0  B12R1.27  COC(=O)CCc1ccccc1 AS06125 [0,0,0,0,0,0|3,0,1]=4
1  B11R1.28  CCCCOc1ccccc1 AS01104 [1,0,0,0,0,0|2,0,1]=4
2  B11R1.28  c1ccc(cc1)CCN=C=O AS04375 [1,0,0,0,0,0|1,0,1]=3
3  B11R1.28  c1ccc(cc1)CNCC#N AS06325 [1,0,0,0,0,0|2,0,1]=4
4  B11R1.28  c1ccc(cc1)OCCCBr AS03455 [1,0,0,0,0,0|2,0,1]=4
5  B11R1.91  CC(=O)COc1ccccc1 AS05273 [1,0,0,0,0,0|1,0,1]=3
6  B11R1.91  CC(=O)OCc1ccccc1 AS01460 [1,0,0,0,0,0|1,0,1]=3
7  B10R1.17  CCCOc1ccccc1 AS01111 [2,0,0,0,0,0|1,0,0]=3
8  B10R1.17  c1ccc(cc1)C#CC=O AS06906 [2,0,0,0,0,0|0,0,2]=4
9  B10R1.17  c1ccc(cc1)CCCBr AS03468 [2,0,0,0,0,0|1,0,0]=3
10  B10R1.17  c1ccc(cc1)NCCO AS00460 [2,0,0,0,0,0|1,0,1]=4
11  B10R1.17  c1ccc(cc1)OCCBr AS03452 [2,0,0,0,0,0|2,0,0]=4
12  B12R1.1  CCCCCc1ccc(cc1)Br AS00629 [1,1,0,0,0,0|1,0,1]=4
13  B12R1.8  CCCCCOc1ccccc1 AS01110 [1,1,0,0,0,0|1,0,1]=4
14  B12R1.8  c1ccc(cc1)COCCC=O AS05243 [1,1,0,0,0,0|0,0,0]=2
15  B12R1.8  c1ccc(cc1)COCCCO AS03951 [1,1,0,0,0,0|0,0,2]=4
16  B12R1.8  c1ccc(cc1)OCCCCBr AS03450 [1,1,0,0,0,0|1,0,1]=4
17  B12R1.8  c1ccc(cc1)OCCCCI AS02285 [1,1,0,0,0,0|1,0,1]=4
18  B12R1.252  CC(=O)OCCc1ccccc1 AS02439 [1,1,0,0,0,0|1,0,0]=3
19  B12R1.252  c1ccc(cc1)COCC(=O)O AS06202 [1,1,0,0,0,0|1,0,0]=3
20  B12R1.21  c1cc(ccc1CCC(=O)O)F AS04666 [1,1,0,0,0,0|1,0,1]=4
21  B12R1.21  c1cc(ccc1CCC(=O)O)O AS02950 [1,1,0,0,0,0|1,0,1]=4
22  B12R1.107  c1ccc(cc1)[C@@H](CC(=O)O)N AS06772 [1,1,0,0,0,0|1,0,1]=4
23  B12R1.125  Cc1ccccc1CCC(=O)O AS00516 [1,1,0,0,0,0|1,0,1]=4
24  B12R1.125  c1ccc(c(c1)CCC(=O)O)Br AS06127 [1,1,0,0,0,0|1,0,1]=4
25  B12R1.125  c1ccc(c(c1)CCC(=O)O)F AS02202 [1,1,0,0,0,0|1,0,1]=4
26  B12R1.125  c1ccc(c(c1)CCC(=O)O)I AS07158 [1,1,0,0,0,0|1,0,1]=4
27  B14R1.425  c1ccc(cc1)C[C@H]([C@@H](C(=O)O)O)N AS06798 [0,2,0,0,0,0|1,0,0]=3
28  B12R2.2  c1ccc(cc1)[C@H]2CCNC2 AS06821 [1,0,0,1,0,0|2,0,0]=4
29  B12R2.1081  c1ccc2c(c1)C(=O)CCO2 AS06210 [1,0,0,1,0,0|1,0,0]=3
30  B14R2.781  c1ccc2c(c1)OC[C@@H](O2)C(=O)O AS06640 [0,1,0,1,0,0|2,0,0]=4
31  B10R1.18  CC(Cc1ccccc1)O AS07220 [1,0,0,0,1,0|0,0,1]=3
32  B10R1.15  CC(CBr)c1ccccc1 AS03467 [0,0,0,0,2,0|1,0,1]=4
33  B10R1.15  CCC(C)c1ccccc1 AS05667 [0,0,0,0,2,0|1,0,1]=4