0  B12R1.32  CCOC(=O)NC1=NC=CC=C1 374623 [0,0,0,0,0,0|3,0,0]=3
1  B11R1.28  CCCSCC1=CC=CC=C1 094802 [1,0,0,0,0,0|2,0,0]=3
2  B11R1.28  COCCOC1=CC=CC=C1 336003 [1,0,0,0,0,0|1,0,1]=3
3  B11R1.40  CCC(C)SC1=CC=CC=C1 094611 [1,0,0,0,0,0|1,1,1]=4
4  B11R1.40  CC[C@H](N)CC1=CC=CC=C1 048350 [1,0,0,0,0,0|2,0,1]=4
5  B13R1.19  CCOC(=O)NC1=NC=C(C)C=C1 180469 [0,1,0,0,0,0|3,0,0]=4
6  B13R1.20  CCOC(=O)CC1=CC=CC(F)=C1 241884 [0,1,0,0,0,0|2,0,0]=3
7  B13R1.20  CCOC(=O)NC1=NC(C)=CC=C1 180468 [0,1,0,0,0,0|3,0,0]=4
8  B13R1.348  O=C(O)CC(=O)NC1=CC=CC=C1 401619 [0,1,0,0,0,0|2,0,1]=4
9  B13R1.470  O=C(CCCl)NC1=C(O)C=CC=C1 180712 [0,1,0,0,0,0|2,0,0]=3
10  B11R1.16  C=C(CCO)C1=CC=NC=C1 180182 [0,0,0,0,1,0|3,0,0]=4
11  B11R1.16  CCCC(C)C1=NC=CC=C1 102203 [0,0,0,0,1,0|2,0,1]=4
12  B13R1.42  CCCC(C)SCC1=CC=CC=C1 094720 [0,0,0,0,0,1|1,1,1]=4
13  B10R1.17  CCCCC1=CC=CC=N1 180367 [2,0,0,0,0,0|1,0,1]=4
14  B10R1.17  NCCOC1=CN=CC=C1 044845 [2,0,0,0,0,0|2,0,0]=4
15  B12R1.1  CCCCOC1=CC=C(Br)C=C1 080308 [1,1,0,0,0,0|0,0,1]=3
16  B12R1.1  CCCNCC1=CC=C(C)C=C1 523051 [1,1,0,0,0,0|2,0,0]=4
17  B12R1.27  CCC(C)SCC1=CC=CC=C1 094712 [1,1,0,0,0,0|2,0,0]=4
18  B12R1.267  CCCNCC1=CC=CC=C1C 042936 [1,1,0,0,0,0|2,0,0]=4
19  B12R1.43  CC(C)C(=O)OC1=CC=CC=C1 105181 [1,1,0,0,0,0|0,0,0]=2
20  B12R1.43  CC(C)C(=O)SC1=CC=CC=C1 180471 [1,1,0,0,0,0|0,1,0]=3
21  B12R1.43  CN(O)C(=O)NC1=CC=CC=C1 024109 [1,1,0,0,0,0|2,0,0]=4
22  B12R1.49  CNC(=O)CC1=CC=C(F)C=C1 102257 [1,1,0,0,0,0|2,0,0]=4
23  B12R1.50  CCC(C)OC1=CC=CC(Br)=C1 097851 [1,1,0,0,0,0|1,0,1]=4
24  B12R1.50  CNC(=O)CC1=CC(Cl)=CC=C1 105123 [1,1,0,0,0,0|2,0,0]=4
25  B12R1.371  CNC(=O)CC1=C(Cl)C=CC=C1 505690 [1,1,0,0,0,0|2,0,0]=4
26  B12R1.16  N#CCC(=O)C1=CC=C(F)C=C1 022389 [0,1,0,0,1,0|1,0,1]=4
27  B12R1.308  N#CCC(=O)C1=CC=CC=C1Cl 079248 [0,1,0,0,1,0|1,0,1]=4
28  B14R1.598  CCOC(=O)CSC1=C(Cl)C=CC=C1 094609 [0,1,0,0,0,1|1,1,0]=4
29  B14R1.818  CC(Cl)OC(=O)OCC1=CC=CC=C1 098785 [0,1,0,0,0,1|1,0,0]=3
30  B14R1.6823  CCOC(=O)CC1=C(Br)C=C(F)C=C1 094489 [0,2,0,0,0,0|2,0,0]=4
31  B14R1.6823  CCOC(=O)CC1=C(Cl)C=C(Cl)C=C1 017446 [0,2,0,0,0,0|2,0,0]=4
32  B14R1.36  CCOC(=O)C(=O)C1=CC(Cl)=CC=C1 023000 [0,2,0,0,0,0|2,0,0]=4
33  B14R1.158  COCCNC(=S)NC1=CC=CC=C1 224856 [0,2,0,0,0,0|1,1,0]=4
34  B14R1.3348  CCOC(=O)C(=O)C1=CC=CC=C1F 043388 [0,2,0,0,0,0|2,0,0]=4
35  B12R2.41  C1=CC=C2CNCCCC2=C1 078034 [1,0,0,1,0,0|2,0,0]=4
36  B12R2.1081  CC1CCNC2=C1C=CC=C2 320047 [1,0,0,1,0,0|1,0,1]=4
37  B12R2.32  CNC1=NC2=C(C=CC=C2)O1 050608 [1,0,0,1,0,0|2,0,0]=4