0  B14R1.3  N#CC1=CC=C(C[C@H](N)C(=O)O)C=C1 CS-W022752 [0,0,0,0,0,0|3,0,1]=4
1  B13R1.3  COC1=CC=C(CCC(=O)O)C=N1 CS-0037812 [1,0,0,0,0,0|1,0,1]=3
2  B13R1.133  CC(CC1=CC=C(F)C=C1)C(=O)O CS-0038549 [1,0,0,0,0,0|2,0,1]=4
3  B13R1.133  C\C(=C/C1=CC=C(F)C=C1)C(=O)O CS-0112389 [1,0,0,0,0,0|2,0,1]=4
4  B13R1.133  NC(CC1=CC=C(Br)C=C1)C(=O)O CS-W012746 [1,0,0,0,0,0|2,0,1]=4
5  B13R1.133  N[C@H](CC1=CC=C(O)C=C1)C(=O)O CS-D1377 [1,0,0,0,0,0|1,0,1]=3
6  B13R1.133  O=C(O)[C@H](O)CC1=CC=C(F)C=C1 CS-0046987 [1,0,0,0,0,0|1,0,2]=4
7  B13R1.133  [C@H](N)(CC1=CC=C(N)C=C1)C(=O)O CS-W017196 [1,0,0,0,0,0|2,0,1]=4
8  B15R2.4834  COC1=CC2=C(C=C1)C=C(C(=O)O)N2 CS-W007863 [0,0,0,1,0,0|1,0,1]=3
9  B15R2.21336  COC1=CC=C2N=C(O)C(O)=NC2=C1 CS-0008690 [0,0,0,1,0,0|2,0,1]=4
10  B12R1.21  CC1=CC=C(C#CC(=O)O)C=C1 CS-W018356 [2,0,0,0,0,0|0,0,2]=4
11  B12R1.4  N#CC1=CC=C(CC(=O)O)C=C1 CS-W004704 [2,0,0,0,0,0|2,0,0]=4
12  B12R1.49  N=C(CC1=CC=C(O)C=C1)NO CS-0037137 [2,0,0,0,0,0|2,0,0]=4
13  B14R1.103  COC1=CC=C(CCC(=O)O)C(F)=C1 CS-0036589 [1,1,0,0,0,0|0,0,1]=3
14  B14R1.142  NCCC1=CC=C(CCC(=O)O)C=C1 CS-0043336 [1,1,0,0,0,0|1,0,1]=4
15  B14R1.3653  COC1=CC=C(CCC(=O)O)C=C1F CS-0094414 [1,1,0,0,0,0|0,0,1]=3
16  B14R1.213  COC1=CC=C(C(F)(F)C(=O)O)C=C1 CS-B1112 [0,1,0,0,1,0|1,0,1]=4
17  B16R1.197  COC(=O)\C(Cl)=N\NC1=CC=C(OC)C=C1 CS-M3608 [0,1,0,0,0,1|2,0,0]=4
18  B14R2.134  COC1=CC2=C(C=C1)CCC(=O)C2 CS-D0606 [1,0,0,1,0,0|1,0,1]=4
19  B14R2.4529  CC1=CC2=C(C=C1)C=C(C(=O)O)N2 CS-0018975 [1,0,0,1,0,0|1,0,1]=4
20  B14R2.4529  CC1=CC=C2C=C(C(=O)O)SC2=C1 CS-0043148 [1,0,0,1,0,0|0,1,1]=4
21  B14R2.4529  O=C(O)C1=CC2=CC(O)=CC=C2N1 CS-W017375 [1,0,0,1,0,0|2,0,0]=4
22  B16R2.7476  COC1=CC2=C(C=C1)OC[C@@H](C(=O)O)C2 CS-M1566 [0,0,0,1,0,1|1,0,1]=4
23  B16R2.7486  COC1=CC2=CC=C(C(=O)O)N=C2C=C1 CS-0037186 [0,1,0,1,0,0|2,0,0]=4
24  B12R1.20  O=C(O)C(=O)C1=CC=C(Cl)C=C1 CS-0038382 [1,0,0,0,1,0|1,0,0]=3
25  B12R1.20  O=C(O)C(=O)C1=CC=C(F)C=C1 CS-0102796 [1,0,0,0,1,0|1,0,0]=3
26  B14R1.75  COC1=CC(C[C@H](N)C(=O)O)=CC=C1 CS-0030798 [0,0,0,0,1,1|1,0,1]=4