0  B14R1.3152  CC1=CC(=C(C(=C1)C)OCC(=O)O)C S236055 [0,0,0,0,0,0|3,0,1]=4
1  B13R1.164  CC1=CC(=CC=C1OCC(=O)N)Cl R631132 [1,0,0,0,0,0|2,0,1]=4
2  B13R1.1601  C#CCOC1=C(C=C(C=C1C)C)C CDS024027 [1,0,0,0,0,0|1,0,2]=4
3  B13R1.1601  CC1=CC(=CC(=C1OCC#N)C)Br OTV000127 [1,0,0,0,0,0|1,0,2]=4
4  B13R1.3787  CC1=CC=CC(=C1OCC(=O)O)C S947865 [1,0,0,0,0,0|2,0,1]=4
5  B15R1.38791  CC1=CC(=C(C(=C1)C)OCC(O)CCl)C S377546 [0,1,0,0,0,0|2,0,0]=3
6  B15R1.38791  CC1=CC(=C(C(=C1)C)OCC(O)CO)C S377333 [0,1,0,0,0,0|2,0,0]=3
7  B13R1.2808  CC(=O)OC1=C(C=C(C=C1C)Br)C OTV000040 [0,0,0,0,1,0|2,0,1]=4
8  B12R1.21  CC(C)CCC1=CC=C(C=C1)O S511803 [2,0,0,0,0,0|2,0,0]=4
9  B12R1.21  CC(C)COC1=CC=C(C=C1)N CDS008265 [2,0,0,0,0,0|2,0,0]=4
10  B12R1.21  CC1=CC=C(C=C1)OCC(C)O PH015463 [2,0,0,0,0,0|2,0,0]=4
11  B12R1.69  CC1=CC(=C(C=C1)OCCN)Br R414468 [2,0,0,0,0,0|2,0,0]=4
12  B12R1.69  CC1=CC(=C(C=C1)OCCN)C R414352 [2,0,0,0,0,0|1,0,0]=3
13  B12R1.125  CC(O)COC1=CC=CC=C1Cl PH006972 [2,0,0,0,0,0|2,0,0]=4
14  B12R1.125  CC1=C(C=CC=C1)OCC(=S)N OTV000238 [2,0,0,0,0,0|1,0,1]=4
15  B12R1.125  CC1=C(C=CC=C1)OCC(C)O PH016252 [2,0,0,0,0,0|1,0,0]=3
16  B12R1.125  CC1=CC=CC=C1OCC(=O)N R715522 [2,0,0,0,0,0|1,0,1]=4
17  B12R1.1631  CC1=CC=CC(=C1NCCN)C PH002687 [2,0,0,0,0,0|1,0,0]=3
18  B12R1.1631  CC1=CC=CC(=C1OCC#N)C PH000526 [2,0,0,0,0,0|0,0,2]=4
19  B12R1.1631  CC1=CC=CC(=C1OCCN)C OTV000226 [2,0,0,0,0,0|0,0,0]=2
20  B12R1.1631  CC1=CC=CC(=C1OCCN)C R414344 [2,0,0,0,0,0|0,0,0]=2
21  B14R1.18811  CCOC(=O)C1=C(C=C(C=C1C)O)C S873845 [1,1,0,0,0,0|2,0,0]=4
22  B14R1.5971  CC1=CC=CC(=C1NC(=O)[C@H](C)N)C PH017244 [1,1,0,0,0,0|1,0,1]=4
23  B14R1.19598  CC1=C(C(=CC=C1)Cl)OCC(O)CO S752053 [1,1,0,0,0,0|2,0,0]=4
24  B12R1.1009  CC(=O)OC1=C(C=CC=C1C)C S240354 [1,0,0,0,1,0|1,0,1]=4
25  B12R1.1000  CC(=O)C1=C(C=C(C=C1C)O)C S991066 [0,0,0,0,2,0|1,0,1]=4