0  B10R1.66  CC(C)NCc1ccco1 A2Z00087006 [0,0,0,0,0,0|2,0,1]=3
1  B10R1.66  c1cc([nH]c1)CCC(=O)O A2Z00094982 [0,0,0,0,0,0|3,0,0]=3
2  B10R1.66  c1cc([nH]c1)\C=C\C(=O)O A2Z00094929 [0,0,0,0,0,0|3,0,1]=4
3  B10R1.66  c1cc(oc1)CCC(=O)O A2Z00095303 [0,0,0,0,0,0|2,0,0]=2
4  B10R1.66  c1cc(oc1)\C=C\C(=O)Cl A2Z00095952 [0,0,0,0,0,0|2,0,1]=3
5  B10R1.66  c1cc(oc1)\C=C\C(=O)O A2Z00085545 [0,0,0,0,0,0|2,0,1]=3
6  B10R1.66  c1cc(sc1)CCC(=O)O A2Z00095188 [0,0,0,0,0,0|2,1,0]=3
7  B10R1.66  c1cc(sc1)\C=C\C(=O)O A2Z00096656 [0,0,0,0,0,0|2,1,1]=4
8  B9R1.12  c1cc([nH]c1)\C=C\C=O A2Z00094927 [1,0,0,0,0,0|2,0,1]=4
9  B9R1.12  c1cc(oc1)\C=C\C=O A2Z00094719 [1,0,0,0,0,0|1,0,1]=3
10  B11R1.25  COC(=O)\C=C\c1cccs1 A2Z00096369 [0,1,0,0,0,0|1,1,1]=4
11  B11R1.25  c1cc(oc1)CNC(=O)CCl A2Z00056809 [0,1,0,0,0,0|1,0,0]=2
12  B11R1.75  c1c(onc1Cl)CCC(=O)O A2Z00087366 [0,1,0,0,0,0|3,0,0]=4
13  B9R1.13  c1c(ncs1)CC(=O)O A2Z00061633 [0,0,0,0,1,0|3,0,0]=4
14  B9R1.13  c1c[nH]nc1CC(=O)O A2Z00050347 [0,0,0,0,1,0|3,0,0]=4
15  B9R1.13  c1cc(oc1)CC(=O)O A2Z00061737 [0,0,0,0,1,0|1,0,0]=2
16  B9R1.13  c1cc(sc1)CC(=O)Cl A2Z00094074 [0,0,0,0,1,0|1,1,0]=3
17  B9R1.13  c1cc(sc1)CC(=O)N A2Z00095950 [0,0,0,0,1,0|1,1,0]=3
18  B9R1.13  c1cc(sc1)CC(=O)O A2Z00095935 [0,0,0,0,1,0|1,1,0]=3
19  B9R1.13  c1cn[nH]c1CC(=O)O A2Z00096237 [0,0,0,0,1,0|3,0,0]=4
20  B11R1.91  CC(=O)NCc1ccccn1 A2Z00094956 [0,0,0,0,0,1|2,0,0]=3
21  B11R1.91  c1ccnc(c1)CCC(=O)O A2Z00094491 [0,0,0,0,0,1|3,0,0]=4
22  B10R1.21  C=CCNCc1ccco1 A2Z00048061 [1,1,0,0,0,0|1,0,1]=4
23  B10R1.54  Cc1ccc(o1)CC(=O)O A2Z00049556 [0,1,0,0,1,0|1,0,0]=3
24  B10R1.54  Cc1ccc(o1)CN(C)C A2Z00096304 [0,1,0,0,1,0|2,0,0]=4
25  B10R1.54  c1cc(sc1CC(=O)O)Br A2Z00050168 [0,1,0,0,1,0|1,1,0]=4
26  B12R1.21  CC(=O)CCc1ccc(cc1)Br A2Z00049942 [0,1,0,0,0,1|2,0,0]=4
27  B12R1.27  c1ccc(cc1)CCC(=O)CBr A2Z00094984 [0,1,0,0,0,1|2,0,0]=4
28  B12R1.27  c1ccc(cc1)CNC(=O)CCl A2Z00097817 [0,1,0,0,0,1|2,0,0]=4
29  B12R1.27  c1ccc(cc1)CNC(=O)CO A2Z00068365 [0,1,0,0,0,1|2,0,0]=4
30  B12R1.226  CC(=O)CCc1cccc(c1)Cl A2Z00094749 [0,1,0,0,0,1|2,0,0]=4
31  B12R1.54  CC(=O)CCC(=O)c1cccs1 A2Z00048097 [0,1,0,0,0,1|1,1,0]=4
32  B8R1.7  CC(=O)c1cccs1 A2Z00050162 [0,0,0,0,2,0|0,1,0]=3
33  B8R1.7  CC(=O)c1cncs1 A2Z00085476 [0,0,0,0,2,0|1,1,0]=4
34  B8R1.7  c1cc([nH]c1)C(=O)O A2Z00070219 [0,0,0,0,2,0|2,0,0]=4
35  B8R1.7  c1cc(oc1)C(=O)O A2Z00093505 [0,0,0,0,2,0|1,0,0]=3
36  B8R1.7  c1cnoc1C(=O)O A2Z00096002 [0,0,0,0,2,0|2,0,0]=4