0 B12R1.114 CCOc1ccc(cc1Cl)C#N CSC000189308 [1,0,0,0,0,0|2,0,1]=4 1 B12R1.116 CCOc1ccc(cc1)CCO CSC011217992 [1,0,0,0,0,0|1,0,2]=4 2 B12R1.116 CCOc1ccc(cc1)OCC CSC000170733 [1,0,0,0,0,0|1,0,1]=3 3 B12R1.288 CNCc1ccc(c(c1)O)OC CSC000188468 [1,0,0,0,0,0|1,0,1]=3 4 B11R1.81 CCOc1ccc(cc1Br)C CSC000230997 [2,0,0,0,0,0|1,0,0]=3 5 B11R1.81 CCOc1ccc(cc1Br)Cl CSC000171684 [2,0,0,0,0,0|2,0,0]=4 6 B11R1.81 CCOc1ccc(cc1C)Br CSC011308936 [2,0,0,0,0,0|2,0,0]=4 7 B11R1.81 CCOc1ccc(cc1C)C CSC000174096 [2,0,0,0,0,0|1,0,0]=3 8 B11R1.81 CCOc1ccc(cc1Cl)Br CSC000149648 [2,0,0,0,0,0|2,0,0]=4 9 B11R1.81 CCOc1ccc(cc1Cl)Cl CSC000005818 [2,0,0,0,0,0|2,0,0]=4 10 B11R1.81 CCOc1ccc(cc1Cl)F CSC000005860 [2,0,0,0,0,0|2,0,0]=4 11 B11R1.81 CCOc1ccc(cc1F)Br CSC000171753 [2,0,0,0,0,0|2,0,0]=4 12 B11R1.81 CCOc1ccc(cc1F)Cl CSC011212613 [2,0,0,0,0,0|2,0,0]=4 13 B11R1.81 CCSc1ccc(cc1C)C CSC000006292 [2,0,0,0,0,0|1,1,0]=4 14 B11R1.83 CCCc1ccc(cc1)OC CSC000034192 [2,0,0,0,0,0|0,0,2]=4 15 B11R1.83 CCOc1ccc(cc1)CN CSC000185588 [2,0,0,0,0,0|1,0,1]=4 16 B11R1.83 CCOc1ccc(cc1)CO CSC000173027 [2,0,0,0,0,0|1,0,1]=4 17 B11R1.83 CCOc1ccc(cc1)SC CSC000021790 [2,0,0,0,0,0|1,0,0]=3 18 B11R1.83 CCSc1ccc(cc1)OC CSC000021481 [2,0,0,0,0,0|1,0,1]=4 19 B13R1.144 CCOc1ccc(cc1C)C(=O)C CSC011826144 [1,1,0,0,0,0|1,0,0]=3 20 B13R1.144 CCOc1ccc(cc1Cl)C(=O)C CSC011772398 [1,1,0,0,0,0|1,0,0]=3 21 B13R1.144 CCOc1ccc(cc1F)C(=O)C CSC011229987 [1,1,0,0,0,0|1,0,0]=3 22 B13R1.77 CCOc1ccc(cc1)OCCO CSC011305789 [1,1,0,0,0,0|1,0,1]=4 23 B13R1.139 CCCc1ccc(cc1)C(=O)OC CSC011528880 [1,1,0,0,0,0|2,0,0]=4 24 B13R1.139 CCOc1ccc(cc1)C(=O)CC CSC000170456 [1,1,0,0,0,0|0,0,1]=3 25 B13R1.139 CCOc1ccc(cc1)C(=O)OC CSC000148975 [1,1,0,0,0,0|1,0,0]=3 26 B13R1.139 CCOc1ccc(cc1)C(O)CC CSC011305111 [1,1,0,0,0,0|0,0,2]=4 27 B13R1.142 CNCc1ccc(cc1)OC(C)C CSC000713913 [1,1,0,0,0,0|1,0,1]=4 28 B13R1.35 CCc1ccc(cc1Cl)NC(=O)C CSC009871426 [1,1,0,0,0,0|2,0,0]=4 29 B13R1.35 COc1ccc(cc1Br)NC(=O)C CSC000187428 [1,1,0,0,0,0|2,0,0]=4 30 B13R1.35 COc1ccc(cc1Cl)NC(=O)C CSC000152235 [1,1,0,0,0,0|2,0,0]=4 31 B13R1.35 COc1ccc(cc1F)NC(=O)C CSC011323073 [1,1,0,0,0,0|2,0,0]=4 32 B13R1.35 COc1ccc(cc1N)NC(=O)C CSC000211725 [1,1,0,0,0,0|2,0,0]=4 33 B13R1.386 COc1ccc(cc1OC)C=CC CSC020645153 [1,1,0,0,0,0|0,0,0]=2 34 B13R1.3088 CCC(=O)c1ccc(c(c1)F)OC CSC011220448 [1,1,0,0,0,0|1,0,1]=4 35 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC CSC000206220 [1,1,0,0,0,0|2,0,0]=4 36 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC CSC000198141 [1,1,0,0,0,0|2,0,0]=4 37 B13R1.3088 COC(=O)c1ccc(c(c1)Br)OC CSC000189012 [1,1,0,0,0,0|2,0,0]=4 38 B13R1.3088 COC(=O)c1ccc(c(c1)F)OC CSC000198256 [1,1,0,0,0,0|2,0,0]=4 39 B13R1.3088 COC(=O)c1ccc(c(c1)I)OC CSC011216211 [1,1,0,0,0,0|2,0,0]=4 40 B13R1.3088 COC(=O)c1ccc(c(c1)O)OC CSC011215032 [1,1,0,0,0,0|1,0,0]=3 41 B15R1.5627 CCOc1ccc(cc1Cl)NC(=O)CN CSC011376319 [0,2,0,0,0,0|2,0,0]=4 42 B15R1.5627 CCOc1ccc(cc1F)NC(=O)CN CSC012771191 [0,2,0,0,0,0|2,0,0]=4 43 B15R1.594 COc1cc(ccc1OC(=O)C)C=CC CSC000008708 [0,2,0,0,0,0|0,0,1]=3 44 B15R1.7061 CCOc1ccc(cc1OC)C(=O)NC CSC000159749 [0,2,0,0,0,0|1,0,0]=3 45 B13R2.57 COc1ccc2c(c1)OCCO2 CSC009884742 [1,0,0,1,0,0|1,0,0]=3 46 B13R2.449 CCOc1ccc2[nH]ccc2c1 CSC012017212 [1,0,0,1,0,0|1,0,1]=4 47 B15R2.1668 NC(=O)Cc1ccc2c(c1)OCCO2 CSC000003383 [0,1,0,1,0,0|1,0,1]=4 48 B15R2.1601 COC(=O)c1ccc2c(c1)OCCO2 CSC000149866 [0,1,0,1,0,0|1,0,0]=3 49 B15R2.19280 COC(=O)c1ccc2c(c1)CC(O2)C CSC009854162 [0,1,0,1,0,0|2,0,0]=4