0 B10R1.15 CC(CBr)c1ccccc1 AS03467 [1,0,0,0,0,0|2,0,0]=3 1 B10R1.15 CCC(=O)c1ccccc1 AS01141 [1,0,0,0,0,0|1,0,2]=4 2 B10R1.15 CCC(C)c1ccccc1 AS05667 [1,0,0,0,0,0|1,0,0]=2 3 B12R1.12 COC(c1ccc(cc1)Br)OC AS03782 [0,1,0,0,0,0|0,0,0]=1 4 B12R1.12 COC(c1ccc(cc1)I)OC AS03919 [0,1,0,0,0,0|0,0,0]=1 5 B12R1.13 COC(c1cccc(c1)Br)OC AS03781 [0,1,0,0,0,0|0,0,0]=1 6 B12R1.13 COC(c1cccc(c1)I)OC AS03918 [0,1,0,0,0,0|0,0,0]=1 7 B12R1.243 CCN(CC)c1ccccc1C AS04655 [0,1,0,0,0,0|3,0,0]=4 8 B12R1.243 COC(c1ccccc1Br)OC AS03780 [0,1,0,0,0,0|0,0,0]=1 9 B12R1.243 COC(c1ccccc1I)OC AS03917 [0,1,0,0,0,0|0,0,0]=1 10 B12R1.243 COC(c1ccccc1I)OC AS05605 [0,1,0,0,0,0|0,0,0]=1 11 B12R1.478 COC(c1ccccc1)C(=O)O AS04652 [0,1,0,0,0,0|2,0,0]=3 12 B12R2.2 c1ccc(cc1)[C@H]2CCNC2 AS06821 [0,0,0,1,0,0|3,0,0]=4 13 B9R1.6 c1ccc(cc1)C(=O)O AS04617 [2,0,0,0,0,0|0,0,2]=4 14 B9R1.8 c1ccc(cc1)CC#N AS01366 [2,0,0,0,0,0|2,0,0]=4 15 B9R1.8 c1ccc(cc1)CCCl AS00650 [2,0,0,0,0,0|2,0,0]=4 16 B9R1.8 c1ccc(cc1)CCN AS00484 [2,0,0,0,0,0|2,0,0]=4 17 B9R1.8 c1ccc(cc1)CCO AS00558 [2,0,0,0,0,0|2,0,0]=4 18 B9R1.8 c1ccc(cc1)CON AS04494 [2,0,0,0,0,0|1,0,0]=3 19 B11R1.7 CC(C#C)(c1ccccc1)O AS01594 [1,1,0,0,0,0|1,0,1]=4 20 B11R1.22 COC(=O)c1ccc(cc1)Br AS03617 [1,1,0,0,0,0|0,0,2]=4 21 B11R1.22 COC(=O)c1ccc(cc1)Cl AS02923 [1,1,0,0,0,0|0,0,2]=4 22 B11R1.22 COC(=O)c1ccc(cc1)F AS01318 [1,1,0,0,0,0|0,0,2]=4 23 B11R1.22 COC(=O)c1ccc(cc1)I AS02318 [1,1,0,0,0,0|0,0,2]=4 24 B11R1.22 COC(=O)c1ccc(cc1)O AS01626 [1,1,0,0,0,0|0,0,2]=4 25 B11R1.22 Cc1ccc(cc1)C(=O)OC AS01339 [1,1,0,0,0,0|0,0,2]=4 26 B11R1.22 c1cc(ccc1C(CO)O)Br AS06515 [1,1,0,0,0,0|2,0,0]=4 27 B11R1.23 COC(=O)c1cccc(c1)Br AS03616 [1,1,0,0,0,0|0,0,2]=4 28 B11R1.23 COC(=O)c1cccc(c1)I AS02317 [1,1,0,0,0,0|0,0,2]=4 29 B11R1.23 Cc1cccc(c1)C(=O)OC AS02466 [1,1,0,0,0,0|0,0,2]=4 30 B11R1.36 c1ccc(cc1)[C@H](C(=O)O)O AS01425 [1,1,0,0,0,0|2,0,0]=4 31 B11R1.222 CCC(C)c1ccccc1N AS05311 [1,1,0,0,0,0|1,0,0]=3 32 B11R1.222 COC(=O)c1ccccc1Br AS03615 [1,1,0,0,0,0|0,0,2]=4 33 B11R1.222 COC(=O)c1ccccc1Cl AS00094 [1,1,0,0,0,0|0,0,2]=4 34 B11R1.222 COC(=O)c1ccccc1F AS01317 [1,1,0,0,0,0|0,0,2]=4 35 B11R1.222 COC(=O)c1ccccc1I AS02316 [1,1,0,0,0,0|0,0,2]=4 36 B11R1.222 COC(=O)c1ccccc1N AS01236 [1,1,0,0,0,0|0,0,2]=4 37 B13R1.331 COC(c1ccc(c(c1)Br)Br)OC AS03858 [0,2,0,0,0,0|0,0,0]=2 38 B13R1.331 COC(c1ccc(c(c1)Br)F)OC AS03809 [0,2,0,0,0,0|0,0,0]=2 39 B13R1.331 COC(c1ccc(c(c1)I)F)OC AS03892 [0,2,0,0,0,0|0,0,0]=2 40 B13R1.331 Cc1ccc(cc1Br)C(OC)OC AS03825 [0,2,0,0,0,0|0,0,0]=2 41 B13R1.961 COC(c1ccc(cc1Br)Br)OC AS03857 [0,2,0,0,0,0|0,0,0]=2 42 B13R1.961 COC(c1ccc(cc1Br)Cl)OC AS03933 [0,2,0,0,0,0|0,0,0]=2 43 B13R1.961 COC(c1ccc(cc1Cl)Br)OC AS03790 [0,2,0,0,0,0|0,0,0]=2 44 B13R1.961 COC(c1ccc(cc1F)Br)OC AS03810 [0,2,0,0,0,0|0,0,0]=2 45 B13R1.961 COC(c1ccc(cc1F)I)OC AS03888 [0,2,0,0,0,0|0,0,0]=2 46 B13R1.317 COC(c1cc(ccc1Br)F)OC AS03807 [0,2,0,0,0,0|0,0,0]=2 47 B13R1.317 COC(c1cc(ccc1F)Br)OC AS03811 [0,2,0,0,0,0|0,0,0]=2 48 B13R1.317 COC(c1cc(ccc1F)I)OC AS03889 [0,2,0,0,0,0|0,0,0]=2 49 B13R1.321 COC(c1cc(cc(c1)Br)Br)OC AS03859 [0,2,0,0,0,0|0,0,0]=2 50 B13R1.321 COC(c1cc(cc(c1)I)F)OC AS03891 [0,2,0,0,0,0|0,0,0]=2 51 B13R1.8528 COC(c1c(cccc1Br)F)OC AS03808 [0,2,0,0,0,0|0,0,0]=2 52 B13R1.8528 COC(c1c(cccc1I)F)OC AS03890 [0,2,0,0,0,0|0,0,0]=2 53 B13R2.3 c1ccc(cc1)[C@@H]2CCCNC2 AS06813 [0,1,0,1,0,0|2,0,0]=4 54 B13R2.3 c1ccc(cc1)[C@H]2CCCNC2 AS06812 [0,1,0,1,0,0|2,0,0]=4 55 B13R2.13 c1cc(cc(c1)Br)C2OCCO2 AS03784 [0,1,0,1,0,0|0,0,0]=2 56 B13R2.18 c1ccc(c(c1)C2OCCO2)Br AS03783 [0,1,0,1,0,0|0,0,0]=2