0  B14R1.60  CCOC(=O)C(=O)NC1=NC=CC=C1 BBL034202 [0,0,0,0,0,0|2,0,2]=4
1  B13R1.42  CCOC(=O)CCC1=CC=CC=C1 BBL035649 [1,0,0,0,0,0|0,0,0]=1
2  B13R1.42  CNCC(=O)NCC1=CC=CC=C1 BBL029662 [1,0,0,0,0,0|3,0,0]=4
3  B13R1.42  NCCC(=O)NCC1=CC=CC=C1 BBL011279 [1,0,0,0,0,0|3,0,0]=4
4  B13R1.135  CNC(=O)[C@@H](N)CC1=CC=CC=C1 BBL011269 [1,0,0,0,0,0|2,0,0]=3
5  B13R1.135  COC(=O)C(N)CC1=CC=CC=C1 BBL009783 [1,0,0,0,0,0|1,0,0]=2
6  B15R1.48  CCOC(=O)C(=O)NC1=CC=C(C)C=C1 BBL003956 [0,1,0,0,0,0|1,0,2]=4
7  B15R1.48  CCOC(=O)[C@@H](N)CC1=CC=C(O)C=C1 BBL009720 [0,1,0,0,0,0|1,0,0]=2
8  B15R1.640  CCOC(=O)\C(C#N)=C\C1=CC=CC=C1 BBL002782 [0,1,0,0,0,0|1,0,2]=4
9  B15R1.3960  CCOC(=O)C(C)OC1=CC=CC=C1Br BBL038595 [0,1,0,0,0,0|2,0,0]=3
10  B15R1.3960  CCOC(=O)C(C)OC1=CC=CC=C1Cl BBL039606 [0,1,0,0,0,0|2,0,0]=3
11  B15R1.3960  CCOC(=O)C(N)CC1=CC=CC=C1F BBL020647 [0,1,0,0,0,0|1,0,0]=2
12  B15R2.325  O=C1CC(CC2=CC=CC=C2)C(=O)O1 BBL000780 [0,0,0,1,0,0|2,0,1]=4
13  B15R2.1342  CCOC(=O)C1CC1C2=CC=CC=C2 BBL028661 [0,0,0,1,0,0|1,0,0]=2
14  B15R1.826  CCOC(=O)C(=O)NCC1=CC=NC=C1 BBL034203 [0,0,0,0,0,1|1,0,2]=4
15  B12R1.27  COC(=O)CNC1=CC=CC=C1 BBL034685 [2,0,0,0,0,0|1,0,0]=3
16  B12R1.27  NNC(=O)CCC1=CC=CC=C1 BBL015565 [2,0,0,0,0,0|2,0,0]=4
17  B12R1.27  O=C(CCl)OCC1=CC=CC=C1 BBL034736 [2,0,0,0,0,0|2,0,0]=4
18  B12R1.43  CC(OC1=CC=CC=C1)C(=O)O BBL002385 [2,0,0,0,0,0|2,0,0]=4
19  B12R1.43  NC(=O)C(N)CC1=CC=CC=C1 BBL013314 [2,0,0,0,0,0|2,0,0]=4
20  B12R1.43  NC(CC1=CN=CC=C1)C(=O)O BBL036665 [2,0,0,0,0,0|2,0,0]=4
21  B14R1.29  CCOC(=O)CC(=O)C1=CC=CC=C1 BBL027743 [1,1,0,0,0,0|0,0,1]=3
22  B14R1.32  CCOC(=O)COC1=CC=CC(Br)=C1 BBL025626 [1,1,0,0,0,0|1,0,0]=3
23  B16R1.912  CCOC(=O)C(=O)CC(=O)C1=CC=CC=C1 BBL029524 [0,1,0,0,0,1|0,0,2]=4
24  B16R1.971  CCOC(=O)C(CC1=CC=CC=C1)N=C=S BBL030946 [0,2,0,0,0,0|0,1,0]=3
25  B16R1.13650  CCOC(=O)C(CC1=CC=CC=C1)C(C)=O BBL011458 [0,2,0,0,0,0|0,0,1]=3
26  B14R2.972  CNC(=O)[C@@H]1CC2=CC=CC=C2N1 BBL011132 [1,0,0,1,0,0|2,0,0]=4
27  B14R2.972  COC(=O)C1=CC2=C(C=CC=C2)O1 BBL036219 [1,0,0,1,0,0|0,0,2]=4
28  B14R2.19306  CCN1C(=O)C(N)C2=CC=CC=C21 BBL031695 [0,0,0,1,1,0|2,0,0]=4
29  B16R2.723  CCOC(=O)C1CC1C2=CC=C(C)C=C2 BBL038616 [0,1,0,1,0,0|1,0,0]=3
30  B16R2.723  CCOC(=O)C1CC1C2=CC=C(Cl)C=C2 BBL039238 [0,1,0,1,0,0|1,0,0]=3
31  B16R2.757  CCOC(=O)C1=C(N)C2=CC=CC=C2O1 BBL004238 [0,1,0,1,0,0|0,0,2]=4
32  B12R1.34  COC(=O)C(O)C1=CC=CC=C1 BBL027464 [1,0,0,0,1,0|0,0,0]=2
33  B14R1.520  CNCC(=O)NCCC1=CC=CC=C1 BBL011307 [1,0,0,0,0,1|2,0,0]=4
34  B14R1.520  NCCC(=O)NCCC1=CC=CC=C1 BBL011171 [1,0,0,0,0,1|2,0,0]=4