B17R1.28762 CNC(=O)C=Cc1cc(c(cc1OC)OC)Br 11a_106832991635_200009812227 [0,2,1,0,0,0|1,0,0]=4 574 B17R1.28762 CNC(=O)C=Cc1cc(c(cc1OC)OC)Br 1626a_100102657272_200009812227 [0,2,1,0,0,0|1,0,0]=4 575 B17R1.28762 CNC(=O)C=Cc1cc(c(cc1OC)OC)Br 240690a_100102657272_200009812227 [0,2,1,0,0,0|1,0,0]=4 576 B17R1.28762 COc1cc(c(cc1Br)C=CC(=O)CF)OC 1458a_200009812227_100015361967 [0,2,1,0,0,0|1,0,0]=4 577 B17R1.28762 COc1cc(c(cc1Cl)C=CC(=O)CBr)OC 6a_100000069025_100009888967 [0,2,1,0,0,0|1,0,0]=4 578 B17R1.28762 COc1cc(c(cc1Cl)C=CC(=O)CCl)OC 6a_100000069025_100000086384 [0,2,1,0,0,0|1,0,0]=4 579 B17R1.28762 COc1cc(c(cc1Cl)C=CC(=O)CF)OC 6a_100000069025_100000764096 [0,2,1,0,0,0|1,0,0]=4 580 B17R1.28762 COc1cc(c(cc1I)C=CC(=O)CBr)OC 6a_200010205283_100009888967 [0,2,1,0,0,0|1,0,0]=4 581 B17R1.28762 COc1cc(c(cc1I)C=CC(=O)CCl)OC 6a_200010205283_100000086384 [0,2,1,0,0,0|1,0,0]=4 582 B17R1.28762 COc1cc(c(cc1I)C=CC(=O)CF)OC 6a_200010205283_100000764096 [0,2,1,0,0,0|1,0,0]=4 583 B17R1.164004 COc1cc(c(cc1C=CC(=O)C)OC)OC 1458a_100000261302_200000210301 [0,2,1,0,0,0|1,0,0]=4 584 B17R1.164004 COc1cc(c(cc1C=CC(=O)[13CH3])OC)OC 1458a_100000261302_200025704644 [0,2,1,0,0,0|1,0,0]=4 585 B17R1.48219 COc1ccc(c(c1OC)OC)C=CC(=O)C 1458a_100000262426_200000210301 [0,2,1,0,0,0|1,0,0]=4 586 B17R1.48219 COc1ccc(c(c1OC)OC)C=CC(=O)[13CH3] 1458a_100000262426_200025704644 [0,2,1,0,0,0|1,0,0]=4 587 B17R1.6729 CCC(=O)C=C(C)c1ccc(cc1OC)OC 1458a_100016998046_100000210202 [0,2,1,0,0,0|1,0,0]=4 588 B17R1.6729 CNC(=O)C=C(C)c1ccc(cc1OC)OC 11a_106832991635_100016998046 [0,2,1,0,0,0|1,0,0]=4 589 B17R1.6729 CNC(=O)C=C(C)c1ccc(cc1OC)OC 1626a_100102657272_100016998046 [0,2,1,0,0,0|1,0,0]=4 590 B17R1.6729 CNC(=O)C=C(C)c1ccc(cc1OC)OC 240690a_100102657272_100016998046 [0,2,1,0,0,0|1,0,0]=4 591 B17R1.6729 COC(=O)CC(=O)c1ccc(cc1OC)OC 1458a_100000210807_100000747449 [0,2,1,0,0,0|0,0,1]=4 592 B17R1.6729 COc1ccc(c(c1)OC)C(=CC(=O)CF)C 1458a_100016998046_100015361967 [0,2,1,0,0,0|1,0,0]=4 593 B17R1.6729 COc1ccc(c(c1)OC)C(=O)CC(=O)CO 1458a_100000210174_200000212151 [0,2,1,0,0,0|0,0,1]=4 594 B17R1.28975 COC(=O)C(=O)Nc1ccc(cc1OC)OC 11a_100000211191_100000024059 [0,2,1,0,0,0|1,0,0]=4 595 B17R1.28975 COC(=O)C(=O)Nc1ccc(cc1OC)OC 1626a_100000211191_100000024059 [0,2,1,0,0,0|1,0,0]=4 596 B17R1.28975 COC(=O)C(=O)Nc1ccc(cc1OC)OC 527a_100000211191_100000024059 [0,2,1,0,0,0|1,0,0]=4 597 B17R1.21444 C#CCC(=O)C=Cc1ccc(cc1OC)OC 1458a_100000211080_100000184674 [0,2,1,0,0,0|1,0,0]=4 598 B17R1.21444 C=CCC(=O)C=Cc1ccc(cc1OC)OC 1458a_100000211080_100000210623 [0,2,1,0,0,0|1,0,0]=4 599 B17R1.21444 CCCC(=O)C=Cc1ccc(cc1OC)OC 1458a_100000211080_100000210303 [0,2,1,0,0,0|1,0,0]=4 600 B17R1.21444 CCNC(=O)C=Cc1ccc(cc1OC)OC 11a_100015525214_100000211080 [0,2,1,0,0,0|1,0,0]=4 601 B17R1.21444 CCOC(=O)C=Cc1ccc(cc1CC)OC 271570a_100010199719_100000720562 [0,2,1,0,0,0|1,0,0]=4 602 B17R1.21444 CCOC(=O)C=Cc1ccc(cc1OC)CC 271570a_100010199719_200010710389 [0,2,1,0,0,0|1,0,0]=4 603 B17R1.21444 CCOC(=O)C=Cc1ccc(cc1OC)OC 271570a_100010199719_100000750026 [0,2,1,0,0,0|0,0,0]=3 604 B17R1.21444 CCOC(=O)C=Cc1ccc(nc1OC)OC 271570a_100010199719_100009816055 [0,2,1,0,0,0|1,0,0]=4 605 B17R1.21444 CCOC(=O)C=Cc1cnc(cc1OC)OC 271570a_100010199719_100010191559 [0,2,1,0,0,0|1,0,0]=4 606 B17R1.21444 CNNC(=O)C=Cc1ccc(cc1OC)OC 22a_100016993582_100000211080 [0,2,1,0,0,0|1,0,0]=4 607 B17R1.21444 COc1ccc(c(c1)OC)C=CC(=O)CC#N 1458a_100000211080_100011214920 [0,2,1,0,0,0|1,0,0]=4 608 B17R1.21444 COc1ccc(c(c1)OC)C=CC(=O)CCF 1458a_100000211080_100011217306 [0,2,1,0,0,0|1,0,0]=4 609 B17R1.21444 COc1ccc(c(c1)OC)C=CC(=O)CCO 1458a_100000211080_100000211926 [0,2,1,0,0,0|0,0,0]=3 610 B17R1.8129 COc1cc(c(c(c1)OCC=O)C(=O)C)OC 34a_100000035976_200009817547 [0,2,1,0,0,0|0,0,1]=4 611 B17R1.8129 COc1cc(c(c(c1)OCC=O)C(=O)C)OC 7a_100000035976_200015260668 [0,2,1,0,0,0|0,0,1]=4 612 B17R2.392652 C=Cc1ccnc2c1c(cc(c2)OC)OC 271570a_100011290941_200000751283 [1,2,0,0,0,0|1,0,0]=4 613 B17R2.327 COCSc1cc(c2cccnc2c1)OC 62a_100000766300_100010248854 [1,2,0,0,0,0|1,0,0]=4 614 B17R2.1261 COc1cc(c2ccccc2c1)OC(C)C 34a_200000076035_100000210206 [1,2,0,0,0,0|1,0,0]=4 615 B17R2.1261 COc1cc(c2ccccc2c1)OC(C)C 7a_200000076035_100000210206 [1,2,0,0,0,0|1,0,0]=4 616 B17R2.153865 C#CCOc1cc(cc2c1cccc2)OC 34a_200000076035_100000184674 [1,2,0,0,0,0|1,0,0]=4 617 B17R2.153865 C#CCOc1cc(cc2c1cccc2)OC 7a_200000076035_100000038162 [1,2,0,0,0,0|1,0,0]=4 618 B17R2.153865 C=CCOc1cc(cc2c1cccc2)OC 34a_200000076035_100015514636 [1,2,0,0,0,0|1,0,0]=4 619 B17R2.153865 C=CCOc1cc(cc2c1cccc2)OC 7a_200000076035_100015514636 [1,2,0,0,0,0|1,0,0]=4 620 B17R2.153865 CCCOc1cc(cc2c1cccc2)OC 34a_200000076035_100000210303 [1,2,0,0,0,0|1,0,0]=4 621 B17R2.153865 CCCOc1cc(cc2c1cccc2)OC 7a_200000076035_100000210303 [1,2,0,0,0,0|1,0,0]=4 622 B17R2.153865 COCSc1cc(cc2c1cccc2)OC 62a_100000766300_100010152498 [1,2,0,0,0,0|1,0,0]=4 623 B17R2.153865 COCSc1cc(cc2c1cccn2)OC 62a_100000766300_100010248855 [1,2,0,0,0,0|1,0,0]=4 624 B17R2.153865 COCSc1cc(cc2c1cccn2)OC 62a_100010248855_100000766300 [1,2,0,0,0,0|1,0,0]=4 625 B17R2.153865 COc1cc(c2ccccc2c1)OCC#N 7a_200000076035_100011215382 [1,2,0,0,0,0|1,0,0]=4 626 B17R2.153865 COc1cc(c2ccccc2c1)OCC=O 34a_200000076035_200009817547 [1,2,0,0,0,0|1,0,0]=4 627 B17R2.153865 COc1cc(c2ccccc2c1)OCC=O 7a_200000076035_200015260668 [1,2,0,0,0,0|1,0,0]=4 628 B17R2.153865 COc1cc(c2ccccc2c1)OCCF 34a_200000076035_100011217306 [1,2,0,0,0,0|1,0,0]=4 629 B17R2.153865 COc1cc(c2ccccc2c1)OCCF 7a_200000076035_100011217306 [1,2,0,0,0,0|1,0,0]=4 630 B17R2.153865 COc1cc(c2ccccc2c1)OCCO 34a_200000076035_100000211926 [1,2,0,0,0,0|1,0,0]=4 631 B17R2.153865 COc1cc(c2ccccc2c1)OCCO 7a_200000076035_100000211926 [1,2,0,0,0,0|1,0,0]=4 632 B17R2.153865 COc1cc(c2ccccc2c1)OCSC 34a_200000076035_100011218213 [1,2,0,0,0,0|1,0,0]=4 633 B17R2.56288 C#CCOc1cc(c2ccc(=O)oc2c1)C 34a_100000029242_100000184674 [1,2,0,0,0,0|0,0,0]=3 634 B17R2.56288 C#CCOc1cc(c2ccc(=O)oc2c1)C 7a_100000029242_100000038162 [1,2,0,0,0,0|0,0,0]=3 635 B17R2.56288 C=CCOc1cc(c2ccc(=O)oc2c1)C 34a_100000029242_100015514636 [1,2,0,0,0,0|0,0,0]=3 636 B17R2.56288 C=CCOc1cc(c2ccc(=O)oc2c1)C 7a_100000029242_100015514636 [1,2,0,0,0,0|0,0,0]=3 637 B17R2.56288 CCCOc1cc(c2ccc(=O)oc2c1)C 34a_100000029242_100000210303 [1,2,0,0,0,0|0,0,0]=3 638 B17R2.56288 CCCOc1cc(c2ccc(=O)oc2c1)C 7a_100000029242_100000210303 [1,2,0,0,0,0|0,0,0]=3 639 B17R2.56288 CSCOc1cc(c2ccc(=O)oc2c1)C 34a_100000029242_100011218213 [1,2,0,0,0,0|0,0,0]=3 640 B17R2.56288 Cc1cc(cc2c1ccc(=O)o2)OCC#N 7a_100000029242_100011215382 [1,2,0,0,0,0|0,0,0]=3 641 B17R2.56288 Cc1cc(cc2c1ccc(=O)o2)OCC=O 34a_100000029242_200009817547 [1,2,0,0,0,0|0,0,0]=3 642 B17R2.56288 Cc1cc(cc2c1ccc(=O)o2)OCC=O 7a_100000029242_200015260668 [1,2,0,0,0,0|0,0,0]=3 643 B17R2.56288 Cc1cc(cc2c1ccc(=O)o2)OCCF 34a_100000029242_100011217306 [1,2,0,0,0,0|0,0,0]=3 644 B17R2.56288 Cc1cc(cc2c1ccc(=O)o2)OCCF 7a_100000029242_100011217306 [1,2,0,0,0,0|0,0,0]=3 645 B17R2.56288 Cc1cc(cc2c1ccc(=O)o2)OCCO 34a_100000029242_100000211926 [1,2,0,0,0,0|0,0,0]=3 646 B17R2.56288 Cc1cc(cc2c1ccc(=O)o2)OCCO 7a_100000029242_100000211926 [1,2,0,0,0,0|0,0,0]=3 647 B17R2.266347 Cc1cc(cc2c1ccc(=O)o2)OC(C)C 34a_100000029242_100000210206 [1,2,0,0,0,0|0,0,0]=3 648 B17R2.266347 Cc1cc(cc2c1ccc(=O)o2)OC(C)C 7a_100000029242_100000210206 [1,2,0,0,0,0|0,0,0]=3 649 B17R2.417460 COc1cc(cc2c1c(c(c(=O)o2)C)C)C 34a_100000067130_200000210301 [1,2,0,0,0,0|0,0,0]=3 650 B17R2.417460 COc1cc(cc2c1c(c(c(=O)o2)C)C)C 7a_100000067130_200000210301 [1,2,0,0,0,0|0,0,0]=3 651 B17R2.417460 Cc1cc(c2c(c(c(=O)oc2c1)C)C)O[13CH3] 34a_100000067130_200025704644 [1,2,0,0,0,0|0,0,0]=3 652 B17R2.417460 Cc1cc(c2c(c(c(=O)oc2c1)C)C)O[13CH3] 7a_100000067130_200025704644 [1,2,0,0,0,0|0,0,0]=3 653 B17R2.417396 CCc1cc(=O)oc2c1c(cc(c2)C)OC 7a_100000011533_200000210301 [1,2,0,0,0,0|0,0,0]=3 654 B17R2.417396 CCc1cc(=O)oc2c1c(cc(c2)C)O[13CH3] 7a_100000011533_200025704644 [1,2,0,0,0,0|0,0,0]=3 655 B17R2.9740 CCOc1cc2oc(=O)ccc2cc1OC 7a_100000032626_100000210202 [0,1,0,0,1,1|0,0,0]=3 656 B17R2.9740 COc1cc2ccc(=O)oc2cc1OCF 7a_100000032626_100015361967 [0,1,0,0,1,1|0,0,0]=3 657 B17R2.139606 CCc1cc2c(cc(=O)oc2cc1OC)C 7a_100000008134_200000210301 [0,1,0,0,1,1|1,0,0]=4 658 B17R2.139606 CCc1cc2c(cc(=O)oc2cc1O[13CH3])C 7a_100000008134_200025704644 [0,1,0,0,1,1|1,0,0]=4 659 B17R2.139606 COc1cc2[nH]c(=O)cc(c2cc1OC)O 271570a_203496583355_200021634696 [0,1,0,0,1,1|1,0,0]=4 660 B17R2.68890 COC(=O)c1cc(c2cc(oc2c1)C)OC 34a_200010184872_200000210301 [0,2,0,0,1,0|1,0,0]=4 661 B17R2.68890 COC(=O)c1cc(c2cc(oc2c1)C)OC 7a_200010184872_200000210301 [0,2,0,0,1,0|1,0,0]=4 662 B17R2.68890 COC(=O)c1cc(c2cc(oc2c1)C)O[13CH3] 34a_200010184872_200025704644 [0,2,0,0,1,0|1,0,0]=4 663 B17R2.68890 COC(=O)c1cc(c2cc(oc2c1)C)O[13CH3] 7a_200010184872_200025704644 [0,2,0,0,1,0|1,0,0]=4 664 B17R2.2512 COc1cc(cc(c1)c2ccc(o2)C)OC 271570a_100000061910_100000685218 [0,0,1,1,0,1|1,0,0]=4 665 B17R2.1962 COc1ccc(c(c1)OC)c2ccc(o2)C 271570a_100000061910_100000750026 [0,0,1,1,0,1|1,0,0]=4 666 B17R2.11734 COC(=O)C1=Cc2ccc(cc2OC1)SC 62a_100010168985_200000210301 [0,1,1,1,0,0|0,1,0]=4 667 B17R2.11734 COC(=O)C1=Cc2ccc(cc2OC1)S[13CH3] 62a_100010168985_200025704644 [0,1,1,1,0,0|0,1,0]=4 668 B13R1.313 C=C(C)c1cc(cc(c1)OC)OC 271570a_100000694244_100000685218 [1,0,1,0,1,0|1,0,0]=4 669 B13R1.313 COc1cc(cc(c1)C(=O)C)OC 1458a_100000210870_200000210301 [1,0,1,0,1,0|0,0,1]=4 670 B13R1.313 COc1cc(cc(c1)C(=O)[13CH3])OC 1458a_100000210870_200025704644 [1,0,1,0,1,0|0,0,1]=4 671 B13R1.99 COc1cc(ccc1C(=O)C)O[13CH3] 34a_100000116857_200025704644 [0,0,1,0,2,0|1,0,0]=4 672 B13R1.99 COc1cc(ccc1C(=O)C)O[13CH3] 7a_100000116857_200025704644 [0,0,1,0,2,0|1,0,0]=4 673 B13R1.99 COc1ccc(c(c1)OC)C(=O)C 1458a_100000210807_200000210301 [0,0,1,0,2,0|1,0,0]=4 674 B13R1.99 COc1ccc(c(c1)OC)C(=O)C 34a_100000116857_200000210301 [0,0,1,0,2,0|1,0,0]=4 675 B13R1.99 COc1ccc(c(c1)OC)C(=O)C 34a_100000185565_200000210301 [0,0,1,0,2,0|1,0,0]=4 676 B13R1.99 COc1ccc(c(c1)OC)C(=O)C 7a_100000116857_200000210301 [0,0,1,0,2,0|1,0,0]=4 677 B13R1.99 COc1ccc(c(c1)OC)C(=O)C 7a_100000185565_200000210301 [0,0,1,0,2,0|1,0,0]=4 678 B13R1.99 COc1ccc(c(c1)OC)C(=O)N 34a_100000185031_200000210301 [0,0,1,0,2,0|1,0,0]=4 679 B13R1.99 COc1ccc(c(c1)OC)C(=O)N 7a_100000185031_200000210301 [0,0,1,0,2,0|1,0,0]=4 680 B13R1.99 COc1ccc(c(c1)OC)C(=O)[13CH3] 1458a_100000210807_200025704644 [0,0,1,0,2,0|1,0,0]=4 681 B13R1.99 COc1ccc(c(c1)O[13CH3])C(=O)C 34a_100000185565_200025704644 [0,0,1,0,2,0|1,0,0]=4 682 B13R1.99 COc1ccc(c(c1)O[13CH3])C(=O)C 7a_100000185565_200025704644 [0,0,1,0,2,0|1,0,0]=4 683 B13R1.99 COc1ccc(c(c1)O[13CH3])C(=O)N 34a_100000185031_200025704644 [0,0,1,0,2,0|1,0,0]=4 684 B13R1.99 COc1ccc(c(c1)O[13CH3])C(=O)N 7a_100000185031_200025704644 [0,0,1,0,2,0|1,0,0]=4 685 B13R2.654 COc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100010006585 [2,0,0,0,1,0|1,0,0]=4 686 B13R2.623 COc1cc(cc2c1cc[nH]2)O 271570a_203496583355_100010006603 [2,0,0,0,1,0|1,0,0]=4 687 B13R2.2121 COc1ccc2[nH]c(=O)oc2c1 7a_200000068749_200000210301 [2,0,0,0,1,0|1,0,0]=4 688 B13R2.2121 COc1ccc2cc(oc2c1)C 34a_100000095638_200000210301 [2,0,0,0,1,0|1,0,0]=4 689 B13R2.2121 COc1ccc2cc(oc2c1)C 7a_100000095638_200000210301 [2,0,0,0,1,0|1,0,0]=4 690 B13R2.2121 Cc1cc2ccc(cc2o1)O[13CH3] 34a_100000095638_200025704644 [2,0,0,0,1,0|1,0,0]=4 691 B13R2.2121 Cc1cc2ccc(cc2o1)O[13CH3] 7a_100000095638_200025704644 [2,0,0,0,1,0|1,0,0]=4 692 B13R2.2121 [13CH3]Oc1ccc2[nH]c(=O)oc2c1 7a_200000068749_200025704644 [2,0,0,0,1,0|1,0,0]=4 693 B15R1.3769 C=CC(=O)Nc1ccc(c(c1)OC)OC 1626a_100000187404_100000185746 [0,0,1,0,1,1|1,0,0]=4 694 B15R1.3769 C=CC(=O)Nc1ccc(c(c1)OC)OC 22a_100000187404_100000185746 [0,0,1,0,1,1|1,0,0]=4 695 B15R1.1882 COc1ccc(c(c1)C=CC(=O)C)OC 1458a_100000185123_200000210301 [0,0,1,0,1,1|1,0,0]=4 696 B15R1.1882 COc1ccc(c(c1)C=CC(=O)[13CH3])OC 1458a_100000185123_200025704644 [0,0,1,0,1,1|1,0,0]=4 697 B15R1.1579 COc1cccc(c1OC)C=CC(=O)C 1458a_100016318293_200000210301 [0,0,1,0,1,1|1,0,0]=4 698 B15R1.1579 COc1cccc(c1OC)C=CC(=O)[13CH3] 1458a_100016318293_200025704644 [0,0,1,0,1,1|1,0,0]=4 699 B15R1.12854 COc1cc(ccc1O[13CH3])/C=C/C(=O)C 34a_100102526088_200025704644 [0,0,1,0,1,1|1,0,0]=4 700 B15R1.12854 COc1ccc(cc1OC)/C=C/C(=O)C 34a_100102526088_200000210301 [0,0,1,0,1,1|1,0,0]=4 701 B15R1.12854 COc1ccc(cc1OC)C=CC(=O)C 1458a_100015194992_200000210301 [0,0,1,0,1,1|1,0,0]=4 702 B15R1.12854 COc1ccc(cc1OC)C=CC(=O)[13CH3] 1458a_100015194992_200025704644 [0,0,1,0,1,1|1,0,0]=4 703 B15R2.117 COc1cc2ccccc2cc1OC 34a_200011203880_200000210301 [1,0,0,0,1,1|1,0,0]=4 704 B15R2.117 COc1cc2ccccc2cc1OC 7a_200011203880_200000210301 [1,0,0,0,1,1|1,0,0]=4 705 B15R2.117 COc1cc2ccccc2cc1O[13CH3] 34a_200011203880_200025704644 [1,0,0,0,1,1|1,0,0]=4 706 B15R2.117 COc1cc2ccccc2cc1O[13CH3] 7a_200011203880_200025704644 [1,0,0,0,1,1|1,0,0]=4 707 B15R2.22222 COc1ccc(c2c1cccc2)OC 34a_100000032393_200000210301 [1,0,0,0,1,1|1,0,0]=4 708 B15R2.22222 COc1ccc(c2c1cccc2)OC 7a_100000032393_200000210301 [1,0,0,0,1,1|1,0,0]=4 709 B15R2.22222 COc1ccc(c2c1cccc2)O[13CH3] 34a_100000032393_200025704644 [1,0,0,0,1,1|1,0,0]=4 710 B15R2.22222 COc1ccc(c2c1cccc2)O[13CH3] 7a_100000032393_200025704644 [1,0,0,0,1,1|1,0,0]=4 711 B15R2.22222 COc1ccc(c2c1cccn2)OC 34a_100009853971_200000210301 [1,0,0,0,1,1|1,0,0]=4 712 B15R2.22222 COc1ccc(c2c1cccn2)O[13CH3] 34a_100009853971_200025704644 [1,0,0,0,1,1|1,0,0]=4 713 B17R1.14745 C=CC(=O)NCCc1cc(cc(c1)OC)OC 1626a_100011227904_100000185746 [0,0,1,0,0,2|1,0,0]=4 714 B17R1.14745 C=CC(=O)NCCc1cc(cc(c1)OC)OC 240690a_100011227904_200121576911 [0,0,1,0,0,2|1,0,0]=4 715 B17R1.28976 COc1ccc(c(c1)OC)C=CCOC(=O)C 271570a_200000047263_100000750026 [0,0,1,0,0,2|1,0,0]=4