0  B13R2.4825  CC1C(=O)NC2=C1C=CC=C2Br CS-0055872 [0,0,0,0,0,0|3,0,0]=3
1  B12R2.18  CN1C(=O)NC2=C1C=NC=C2 CS-0086207 [1,0,0,0,0,0|2,0,0]=3
2  B12R2.18  CN1C(=O)NC2=NC=CC=C21 CS-0086354 [1,0,0,0,0,0|2,0,0]=3
3  B12R2.196  CC1=CNC2=C(Br)C=CC=C12 CS-0093897 [1,0,0,0,0,0|3,0,0]=4
4  B12R2.202  CC1=C2N=C(Br)SC2=CC=C1 CS-0103390 [1,0,0,0,0,0|2,0,1]=4
5  B12R2.202  CC1=CC2=C(C=CC=C2O)N1 CS-W008342 [1,0,0,0,0,0|3,0,0]=4
6  B12R2.202  O=C1CC2=C(Cl)C=CN=C2N1 CS-0004789 [1,0,0,0,0,0|3,0,0]=4
7  B12R2.202  O=C1CC2=C(F)C=CC=C2N1 CS-0032315 [1,0,0,0,0,0|2,0,0]=3
8  B12R2.202  O=C1CC2=CC=CC(Br)=C2C1 CS-0051004 [1,0,0,0,0,0|3,0,0]=4
9  B12R2.202  O=C1NC2=CC=CC(Cl)=C2S1 CS-0043170 [1,0,0,0,0,0|2,0,0]=3
10  B12R2.202  S=C1NC2=CC=CC(Cl)=C2O1 CS-0064118 [1,0,0,0,0,0|2,1,0]=4
11  B14R2.9184  O=C1NC2=C(C=C(F)C=C2Cl)C1=O CS-0103497 [0,1,0,0,0,0|2,0,1]=4
12  B14R2.8045  CC1=C2NC(=O)OC(=O)C2=CC=C1 CS-0034436 [0,0,0,0,0,1|1,0,1]=3
13  B14R2.8045  O=C1NC(=O)C2=C(N1)C(I)=CC=C2 CS-0039073 [0,0,0,0,0,1|2,0,1]=4
14  B14R2.28472  O=C1NC2=C(Br)C=CC=C2C=C1F CS-0068200 [0,0,0,0,0,1|3,0,0]=4
15  B11R1.159  NC1=C(Br)C=CC=C1C(=O)O CS-B0777 [1,0,1,0,0,0|2,0,0]=4
16  B11R1.159  NC1=C(I)C=CC=C1C(=O)O CS-0030571 [1,0,1,0,0,0|2,0,0]=4
17  B11R1.36  NC(=O)[C@@H](N)C1=CC=CC=C1 CS-W021161 [1,0,1,0,0,0|2,0,0]=4
18  B11R1.157  N=C(N)NC1=CC(Cl)=CC=C1 CS-M0494 [1,0,1,0,0,0|2,0,0]=4
19  B11R2.10  O=C1NC2=C(C=NC=C2)N1 CS-W021327 [2,0,0,0,0,0|1,0,0]=3
20  B11R2.10  OC1=NC2=CC=CC=C2N1 CS-W008003 [2,0,0,0,0,0|0,0,2]=4
21  B11R2.106  BrC1=C2NC=NC2=CC=C1 CS-W004724 [2,0,0,0,0,0|1,0,1]=4
22  B11R2.106  CC1=C2NC=NC2=CC=C1 CS-0012653 [2,0,0,0,0,0|0,0,1]=3
23  B11R2.106  OC1=C2N=CNC2=CC=C1 CS-0035564 [2,0,0,0,0,0|1,0,1]=4
24  B13R1.91  COC(=O)NC1=CC=CC=C1CO CS-0038874 [0,1,1,0,0,0|2,0,0]=4
25  B13R2.45  CC1=C(C=O)NC2=C1C=CC=C2 CS-0041558 [1,1,0,0,0,0|2,0,0]=4
26  B13R2.3028  CC1C(=O)NC2=CC=C(Br)C=C21 CS-0036961 [1,1,0,0,0,0|2,0,0]=4
27  B13R2.3085  CN1C(=O)C(=O)C2=C1C=CC=C2 CS-0045288 [1,1,0,0,0,0|1,0,1]=4
28  B13R2.4856  O=C1NC2=C(C1=O)C(Cl)=CC=C2 CS-W002403 [1,1,0,0,0,0|1,0,1]=4
29  B13R2.5190  CC1C(=O)NC2=CC(Br)=CC=C21 CS-0037724 [1,1,0,0,0,0|2,0,0]=4
30  B13R2.5190  CN1C(=O)CC2=CC(O)=CC=C21 CS-0036169 [1,1,0,0,0,0|2,0,0]=4
31  B13R2.5190  O=C1NC2=C(C=CC(I)=C2)C1=O CS-0037862 [1,1,0,0,0,0|1,0,1]=4
32  B13R2.581  COC1=C2NC(=O)SC2=CC=C1 CS-0019318 [1,1,0,0,0,0|1,0,0]=3
33  B13R2.32  CN1C(=O)C=CC2=CC=CC=C21 CS-W023164 [1,0,0,0,0,1|2,0,0]=4
34  B13R2.328  O=C1C=C(Cl)C2=C(C=CC=C2)N1 CS-0097773 [1,0,0,0,0,1|2,0,0]=4
35  B13R2.328  O=C1C=C(O)C2=C(C=CC=C2)N1 CS-W020079 [1,0,0,0,0,1|1,0,0]=3