0 B7R1.1 c1cc([nH]c1)C=O AS06197 [0,0,0,0,0,0|1,0,2]=3 1 B8R1.7 B(c1cccs1)(O)O AS06041 [0,1,0,0,0,0|1,0,0]=2 2 B8R1.7 CC(C)c1cnc[nH]1 AS07134 [0,1,0,0,0,0|3,0,0]=4 3 B8R1.8 c1cc(sc1)C=NO AS06778 [0,1,0,0,0,0|0,0,1]=2 4 B8R1.11 c1csc(c1CO)Br AS06498 [0,1,0,0,0,0|2,0,0]=3 5 B8R1.2 COc1ccccc1 AS04310 [0,0,0,0,0,1|3,0,0]=4 6 B8R1.2 COc1ccccc1 AS06877 [0,0,0,0,0,1|3,0,0]=4 7 B8R1.2 COc1ccccn1 AS01009 [0,0,0,0,0,1|3,0,0]=4 8 B8R1.2 COc1cccnc1 AS01010 [0,0,0,0,0,1|3,0,0]=4 9 B8R1.2 COc1ccncc1 AS04953 [0,0,0,0,0,1|3,0,0]=4 10 B8R1.2 CSc1ccccc1 AS04279 [0,0,0,0,0,1|3,0,0]=4 11 B8R1.2 c1ccc(cc1)C#N AS02370 [0,0,0,0,0,1|2,0,1]=4 12 B8R1.2 c1ccc(cc1)CBr AS02048 [0,0,0,0,0,1|2,0,0]=3 13 B8R1.2 c1ccc(cc1)CO AS04466 [0,0,0,0,0,1|1,0,0]=2 14 B8R1.2 c1ccc(cc1)N=O AS01444 [0,0,0,0,0,1|2,0,1]=4 15 B7R1.4 Cc1cscc1Br AS06573 [1,1,0,0,0,0|2,0,0]=4 16 B7R1.4 Cc1nccn1C AS07139 [1,1,0,0,0,0|2,0,0]=4 17 B7R1.4 c1csc(c1Br)Cl AS06591 [1,1,0,0,0,0|1,0,0]=3 18 B9R1.1 CCc1ccc(cc1)Br AS03254 [0,1,0,0,0,1|2,0,0]=4 19 B9R1.1 CCc1ccc(cc1)F AS04424 [0,1,0,0,0,1|2,0,0]=4 20 B9R1.1 CCc1ccc(cc1)I AS02159 [0,1,0,0,0,1|2,0,0]=4 21 B9R1.1 Cc1ccc(cc1)CCl AS00637 [0,1,0,0,0,1|2,0,0]=4 22 B9R1.1 c1cc(ccc1CBr)Br AS02044 [0,1,0,0,0,1|2,0,0]=4 23 B9R1.1 c1cc(ccc1CBr)Cl AS02046 [0,1,0,0,0,1|2,0,0]=4 24 B9R1.1 c1cc(ccc1CBr)F AS00664 [0,1,0,0,0,1|2,0,0]=4 25 B9R1.1 c1cc(ccc1CBr)I AS00645 [0,1,0,0,0,1|2,0,0]=4 26 B9R1.1 c1cc(ccc1CCl)Br AS00646 [0,1,0,0,0,1|2,0,0]=4 27 B9R1.1 c1cc(ccc1CCl)F AS00660 [0,1,0,0,0,1|2,0,0]=4 28 B9R1.1 c1cc(ccc1CCl)F AS02054 [0,1,0,0,0,1|2,0,0]=4 29 B9R1.1 c1cc(ccc1CN)Br AS02268 [0,1,0,0,0,1|2,0,0]=4 30 B9R1.1 c1cc(ccc1CN)Br AS03103 [0,1,0,0,0,1|2,0,0]=4 31 B9R1.1 c1cc(ccc1CN)Br AS06970 [0,1,0,0,0,1|2,0,0]=4 32 B9R1.1 c1cc(ccc1CN)Cl AS00379 [0,1,0,0,0,1|2,0,0]=4 33 B9R1.1 c1cc(ccc1CN)Cl AS02689 [0,1,0,0,0,1|2,0,0]=4 34 B9R1.1 c1cc(ccc1CN)F AS00834 [0,1,0,0,0,1|2,0,0]=4 35 B9R1.1 c1cc(ccc1CN)F AS01938 [0,1,0,0,0,1|2,0,0]=4 36 B9R1.1 c1cc(ccc1CN)I AS02223 [0,1,0,0,0,1|2,0,0]=4 37 B9R1.1 c1cc(ccc1CN)I AS02301 [0,1,0,0,0,1|2,0,0]=4 38 B9R1.1 c1cc(ccc1CO)Br AS03954 [0,1,0,0,0,1|1,0,0]=3 39 B9R1.1 c1cc(ccc1CO)Cl AS03965 [0,1,0,0,0,1|1,0,0]=3 40 B9R1.1 c1cc(ccc1CO)F AS03978 [0,1,0,0,0,1|1,0,0]=3 41 B9R1.1 c1cc(ccc1CO)I AS00604 [0,1,0,0,0,1|1,0,0]=3 42 B9R1.1 c1cc(ccc1CO)I AS03987 [0,1,0,0,0,1|1,0,0]=3 43 B9R1.1 c1cc(ccc1CO)N AS00548 [0,1,0,0,0,1|1,0,0]=3 44 B9R1.1 c1cc(ccc1CO)O AS00576 [0,1,0,0,0,1|1,0,0]=3 45 B9R1.2 CCc1cccc(c1)Br AS03253 [0,1,0,0,0,1|2,0,0]=4 46 B9R1.2 CCc1cccc(c1)N AS00465 [0,1,0,0,0,1|2,0,0]=4 47 B9R1.2 CCc1cccc(c1)O AS04468 [0,1,0,0,0,1|2,0,0]=4 48 B9R1.2 Cc1cccc(c1)CCl AS00628 [0,1,0,0,0,1|2,0,0]=4 49 B9R1.2 Cc1cccc(c1)CF AS05991 [0,1,0,0,0,1|2,0,0]=4 50 B9R1.2 Cc1cccc(c1)CN AS00385 [0,1,0,0,0,1|2,0,0]=4 51 B9R1.2 c1cc(cc(c1)Br)CBr AS00624 [0,1,0,0,0,1|2,0,0]=4 52 B9R1.2 c1cc(cc(c1)Br)CN AS02267 [0,1,0,0,0,1|2,0,0]=4 53 B9R1.2 c1cc(cc(c1)Br)CN AS03102 [0,1,0,0,0,1|2,0,0]=4 54 B9R1.2 c1cc(cc(c1)Br)CO AS03953 [0,1,0,0,0,1|1,0,0]=3 55 B9R1.2 c1cc(cc(c1)Cl)CBr AS00001 [0,1,0,0,0,1|2,0,0]=4 56 B9R1.2 c1cc(cc(c1)Cl)CCl AS02066 [0,1,0,0,0,1|2,0,0]=4 57 B9R1.2 c1cc(cc(c1)Cl)CN AS00386 [0,1,0,0,0,1|2,0,0]=4 58 B9R1.2 c1cc(cc(c1)Cl)CN AS02688 [0,1,0,0,0,1|2,0,0]=4 59 B9R1.2 c1cc(cc(c1)Cl)CO AS03964 [0,1,0,0,0,1|1,0,0]=3 60 B9R1.2 c1cc(cc(c1)F)CBr AS00663 [0,1,0,0,0,1|2,0,0]=4 61 B9R1.2 c1cc(cc(c1)F)CCl AS00661 [0,1,0,0,0,1|2,0,0]=4 62 B9R1.2 c1cc(cc(c1)F)CF AS05720 [0,1,0,0,0,1|2,0,0]=4 63 B9R1.2 c1cc(cc(c1)F)CN AS00833 [0,1,0,0,0,1|2,0,0]=4 64 B9R1.2 c1cc(cc(c1)F)CN AS01937 [0,1,0,0,0,1|2,0,0]=4 65 B9R1.2 c1cc(cc(c1)F)CO AS03977 [0,1,0,0,0,1|1,0,0]=3 66 B9R1.2 c1cc(cc(c1)I)CBr AS00643 [0,1,0,0,0,1|2,0,0]=4 67 B9R1.2 c1cc(cc(c1)I)CN AS02222 [0,1,0,0,0,1|2,0,0]=4 68 B9R1.2 c1cc(cc(c1)I)CN AS02300 [0,1,0,0,0,1|2,0,0]=4 69 B9R1.2 c1cc(cc(c1)I)CO AS03986 [0,1,0,0,0,1|1,0,0]=3 70 B9R1.2 c1cc(cc(c1)N)CO AS00403 [0,1,0,0,0,1|1,0,0]=3 71 B9R1.2 c1cc(cc(c1)O)CO AS00159 [0,1,0,0,0,1|1,0,0]=3 72 B9R1.2 c1cc(nc(c1)Br)CO AS04914 [0,1,0,0,0,1|1,0,0]=3 73 B9R1.6 c1ccc(cc1)C(=O)O AS04617 [0,1,0,0,0,1|1,0,1]=4 74 B9R1.8 c1ccc(cc1)CC#N AS01366 [0,1,0,0,0,1|2,0,0]=4 75 B9R1.8 c1ccc(cc1)CCCl AS00650 [0,1,0,0,0,1|2,0,0]=4 76 B9R1.8 c1ccc(cc1)CCN AS00484 [0,1,0,0,0,1|2,0,0]=4 77 B9R1.8 c1ccc(cc1)CCO AS00558 [0,1,0,0,0,1|1,0,0]=3 78 B9R1.8 c1ccc(cc1)CON AS04494 [0,1,0,0,0,1|1,0,0]=3 79 B9R1.8 c1ccnc(c1)CCCl AS04932 [0,1,0,0,0,1|2,0,0]=4 80 B9R1.15 CCc1ccccc1Br AS03252 [0,1,0,0,0,1|2,0,0]=4 81 B9R1.15 CCc1ccccc1I AS02158 [0,1,0,0,0,1|2,0,0]=4 82 B9R1.15 Cc1ccccc1CBr AS02052 [0,1,0,0,0,1|2,0,0]=4 83 B9R1.15 Cc1ccccc1CCl AS03843 [0,1,0,0,0,1|2,0,0]=4 84 B9R1.15 Cc1ccccc1CN AS00380 [0,1,0,0,0,1|2,0,0]=4 85 B9R1.15 c1ccc(c(c1)CBr)Br AS02057 [0,1,0,0,0,1|2,0,0]=4 86 B9R1.15 c1ccc(c(c1)CBr)Cl AS02065 [0,1,0,0,0,1|2,0,0]=4 87 B9R1.15 c1ccc(c(c1)CBr)F AS00662 [0,1,0,0,0,1|2,0,0]=4 88 B9R1.15 c1ccc(c(c1)CBr)I AS00633 [0,1,0,0,0,1|2,0,0]=4 89 B9R1.15 c1ccc(c(c1)CCl)F AS00659 [0,1,0,0,0,1|2,0,0]=4 90 B9R1.15 c1ccc(c(c1)CN)Br AS02252 [0,1,0,0,0,1|2,0,0]=4 91 B9R1.15 c1ccc(c(c1)CN)Br AS03101 [0,1,0,0,0,1|2,0,0]=4 92 B9R1.15 c1ccc(c(c1)CN)Cl AS00369 [0,1,0,0,0,1|2,0,0]=4 93 B9R1.15 c1ccc(c(c1)CN)Cl AS02687 [0,1,0,0,0,1|2,0,0]=4 94 B9R1.15 c1ccc(c(c1)CN)F AS00832 [0,1,0,0,0,1|2,0,0]=4 95 B9R1.15 c1ccc(c(c1)CN)F AS01936 [0,1,0,0,0,1|2,0,0]=4 96 B9R1.15 c1ccc(c(c1)CN)I AS02221 [0,1,0,0,0,1|2,0,0]=4 97 B9R1.15 c1ccc(c(c1)CN)I AS02299 [0,1,0,0,0,1|2,0,0]=4 98 B9R1.15 c1ccc(c(c1)CN)N AS06598 [0,1,0,0,0,1|2,0,0]=4 99 B9R1.15 c1ccc(c(c1)CO)Br AS03952 [0,1,0,0,0,1|1,0,0]=3 100 B9R1.15 c1ccc(c(c1)CO)Cl AS03963 [0,1,0,0,0,1|1,0,0]=3 101 B9R1.15 c1ccc(c(c1)CO)F AS03976 [0,1,0,0,0,1|1,0,0]=3 102 B9R1.15 c1ccc(c(c1)CO)I AS03985 [0,1,0,0,0,1|1,0,0]=3 103 B9R1.15 c1ccc(c(c1)CO)N AS00575 [0,1,0,0,0,1|1,0,0]=3 104 B9R1.15 c1ccc(c(c1)CO)O AS00547 [0,1,0,0,0,1|1,0,0]=3 105 B9R1.22 c1c(c(sc1Br)C#N)N AS06695 [0,2,0,0,0,0|1,0,1]=4 106 B9R1.132 c1c(c(c(s1)C=O)Br)Br AS06575 [0,2,0,0,0,0|0,0,2]=4 107 B9R1.14 c1csc(c1C=O)C=O AS06747 [0,2,0,0,0,0|0,0,2]=4 108 B7R1.3 c1ccc(cc1)S AS04135 [0,0,1,1,0,0|1,0,1]=4