0  B13R1.42  N#CCC(=O)NCC1=CC=CC=C1 B028851 [0,0,0,0,0,0|3,0,1]=4
1  B12R1.27  NNC(=O)CNC1=CC=CC=C1 B003339 [1,0,0,0,0,0|3,0,0]=4
2  B14R1.32  CCOC(=O)COC1=CC(Cl)=CC=C1 B047305 [0,1,0,0,0,0|1,0,0]=2
3  B14R1.502  CCOC(=O)COC1=CC=C(I)C=C1 B047307 [0,1,0,0,0,0|1,0,0]=2
4  B14R1.818  CC(=O)CC(=O)NCC1=CC=CC=C1 B048565 [0,1,0,0,0,0|2,0,1]=4
5  B14R2.30  O=C1CCCN1CC2=CC=CC=C2 B038512 [0,0,0,1,0,0|2,0,0]=3
6  B12R1.51  CCOC(=O)CCN1C=CC=N1 B035727 [0,0,0,0,1,0|2,0,0]=3
7  B12R1.51  CCOC(=O)\C=C\C1=CC=CO1 B048511 [0,0,0,0,1,0|1,0,2]=4
8  B14R1.520  N#CCC(=O)NCCC1=CC=CC=C1 B028862 [0,0,0,0,0,1|2,0,1]=4
9  B11R1.91  O=C(O)CCC1=NC=CC=C1 B039507 [2,0,0,0,0,0|1,0,0]=3
10  B11R1.91  O=C(O)CNC1=CC=CC=C1 B003332 [2,0,0,0,0,0|1,0,0]=3
11  B11R1.91  O=C(O)CSC1=NC=CC=C1 B003349 [2,0,0,0,0,0|2,0,0]=4
12  B13R1.14  COC(=O)CCC1=CC=C(Cl)C=C1 B050273 [1,1,0,0,0,0|0,0,0]=2
13  B13R1.33  CCOC(=O)CC(C)N1C=CC=N1 B058993 [0,1,0,0,1,0|2,0,0]=4
14  B13R1.41  CCOC(=O)CCN1C=C(I)C=N1 B050918 [0,1,0,0,1,0|2,0,0]=4
15  B13R1.41  CCOC(=O)CCN1C=CC(C)=N1 B035735 [0,1,0,0,1,0|2,0,0]=4
16  B13R1.444  CCOC(=O)CCN1N=CC=C1C B035736 [0,1,0,0,1,0|2,0,0]=4
17  B15R1.23  CCOC(=O)CC(N)C1=CC=C(C)C=C1 B048640 [0,2,0,0,0,0|0,0,0]=2
18  B15R1.24  CCOC(=O)CC(N)C1=CC(O)=CC=C1 B048642 [0,2,0,0,0,0|0,0,0]=2
19  B15R1.3722  CCOC(=O)CC(N)C1=CC=CC=C1Cl B048641 [0,2,0,0,0,0|0,0,0]=2
20  B15R1.48  CCOC(=O)C(N)CC1=CC=C(O)C=C1 B047281 [0,2,0,0,0,0|0,0,0]=2
21  B15R1.3960  CCOC(=O)C(C)OC1=CC=CC=C1Br B006656 [0,2,0,0,0,0|1,0,0]=3
22  B15R1.3960  CCOC(=O)C(C)OC1=CC=CC=C1Cl B006640 [0,2,0,0,0,0|1,0,0]=3
23  B15R1.768  CCOC(=O)COC1=CC=CC=C1C=O B005821 [0,2,0,0,0,0|1,0,0]=3
24  B15R1.36731  CCOC(=O)COC1=C(Cl)C=CC=C1Cl B006643 [0,2,0,0,0,0|1,0,0]=3
25  B13R2.3  C1=CC=C(C2CCNCC2)C=C1 B050481 [1,0,0,1,0,0|1,0,1]=4